A0A087Y6G4_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087Y6G4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 806 aa.

						>A0A087Y6G4_POEFO|A0A087Y6G4
MVIMTDTSRAAQPSPAQGRPLQVGFYEIIRTLGKGNFAVVKLAKHKVTKTQVAIKIIDKTRLSPSNLEKIYREVQIMKLLNHPHIIKLYQVMETKDMLYIVTEYAKNGEMFDHLTSNGRMSEDEARKKFWQILTAVDYCHRHHIVHRDLKTENLLLDANMNIKLADFGFGNFYNAGEPLSTWCGSPPYAAPEVFEGKEYEGPQLDIWSLGVVLYVLVCGSLPFDAPSLPALRQRVTEGRFRIPFFMSQDCENLIRKMLVVDPAKRISVAQIKQHRWMLADPSAAHQTLSHSLTEYNSNLGDYSEPVLGIMNTLGIDRQRTIESLQSSSYNHFSAIYYLLLERVREHRAQQLSRQCGTWSQRPRSTSDSTGPEVIMESSESFRATPFSLPSKNTPPVYSEVECDQGGLFQRVVFPVEASLNRLLWNRSISPNSLLETSISEEVRPRDLEEEEATQSLGPLLPPTTSRRHTLAEVSARFHQCNPPCIVVSPSDGASSDSCLKSSCSPAPTLQSAVGEMSTLLASRAEGGAGLPAGAPLALSSHLVPQTQSSLPAVSFQEGRRASDTSLTQGLKAFRQQLRKNTRTKGLLGLNKIKGLTRQAVPPPTSNRGSRGSLGPAFSEHRSMLEEVLHQQRMLQIQHQPQPQVQAPQTGPTQNPLLFLAQQQSPSPPPTSTFSPSSIFDAPAVQPALPPPPPPAQQPTPTGFWRQTLETSSFSGCSSSTSSCYSSSLSPVASAAYLLEARLHISQQPQPLPFAVLQQPQSAAQVPFPVQSKLAMWSMGPASGADAGMQELGLAGQQQLGSCVMVK
					

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	38.3	Very low	33.4	Very low	248 Å²	248	151.7 Å²	151.7	100%	1.222	85%	0.849	S	S	*	*				0	121.6	0	-162	166	-178	0	0	106.4
2	V	27.3	Very low	33.3	Very low	146 Å²	146	154 Å²	154	89%	0.885	85%	0.848	S	S	*	*			trans	-106.1	151.3	-165	-179.6	0	0	0	0	110.8
3	I	41.3	Very low	33.6	Very low	151 Å²	151	150.9 Å²	150.9	77%	0.774	84%	0.84	S	S	*	*			trans	-73.3	137.7	-173.1	-57.8	165.4	0	0	0	111.5
4	M	26.7	Very low	33.8	Very low	188 Å²	188	147.5 Å²	147.5	93%	0.926	83%	0.831	S	S	*	*			trans	-143	173	151.2	-80.3	-151.9	164.7	0	0	110.4
5	T	37.2	Very low	34.2	Very low	117 Å²	117	145.7 Å²	145.7	72%	0.718	83%	0.828	S	S	*	*			trans	-110.4	-169.8	-153.3	54.1	0	0	0	0	115.1
6	D	30.3	Very low	34.6	Very low	141 Å²	141	143.1 Å²	143.1	75%	0.754	83%	0.83	S	S	*	*			trans	83.2	151.8	170.1	-52.5	-11.5	0	0	0	115.2
7	T	31.9	Very low	35.3	Very low	122 Å²	122	145.9 Å²	145.9	75%	0.748	83%	0.833	S	S	*	*			cis	-139.4	159	12.1	-24.9	0	0	0	0	113.3
8	S	31.7	Very low	36.4	Very low	110 Å²	110	141.6 Å²	141.6	77%	0.769	83%	0.826	S	S	*	*			trans	13	133.6	157.2	58.2	0	0	0	0	121.8
9	R	33.8	Very low	37.8	Very low	254 Å²	254	146.6 Å²	146.6	96%	0.958	83%	0.83	S	S	*	*			trans	-128.2	106.8	152.5	-151	174	-165.5	176	4.7	109.2
10	A	33.5	Very low	39.4	Very low	95 Å²	95	143.3 Å²	143.3	79%	0.785	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.4	146.5	-172.7	0	0	0	0	0	112.7
11	A	35.3	Very low	41.6	Very low	97 Å²	97	139.7 Å²	139.7	80%	0.802	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.1	138.3	175.2	0	0	0	0	0	111.2
12	Q	32.8	Very low	44.1	Very low	179 Å²	179	130.5 Å²	130.5	84%	0.836	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-70	132.6	170.6	-74.6	-74.4	-23.3	0	0	109.9	S14	Q12-S14 PolarHBondContact O-N 3.32Å
13	P	36.5	Very low	47.1	Very low	114 Å²	114	123.8 Å²	123.8	74%	0.74	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-68.8	127.7	173.4	28.7	-32.7	0	0	0	110
14	S	36.3	Very low	49.4	Very low	103 Å²	103	117.4 Å²	117.4	72%	0.72	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-62.6	142.6	169.9	53	0	0	0	0	110.5	Q12 A16	Q12-S14 PolarHBondContact O-N 3.32Å; S14-A16 PolarHBondContact O-N 3.26Å
15	P	40.1	Very low	52.6	Low	121 Å²	121	109.3 Å²	109.3	79%	0.786	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-58.1	130.5	176.2	25.3	-34.1	0	0	0	110.1	Q17	P15-Q17 PolarHBondContact O-N 3.39Å
16	A	40.4	Very low	55.5	Low	103 Å²	103	103.7 Å²	103.7	85%	0.851	60%	0.603	S	S	*	*			trans	-64.1	111.2	-178.5	0	0	0	0	0	109.9	S14 G18	S14-A16 PolarHBondContact O-N 3.26Å; A16-G18 PolarHBondContact O-N 3.31Å
17	Q	47.4	Very low	58.6	Low	191 Å²	191	99.6 Å²	99.6	89%	0.893	58%	0.579	S	S	*	*			trans	-67.3	102.6	170.2	-69.8	-176.7	-9.2	0	0	108.2	P15 R19	P15-Q17 PolarHBondContact O-N 3.39Å; Q17-R19 PolarHBondContact O-N 2.96Å
18	G	53.8	Low	61.7	Low	68 Å²	68	94.9 Å²	94.9	70%	0.701	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-52.1	130.6	173.6	0	0	0	0	0	110	A16	A16-G18 PolarHBondContact O-N 3.31Å
19	R	63	Low	64.8	Low	237 Å²	237	93.9 Å²	93.9	89%	0.894	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-60.6	126.9	177	-70.8	-178.7	176.4	178.3	-0	107.8	Q17 L21	Q17-R19 PolarHBondContact O-N 2.96Å; R19-L21 PolarHBondContact O-N 3.12Å
20	P	70.1	Confident	67.7	Low	80 Å²	80	87.7 Å²	87.7	52%	0.519	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-59.8	130.2	-177.6	23.2	-32.8	0	0	0	109.7	Q22	P20-Q22 WeakPolarHBondContact O-CG 3.49Å; P20-Q22 PolarHBondContact O-N 3.32Å; P20-Q22 PolarHBondContact O-NE2 3.47Å
21	L	85.8	Confident	70.6	Confident	68 Å²	68	85.4 Å²	85.4	36%	0.356	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-52.4	127.2	-177.9	-176.6	67.3	0	0	0	110	R19 I28 V442 L447	R19-L21 PolarHBondContact O-N 3.12Å; L21-I28 HydrophobicContact CB-CB 4.18Å; L21-I28 HydrophobicContact CB-CG1 4.44Å; L21-I28 HydrophobicContact CD2-CB 4.27Å; L21-I28 HydrophobicContact CD2-CG1 4.27Å; L21-I28 HydrophobicContact CD2-CG2 4.2Å; L21-I28 HydrophobicContact CG-CB 4.27Å; L21-I28 HydrophobicContact CG-CG1 4.08Å; L21-I28 WeakPolarHBondContact O-CB 3.12Å; L21-I28 WeakPolarHBondContact O-CG1 3.48Å; L21-I28 PolarHBondContact O-N 3.39Å; L21-V442 HydrophobicContact CD1-CG1 4.05Å; L21-V442 HydrophobicContact CD1-CG2 3.68Å; L21-L447 HydrophobicContact CD2-CD2 3.99Å
22	Q	90.1	Very high	73.3	Confident	55 Å²	55	83.8 Å²	83.8	26%	0.257	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.1	-171.6	-86.5	160.9	90.6	0	0	111.6	P20 Y26 E27	P20-Q22 WeakPolarHBondContact O-CG 3.49Å; P20-Q22 PolarHBondContact O-N 3.32Å; P20-Q22 PolarHBondContact O-NE2 3.47Å; Q22-Y26 VanDerWaalsContact CA-O 3.29Å; Q22-Y26 WeakPolarHBondContact CA-O 3.43Å; Q22-E27 HydrophobicContact CG-CG 4.33Å
23	V	90.5	Very high	76	Confident	5 Å²	5	76.8 Å²	76.8	3%	0.03	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	104.5	170.8	-178.4	0	0	0	0	106.9	F25 Y26 I28 M92 Y99	V23-F25 PolarHBondContact O-N 3.02Å; V23-Y26 PolarHBondContact N-O 3.1Å; V23-Y26 WeakPolarHBondContact O-CD2 3.43Å; V23-Y26 PolarHBondContact O-N 3.18Å; V23-I28 HydrophobicContact CG2-CD1 4.18Å; V23-I28 HydrophobicContact CG2-CG1 4.39Å; V23-M92 HydrophobicContact CG1-CE 3.65Å; V23-M92 HydrophobicContact CG1-SD 4.48Å; V23-Y99 HydrophobicContact CB-CE1 4.48Å; V23-Y99 HydrophobicContact CG1-CD1 3.66Å; V23-Y99 HydrophobicContact CG1-CD2 4.46Å; V23-Y99 HydrophobicContact CG1-CE1 3.69Å; V23-Y99 HydrophobicContact CG1-CE2 4.49Å; V23-Y99 HydrophobicContact CG1-CG 4.08Å; V23-Y99 HydrophobicContact CG2-CD1 4.37Å; V23-Y99 HydrophobicContact CG2-CE1 3.93Å
24	G	90.4	Very high	78.5	Confident	17 Å²	17	78 Å²	78	18%	0.175	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	-120.2	-173.6	0	0	0	0	0	112.3	Y26	G24-Y26 VanDerWaalsContact C-N 3.26Å; G24-Y26 PolarHBondContact O-N 2.99Å
25	F	93.5	Very high	80.5	Confident	18 Å²	18	75 Å²	75	8%	0.079	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	12.9	179.6	-69	-72.9	0	0	0	115.3	V23 H45 K46 H331 L433 L434	V23-F25 PolarHBondContact O-N 3.02Å; F25-H45 CarbonylContact O-C 3.6Å; F25-H45 PolarHBondContact O-CD2 3.5Å; F25-H45 VanDerWaalsContact O-CD2 3.27Å; F25-K46 WeakPolarHBondContact O-CB 3.49Å; F25-K46 VanDerWaalsContact O-CG 3.28Å; F25-K46 WeakPolarHBondContact O-CG 3.29Å; F25-K46 PolarHBondContact O-N 3.15Å; F25-H331 HydrophobicContact CD2-CB 3.8Å; F25-H331 HydrophobicContact CE2-CB 3.78Å; F25-H331 AromaticContact CE2-CG 3.82Å; F25-L433 WeakPolarHBondContact CE1-O 3.48Å; F25-L433 WeakPolarHBondContact CZ-O 3.36Å; F25-L434 HydrophobicContact CZ-CD2 4.04Å
26	Y	97.4	Very high	82.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.8	-173.6	-54.7	-83.1	0	0	0	112.7	Q22 V23 G24 K44 H45 V52 I54 Q90 M92 V101 L338	Q22-Y26 VanDerWaalsContact CA-O 3.29Å; Q22-Y26 WeakPolarHBondContact CA-O 3.43Å; V23-Y26 PolarHBondContact N-O 3.1Å; V23-Y26 WeakPolarHBondContact O-CD2 3.43Å; V23-Y26 PolarHBondContact O-N 3.18Å; G24-Y26 VanDerWaalsContact C-N 3.26Å; G24-Y26 PolarHBondContact O-N 2.99Å; Y26-K44 WeakPolarHBondContact CA-O 3.49Å; Y26-H45 HydrophobicContact CD1-CB 3.85Å; Y26-H45 HydrophobicContact CE1-CB 3.72Å; Y26-H45 AromaticContact CE1-CD2 3.6Å; Y26-H45 AromaticContact CE1-CG 3.89Å; Y26-H45 AromaticContact CZ-CD2 3.96Å; Y26-V52 HydrophobicContact CD1-CG2 3.59Å; Y26-V52 HydrophobicContact CE1-CG1 4.47Å; Y26-V52 HydrophobicContact CE1-CG2 3.84Å; Y26-I54 HydrophobicContact CD1-CD1 4.33Å; Y26-I54 HydrophobicContact CD2-CD1 4.18Å; Y26-I54 HydrophobicContact CG-CD1 3.8Å; Y26-Q90 VanDerWaalsContact CE2-OE1 3.26Å; Y26-Q90 PolarHBondContact OH-OE1 3.13Å; Y26-M92 HydrophobicContact CD2-CE 3.98Å; Y26-M92 HydrophobicContact CE2-CE 4.03Å; Y26-M92 HydrophobicContact CE2-SD 4.27Å; Y26-V101 HydrophobicContact CD1-CG1 4.46Å; Y26-V101 HydrophobicContact CD2-CG2 4.45Å; Y26-V101 HydrophobicContact CE1-CG1 3.82Å; Y26-V101 HydrophobicContact CE2-CG1 4.39Å; Y26-V101 HydrophobicContact CE2-CG2 4Å; Y26-L338 HydrophobicContact CE1-CD1 4.48Å
27	E	96.9	Very high	84.2	Confident	55 Å²	55	70.3 Å²	70.3	26%	0.257	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.2	167.7	-69.5	156.2	-169	0	0	108.3	Q22 A43 K44 K46 K49	Q22-E27 HydrophobicContact CG-CG 4.33Å; E27-A43 CarbonylContact O-C 3.58Å; E27-A43 VanDerWaalsContact O-CA 3.23Å; E27-A43 WeakPolarHBondContact O-CA 3.41Å; E27-A43 WeakPolarHBondContact O-CB 3.28Å; E27-K44 PolarHBondContact N-O 3.24Å; E27-K44 PolarHBondContact O-N 3.34Å; E27-K46 HydrophobicContact CG-CD 4.28Å; E27-K46 HydrophobicContact CG-CG 3.75Å; E27-K46 WeakPolarHBondContact OE1-CG 3.43Å; E27-K49 IonicContact OE1-NZ 3.43Å; E27-K49 PolarHBondContact OE1-NZ 3.07Å
28	I	96.5	Very high	86.2	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.118	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	133.2	178.8	-56.1	-57.4	0	0	0	109.6	L21 V23 K41 A43 I54	L21-I28 HydrophobicContact CB-CB 4.18Å; L21-I28 HydrophobicContact CB-CG1 4.44Å; L21-I28 HydrophobicContact CD2-CB 4.27Å; L21-I28 HydrophobicContact CD2-CG1 4.27Å; L21-I28 HydrophobicContact CD2-CG2 4.2Å; L21-I28 HydrophobicContact CG-CB 4.27Å; L21-I28 HydrophobicContact CG-CG1 4.08Å; L21-I28 WeakPolarHBondContact O-CB 3.12Å; L21-I28 WeakPolarHBondContact O-CG1 3.48Å; L21-I28 PolarHBondContact O-N 3.39Å; V23-I28 HydrophobicContact CG2-CD1 4.18Å; V23-I28 HydrophobicContact CG2-CG1 4.39Å; I28-K41 HydrophobicContact CG2-CB 4.19Å; I28-K41 HydrophobicContact CG2-CD 3.63Å; I28-A43 HydrophobicContact CD1-CB 3.85Å; I28-I54 HydrophobicContact CD1-CD1 4.12Å
29	I	95.8	Very high	88.1	Confident	88 Å²	88	60.7 Å²	60.7	45%	0.451	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-58.4	-179.2	-62.2	172.1	0	0	0	111.4	L42 K44	I29-L42 HydrophobicContact CB-CD2 4.49Å; I29-L42 HydrophobicContact CB-CG 4.27Å; I29-L42 WeakPolarHBondContact CB-O 3.47Å; I29-L42 HydrophobicContact CD1-CD2 4.44Å; I29-L42 HydrophobicContact CD1-CG 4.21Å; I29-L42 HydrophobicContact CG2-CD2 4.37Å; I29-L42 PolarHBondContact N-O 3.5Å; I29-K44 HydrophobicContact CD1-CB 3.95Å; I29-K44 HydrophobicContact CG1-CB 4.5Å
30	R	95.3	Very high	89.6	Confident	125 Å²	125	51.7 Å²	51.7	47%	0.472	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	160.3	-175.2	65	-178.8	-177	92.8	-3.4	111.7	K41 L42 Y104	R30-K41 CarbonylContact O-C 3.58Å; R30-K41 WeakPolarHBondContact O-CA 3.33Å; R30-L42 HydrophobicContact CG-CB 3.99Å; R30-L42 HydrophobicContact CG-CD2 4.12Å; R30-L42 PolarHBondContact N-O 3.14Å; R30-L42 PolarHBondContact O-N 2.84Å; R30-Y104 PolarHBondContact NH2-OH 2.7Å
31	T	95.8	Very high	90.9	Very high	47 Å²	47	48.6 Å²	48.6	29%	0.288	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	139.3	168.5	-53.5	0	0	0	0	110.2	K34 V39 K41	T31-K34 HydrophobicContact CG2-CG 3.94Å; T31-V39 HydrophobicContact CG2-CG1 3.75Å; T31-K41 PolarHBondContact OG1-NZ 2.98Å
32	L	91.9	Very high	91.4	Very high	63 Å²	63	45.7 Å²	45.7	33%	0.33	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-41	170.8	-71	171.9	0	0	0	110.8	V40 L42 A53 Y104	L32-V40 HydrophobicContact CB-CB 4.42Å; L32-V40 HydrophobicContact CB-CG1 4.17Å; L32-V40 HydrophobicContact CD1-CG1 4.19Å; L32-V40 PolarHBondContact N-O 3.45Å; L32-L42 HydrophobicContact CD1-CB 3.93Å; L32-L42 HydrophobicContact CD2-CB 4.06Å; L32-L42 HydrophobicContact CG-CB 3.84Å; L32-A53 HydrophobicContact CD1-CB 4.13Å; L32-Y104 HydrophobicContact CD1-CD2 4Å; L32-Y104 HydrophobicContact CD1-CE2 3.93Å; L32-Y104 HydrophobicContact CD2-CE2 3.94Å
33	G	88.7	Confident	91.8	Very high	32 Å²	32	43 Å²	43	33%	0.33	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	154.1	175.8	0	0	0	0	0	112.8	V40	G33-V40 PolarHBondContact N-O 3.45Å; G33-V40 VanDerWaalsContact N-O 3.15Å; G33-V40 PolarHBondContact O-N 3.09Å
34	K	87.9	Confident	92.1	Very high	139 Å²	139	46.4 Å²	46.4	60%	0.604	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.8	173.6	-64.3	-173.6	178.4	-174.8	0	109	T31 V39	T31-K34 HydrophobicContact CG2-CG 3.94Å; K34-V39 HydrophobicContact CG-CG1 4.33Å; K34-V39 HydrophobicContact CG-CG2 4.45Å
35	G	79.8	Confident	92.4	Very high	41 Å²	41	45.6 Å²	45.6	42%	0.423	24%	0.241	S	C	.	.			trans	-118.5	176	167.7	0	0	0	0	0	111	F37 A38	G35-F37 VanDerWaalsContact C-N 3.34Å; G35-F37 PolarHBondContact O-N 3.15Å; G35-A38 CarbonylContact C-O 3.57Å; G35-A38 WeakPolarHBondContact CA-O 3.32Å; G35-A38 PolarHBondContact N-O 3.09Å
36	N	75.1	Confident	92.4	Very high	63 Å²	63	47.4 Å²	47.4	34%	0.337	25%	0.249	S	C	.	.	S	Bend	trans	-59.8	-39.4	-170.5	-73.3	11.3	0	0	0	114.1	R61 A561	N36-R61 VanDerWaalsContact O-CZ 3.28Å; N36-R61 PolarHBondContact O-NH1 3.47Å; N36-R61 PolarHBondContact O-NH2 3.3Å; N36-A561 HydrophobicContact CB-CB 4.22Å; N36-A561 WeakPolarHBondContact CB-O 3.35Å; N36-A561 VanDerWaalsContact CG-O 3.27Å; N36-A561 PolarHBondContact ND2-O 2.69Å
37	F	81.5	Confident	92.1	Very high	61 Å²	61	48.7 Å²	48.7	27%	0.268	26%	0.257	S	S	.	.	S	Bend	trans	-118.7	-2	-177	-53.2	-47	0	0	0	114	G35 D58 R61 L62 A561	G35-F37 VanDerWaalsContact C-N 3.34Å; G35-F37 PolarHBondContact O-N 3.15Å; F37-D58 PolarHBondContact O-N 3.43Å; F37-R61 HydrophobicContact CD1-CB 4.17Å; F37-R61 VanDerWaalsContact CE1-O 3.25Å; F37-R61 WeakPolarHBondContact CE1-O 3.44Å; F37-L62 HydrophobicContact CB-CD2 3.88Å; F37-L62 HydrophobicContact CB-CG 4.39Å; F37-L62 HydrophobicContact CD2-CD2 3.33Å; F37-L62 HydrophobicContact CD2-CG 4.48Å; F37-L62 HydrophobicContact CE2-CD2 3.87Å; F37-L62 HydrophobicContact CG-CD2 3.7Å; F37-L62 HydrophobicContact CG-CG 4.45Å; F37-A561 HydrophobicContact CD2-CB 3.74Å; F37-A561 HydrophobicContact CE2-CB 3.14Å; F37-A561 HydrophobicContact CZ-CB 3.69Å
38	A	89.7	Confident	91.9	Very high	23 Å²	23	46.5 Å²	46.5	19%	0.19	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142	-173.3	0	0	0	0	0	111.8	G35 K55 I56 I57	G35-A38 CarbonylContact C-O 3.57Å; G35-A38 WeakPolarHBondContact CA-O 3.32Å; G35-A38 PolarHBondContact N-O 3.09Å; A38-K55 HydrophobicContact CB-CG 4.45Å; A38-I56 CarbonylContact C-O 3.53Å; A38-I56 WeakPolarHBondContact CA-O 3.39Å; A38-I57 HydrophobicContact CB-CG1 3.99Å
39	V	93.7	Very high	91.8	Very high	34 Å²	34	50 Å²	50	21%	0.206	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.6	173.5	-179.5	0	0	0	0	108.3	T31 K34 K41 I56	T31-V39 HydrophobicContact CG2-CG1 3.75Å; K34-V39 HydrophobicContact CG-CG1 4.33Å; K34-V39 HydrophobicContact CG-CG2 4.45Å; V39-K41 HydrophobicContact CG1-CG 3.98Å; V39-I56 PolarHBondContact N-O 3.2Å; V39-I56 WeakPolarHBondContact O-CB 3.4Å; V39-I56 PolarHBondContact O-N 3.04Å
40	V	95.2	Very high	91.7	Very high	48 Å²	48	46.9 Å²	46.9	29%	0.291	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	124.2	174.9	-173	0	0	0	0	108.2	L32 G33 A53 I54 K55	L32-V40 HydrophobicContact CB-CB 4.42Å; L32-V40 HydrophobicContact CB-CG1 4.17Å; L32-V40 HydrophobicContact CD1-CG1 4.19Å; L32-V40 PolarHBondContact N-O 3.45Å; G33-V40 PolarHBondContact N-O 3.45Å; G33-V40 VanDerWaalsContact N-O 3.15Å; G33-V40 PolarHBondContact O-N 3.09Å; V40-A53 HydrophobicContact CG1-CB 4.27Å; V40-I54 CarbonylContact C-O 3.59Å; V40-I54 WeakPolarHBondContact CA-O 3.3Å; V40-K55 HydrophobicContact CG2-CB 4.47Å; V40-K55 HydrophobicContact CG2-CG 4.31Å
41	K	96.5	Very high	91.8	Very high	16 Å²	16	44.6 Å²	44.6	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.8	177.1	-60.3	-169.2	-178.6	-86.1	0	111.4	I28 R30 T31 V39 A53 I54 I56	I28-K41 HydrophobicContact CG2-CB 4.19Å; I28-K41 HydrophobicContact CG2-CD 3.63Å; R30-K41 CarbonylContact O-C 3.58Å; R30-K41 WeakPolarHBondContact O-CA 3.33Å; T31-K41 PolarHBondContact OG1-NZ 2.98Å; V39-K41 HydrophobicContact CG1-CG 3.98Å; K41-A53 CarbonylContact O-C 3.5Å; K41-A53 WeakPolarHBondContact O-CA 3.21Å; K41-I54 PolarHBondContact N-O 3.4Å; K41-I54 PolarHBondContact O-N 3.05Å; K41-I56 HydrophobicContact CD-CD1 3.86Å; K41-I56 HydrophobicContact CG-CD1 4.17Å
42	L	97.4	Very high	91.9	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	128.8	164.8	176.5	60.7	0	0	0	107.9	I29 R30 L32 Q51 Y104	I29-L42 HydrophobicContact CB-CD2 4.49Å; I29-L42 HydrophobicContact CB-CG 4.27Å; I29-L42 WeakPolarHBondContact CB-O 3.47Å; I29-L42 HydrophobicContact CD1-CD2 4.44Å; I29-L42 HydrophobicContact CD1-CG 4.21Å; I29-L42 HydrophobicContact CG2-CD2 4.37Å; I29-L42 PolarHBondContact N-O 3.5Å; R30-L42 HydrophobicContact CG-CB 3.99Å; R30-L42 HydrophobicContact CG-CD2 4.12Å; R30-L42 PolarHBondContact N-O 3.14Å; R30-L42 PolarHBondContact O-N 2.84Å; L32-L42 HydrophobicContact CD1-CB 3.93Å; L32-L42 HydrophobicContact CD2-CB 4.06Å; L32-L42 HydrophobicContact CG-CB 3.84Å; L42-Q51 HydrophobicContact CD1-CB 4.14Å; L42-Y104 HydrophobicContact CD1-CD1 3.42Å; L42-Y104 VanDerWaalsContact CD1-CD1 3.42Å; L42-Y104 HydrophobicContact CD1-CD2 4.07Å; L42-Y104 HydrophobicContact CD1-CE1 3.52Å; L42-Y104 HydrophobicContact CD1-CE2 4.19Å; L42-Y104 HydrophobicContact CD1-CG 3.72Å; L42-Y104 HydrophobicContact CD2-CE1 4.18Å
43	A	97.9	Very high	92.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	169.4	176.3	0	0	0	0	0	111.2	E27 I28 Q51 V52 I54	E27-A43 CarbonylContact O-C 3.58Å; E27-A43 VanDerWaalsContact O-CA 3.23Å; E27-A43 WeakPolarHBondContact O-CA 3.41Å; E27-A43 WeakPolarHBondContact O-CB 3.28Å; I28-A43 HydrophobicContact CD1-CB 3.85Å; A43-Q51 WeakPolarHBondContact O-CA 3.4Å; A43-V52 HydrophobicContact CB-CG2 4.07Å; A43-V52 PolarHBondContact N-O 3.4Å; A43-V52 PolarHBondContact O-N 3.2Å; A43-I54 HydrophobicContact CB-CD1 3.57Å; A43-I54 HydrophobicContact CB-CG1 3.99Å
44	K	97.4	Very high	92.6	Very high	75 Å²	75	38.3 Å²	38.3	33%	0.326	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.8	176.5	-169	177.1	-172.9	179.7	0	109.7	Y26 E27 I29 K46 K49 T50	Y26-K44 WeakPolarHBondContact CA-O 3.49Å; E27-K44 PolarHBondContact N-O 3.24Å; E27-K44 PolarHBondContact O-N 3.34Å; I29-K44 HydrophobicContact CD1-CB 3.95Å; I29-K44 HydrophobicContact CG1-CB 4.5Å; K44-K46 PolarHBondContact O-N 3.47Å; K44-K49 VanDerWaalsContact CE-O 3.27Å; K44-K49 WeakPolarHBondContact CE-O 3.48Å; K44-T50 WeakPolarHBondContact CA-O 3.46Å
45	H	96.8	Very high	93	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	128.6	179.1	178.3	-120.4	0	0	0	110.9	F25 Y26 V47 T48 K49 T50 L338	F25-H45 CarbonylContact O-C 3.6Å; F25-H45 PolarHBondContact O-CD2 3.5Å; F25-H45 VanDerWaalsContact O-CD2 3.27Å; Y26-H45 HydrophobicContact CD1-CB 3.85Å; Y26-H45 HydrophobicContact CE1-CB 3.72Å; Y26-H45 AromaticContact CE1-CD2 3.6Å; Y26-H45 AromaticContact CE1-CG 3.89Å; Y26-H45 AromaticContact CZ-CD2 3.96Å; H45-V47 PolarHBondContact O-N 2.98Å; H45-T48 PolarHBondContact ND1-N 3.08Å; H45-T48 PolarHBondContact ND1-OG1 3.05Å; H45-K49 WeakPolarHBondContact O-CA 3.31Å; H45-K49 PolarHBondContact O-N 3.41Å; H45-T50 PolarHBondContact N-O 2.73Å; H45-L338 HydrophobicContact CB-CD1 3.98Å
46	K	93.7	Very high	93.7	Very high	56 Å²	56	33 Å²	33	24%	0.243	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-35.3	-167.6	-76.7	173.6	69.4	176.1	0	113.6	F25 E27 K44 K49	F25-K46 WeakPolarHBondContact O-CB 3.49Å; F25-K46 VanDerWaalsContact O-CG 3.28Å; F25-K46 WeakPolarHBondContact O-CG 3.29Å; F25-K46 PolarHBondContact O-N 3.15Å; E27-K46 HydrophobicContact CG-CD 4.28Å; E27-K46 HydrophobicContact CG-CG 3.75Å; E27-K46 WeakPolarHBondContact OE1-CG 3.43Å; K44-K46 PolarHBondContact O-N 3.47Å; K46-K49 WeakPolarHBondContact O-CD 3.35Å; K46-K49 WeakPolarHBondContact O-CE 3.33Å; K46-K49 PolarHBondContact O-NZ 2.96Å
47	V	90.8	Very high	94.7	Very high	28 Å²	28	30.2 Å²	30.2	17%	0.17	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-59.2	-177.8	-171.9	0	0	0	0	111.4	H45 K49 L313	H45-V47 PolarHBondContact O-N 2.98Å; V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 PolarHBondContact O-N 3.47Å; V47-L313 HydrophobicContact CG1-CD1 3.85Å; V47-L313 HydrophobicContact CG1-CD2 3.97Å; V47-L313 HydrophobicContact CG1-CG 4.42Å
48	T	92.9	Very high	95.3	Very high	8 Å²	8	28 Å²	28	5%	0.049	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-15.1	-175.3	67.1	0	0	0	0	114.1	H45 T50 I335 L338 L339	H45-T48 PolarHBondContact ND1-N 3.08Å; H45-T48 PolarHBondContact ND1-OG1 3.05Å; T48-T50 WeakPolarHBondContact CB-OG1 3.39Å; T48-T50 PolarHBondContact O-N 3.08Å; T48-T50 VanDerWaalsContact O-N 3.13Å; T48-T50 WeakPolarHBondContact OG1-CB 3.45Å; T48-T50 PolarHBondContact OG1-N 3.36Å; T48-T50 PolarHBondContact OG1-OG1 3.45Å; T48-I335 HydrophobicContact CG2-CG2 4.14Å; T48-L338 HydrophobicContact CG2-CB 3.93Å; T48-L339 HydrophobicContact CG2-CD2 3.63Å; T48-L339 HydrophobicContact CG2-CG 3.64Å
49	K	94.1	Very high	95.5	Very high	96 Å²	96	28.2 Å²	28.2	42%	0.417	14%	0.139	S	C	.	.			trans	58.9	12.5	-172.3	-57.9	-50.3	-169.2	-170.7	0	115	E27 K44 H45 K46 V47	E27-K49 IonicContact OE1-NZ 3.43Å; E27-K49 PolarHBondContact OE1-NZ 3.07Å; K44-K49 VanDerWaalsContact CE-O 3.27Å; K44-K49 WeakPolarHBondContact CE-O 3.48Å; H45-K49 WeakPolarHBondContact O-CA 3.31Å; H45-K49 PolarHBondContact O-N 3.41Å; K46-K49 WeakPolarHBondContact O-CD 3.35Å; K46-K49 WeakPolarHBondContact O-CE 3.33Å; K46-K49 PolarHBondContact O-NZ 2.96Å; V47-K49 VanDerWaalsContact C-N 3.28Å; V47-K49 PolarHBondContact O-N 3.47Å
50	T	94.7	Very high	95.4	Very high	24 Å²	24	31 Å²	31	15%	0.147	16%	0.156	C	C	.	.			trans	-64.5	144.9	171.7	-42.4	0	0	0	0	110.7	K44 H45 T48 L338	K44-T50 WeakPolarHBondContact CA-O 3.46Å; H45-T50 PolarHBondContact N-O 2.73Å; T48-T50 WeakPolarHBondContact CB-OG1 3.39Å; T48-T50 PolarHBondContact O-N 3.08Å; T48-T50 VanDerWaalsContact O-N 3.13Å; T48-T50 WeakPolarHBondContact OG1-CB 3.45Å; T48-T50 PolarHBondContact OG1-N 3.36Å; T48-T50 PolarHBondContact OG1-OG1 3.45Å; T50-L338 HydrophobicContact CG2-CD2 3.86Å
51	Q	97	Very high	95.2	Very high	77 Å²	77	34.9 Å²	34.9	36%	0.36	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138.6	171.2	-72.8	176.8	-49.3	0	0	110.4	L42 A43 Y104	L42-Q51 HydrophobicContact CD1-CB 4.14Å; A43-Q51 WeakPolarHBondContact O-CA 3.4Å; Q51-Y104 HydrophobicContact CB-CD1 3.96Å
52	V	97.6	Very high	94.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	156.4	-178.2	-61.9	0	0	0	0	110.3	Y26 A43 I54 Y89 V101 T102 L338	Y26-V52 HydrophobicContact CD1-CG2 3.59Å; Y26-V52 HydrophobicContact CE1-CG1 4.47Å; Y26-V52 HydrophobicContact CE1-CG2 3.84Å; A43-V52 HydrophobicContact CB-CG2 4.07Å; A43-V52 PolarHBondContact N-O 3.4Å; A43-V52 PolarHBondContact O-N 3.2Å; V52-I54 HydrophobicContact CG2-CD1 4.41Å; V52-I54 HydrophobicContact CG2-CG1 4.15Å; V52-Y89 HydrophobicContact CG1-CD2 4.01Å; V52-Y89 HydrophobicContact CG1-CE2 3.92Å; V52-V101 HydrophobicContact CB-CG1 3.89Å; V52-V101 HydrophobicContact CG1-CG1 4.24Å; V52-V101 HydrophobicContact CG2-CG1 3.77Å; V52-T102 WeakPolarHBondContact CA-O 3.44Å; V52-T102 WeakPolarHBondContact CB-O 3.37Å; V52-L338 HydrophobicContact CG1-CD1 4.47Å; V52-L338 HydrophobicContact CG1-CD2 3.81Å
53	A	97.7	Very high	94.5	Very high	9 Å²	9	37.1 Å²	37.1	7%	0.074	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	142.8	165.4	0	0	0	0	0	109.4	L32 V40 K41 V101 T102	L32-A53 HydrophobicContact CD1-CB 4.13Å; V40-A53 HydrophobicContact CG1-CB 4.27Å; K41-A53 CarbonylContact O-C 3.5Å; K41-A53 WeakPolarHBondContact O-CA 3.21Å; A53-V101 WeakPolarHBondContact O-CA 3.31Å; A53-T102 PolarHBondContact N-O 2.94Å; A53-T102 PolarHBondContact O-N 2.93Å
54	I	97.5	Very high	94.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	113.6	176.4	-51.9	-173.3	0	0	0	108.6	Y26 I28 V40 K41 A43 V52 I56 Y99 I100 V101	Y26-I54 HydrophobicContact CD1-CD1 4.33Å; Y26-I54 HydrophobicContact CD2-CD1 4.18Å; Y26-I54 HydrophobicContact CG-CD1 3.8Å; I28-I54 HydrophobicContact CD1-CD1 4.12Å; V40-I54 CarbonylContact C-O 3.59Å; V40-I54 WeakPolarHBondContact CA-O 3.3Å; K41-I54 PolarHBondContact N-O 3.4Å; K41-I54 PolarHBondContact O-N 3.05Å; A43-I54 HydrophobicContact CB-CD1 3.57Å; A43-I54 HydrophobicContact CB-CG1 3.99Å; V52-I54 HydrophobicContact CG2-CD1 4.41Å; V52-I54 HydrophobicContact CG2-CG1 4.15Å; I54-I56 HydrophobicContact CG2-CG1 3.92Å; I54-I56 PolarHBondContact O-N 3.47Å; I54-Y99 HydrophobicContact CG2-CD1 4.36Å; I54-I100 WeakPolarHBondContact CA-O 3.38Å; I54-V101 HydrophobicContact CD1-CG2 4.25Å; I54-V101 HydrophobicContact CG1-CG1 4.26Å; I54-V101 HydrophobicContact CG1-CG2 4.13Å; I54-V101 HydrophobicContact CG2-CG2 4.31Å
55	K	95.9	Very high	93.8	Very high	42 Å²	42	41.8 Å²	41.8	18%	0.183	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	103.8	169.8	-167.6	-178.9	-167.4	179.4	0	107	A38 V40 I57 E73 I100 D166	A38-K55 HydrophobicContact CB-CG 4.45Å; V40-K55 HydrophobicContact CG2-CB 4.47Å; V40-K55 HydrophobicContact CG2-CG 4.31Å; K55-I57 HydrophobicContact CD-CD1 4.21Å; K55-I57 HydrophobicContact CG-CD1 4.18Å; K55-I57 HydrophobicContact CG-CG1 4.16Å; K55-E73 IonicContact NZ-OE1 2.82Å; K55-E73 PolarHBondContact NZ-OE1 3.24Å; K55-E73 IonicContact NZ-OE2 3.76Å; K55-E73 PolarHBondContact NZ-OE2 3.39Å; K55-I100 HydrophobicContact CB-CB 4.27Å; K55-I100 HydrophobicContact CD-CD1 4.42Å; K55-I100 PolarHBondContact N-O 3.47Å; K55-I100 PolarHBondContact O-N 3.01Å; K55-D166 IonicContact NZ-OD1 3.4Å; K55-D166 PolarHBondContact NZ-OD1 2.96Å
56	I	95.6	Very high	93.4	Very high	28 Å²	28	43.7 Å²	43.7	14%	0.144	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.6	178.2	-50.6	-178.4	0	0	0	107.8	A38 V39 K41 I54 Y99	A38-I56 CarbonylContact C-O 3.53Å; A38-I56 WeakPolarHBondContact CA-O 3.39Å; V39-I56 PolarHBondContact N-O 3.2Å; V39-I56 WeakPolarHBondContact O-CB 3.4Å; V39-I56 PolarHBondContact O-N 3.04Å; K41-I56 HydrophobicContact CD-CD1 3.86Å; K41-I56 HydrophobicContact CG-CD1 4.17Å; I54-I56 HydrophobicContact CG2-CG1 3.92Å; I54-I56 PolarHBondContact O-N 3.47Å; I56-Y99 HydrophobicContact CB-CD1 4.31Å; I56-Y99 HydrophobicContact CB-CE1 4.48Å; I56-Y99 HydrophobicContact CD1-CD1 4.46Å; I56-Y99 HydrophobicContact CD1-CE1 4.38Å; I56-Y99 HydrophobicContact CG1-CD1 3.94Å; I56-Y99 HydrophobicContact CG1-CE1 4.25Å; I56-Y99 HydrophobicContact CG2-CD1 3.9Å; I56-Y99 HydrophobicContact CG2-CE1 3.65Å
57	I	95	Very high	93.3	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.6	-172.4	-54.9	179.5	0	0	0	109.7	A38 K55 L62 I70 M97 L98 I100	A38-I57 HydrophobicContact CB-CG1 3.99Å; K55-I57 HydrophobicContact CD-CD1 4.21Å; K55-I57 HydrophobicContact CG-CD1 4.18Å; K55-I57 HydrophobicContact CG-CG1 4.16Å; I57-L62 HydrophobicContact CG2-CD1 3.64Å; I57-I70 HydrophobicContact CD1-CD1 4.43Å; I57-I70 HydrophobicContact CD1-CG2 3.65Å; I57-I70 HydrophobicContact CG2-CD1 4.16Å; I57-M97 WeakPolarHBondContact O-CA 3.17Å; I57-L98 HydrophobicContact CB-CB 4.34Å; I57-L98 PolarHBondContact N-O 3.17Å; I57-L98 PolarHBondContact O-N 3.28Å; I57-I100 HydrophobicContact CD1-CD1 3.97Å
58	D	94.1	Very high	93.3	Very high	15 Å²	15	47.1 Å²	47.1	8%	0.08	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.6	174.9	-177.6	-21.5	0	0	0	110	F37 T60 R61 M97	F37-D58 PolarHBondContact O-N 3.43Å; D58-T60 WeakPolarHBondContact OD1-CA 3.41Å; D58-T60 WeakPolarHBondContact OD1-CB 3.25Å; D58-T60 PolarHBondContact OD1-N 3.01Å; D58-T60 PolarHBondContact OD1-OG1 3.46Å; D58-R61 HydrophobicContact CB-CG 4.44Å; D58-R61 PolarHBondContact OD1-N 2.87Å; D58-R61 WeakPolarHBondContact OD2-CD 3.35Å; D58-R61 WeakPolarHBondContact OD2-CG 3.38Å; D58-M97 HydrophobicContact CB-CE 4.06Å; D58-M97 HydrophobicContact CB-SD 4.01Å
59	K	94.3	Very high	93.2	Very high	28 Å²	28	50.7 Å²	50.7	12%	0.122	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-75.2	-24.3	-178.3	-64.7	-168.1	-74.1	166	0	112.7	R61 L62 L67 E93 T94 K95 D96 L98	K59-R61 PolarHBondContact O-N 3.22Å; K59-L62 PolarHBondContact O-N 3.26Å; K59-L67 HydrophobicContact CD-CD1 3.78Å; K59-L67 HydrophobicContact CD-CD2 4.37Å; K59-L67 HydrophobicContact CG-CD1 3.88Å; K59-E93 IonicContact NZ-OE1 3.36Å; K59-E93 PolarHBondContact NZ-OE1 2.81Å; K59-T94 WeakPolarHBondContact CE-O 3.15Å; K59-T94 PolarHBondContact NZ-O 3.27Å; K59-K95 WeakPolarHBondContact CE-O 3.1Å; K59-K95 PolarHBondContact NZ-O 3.39Å; K59-D96 WeakPolarHBondContact CB-O 3.27Å; K59-D96 PolarHBondContact N-O 3.47Å; K59-L98 HydrophobicContact CD-CB 4.28Å; K59-L98 HydrophobicContact CG-CB 4.3Å
60	T	92.4	Very high	93.2	Very high	91 Å²	91	47.2 Å²	47.2	56%	0.558	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-69.3	-22.8	180	74.9	0	0	0	0	112.4	D58 D96	D58-T60 WeakPolarHBondContact OD1-CA 3.41Å; D58-T60 WeakPolarHBondContact OD1-CB 3.25Å; D58-T60 PolarHBondContact OD1-N 3.01Å; D58-T60 PolarHBondContact OD1-OG1 3.46Å; T60-D96 HydrophobicContact CG2-CB 3.76Å
61	R	89.7	Confident	93.2	Very high	130 Å²	130	50.4 Å²	50.4	49%	0.491	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-95.7	6.8	-178	-63	175.9	64.9	-127	-8.2	113.6	N36 F37 D58 K59	N36-R61 VanDerWaalsContact O-CZ 3.28Å; N36-R61 PolarHBondContact O-NH1 3.47Å; N36-R61 PolarHBondContact O-NH2 3.3Å; F37-R61 HydrophobicContact CD1-CB 4.17Å; F37-R61 VanDerWaalsContact CE1-O 3.25Å; F37-R61 WeakPolarHBondContact CE1-O 3.44Å; D58-R61 HydrophobicContact CB-CG 4.44Å; D58-R61 PolarHBondContact OD1-N 2.87Å; D58-R61 WeakPolarHBondContact OD2-CD 3.35Å; D58-R61 WeakPolarHBondContact OD2-CG 3.38Å; K59-R61 PolarHBondContact O-N 3.22Å
62	L	89.2	Confident	93.1	Very high	25 Å²	25	48.8 Å²	48.8	13%	0.131	25%	0.249	C	C	.	.	S	Bend	trans	-112.3	144	-175.3	-72.9	169.8	0	0	0	112.5	F37 I57 K59 N66 L67 I70	F37-L62 HydrophobicContact CB-CD2 3.88Å; F37-L62 HydrophobicContact CB-CG 4.39Å; F37-L62 HydrophobicContact CD2-CD2 3.33Å; F37-L62 HydrophobicContact CD2-CG 4.48Å; F37-L62 HydrophobicContact CE2-CD2 3.87Å; F37-L62 HydrophobicContact CG-CD2 3.7Å; F37-L62 HydrophobicContact CG-CG 4.45Å; I57-L62 HydrophobicContact CG2-CD1 3.64Å; K59-L62 PolarHBondContact O-N 3.26Å; L62-N66 HydrophobicContact CD2-CB 3.98Å; L62-L67 HydrophobicContact CD1-CD1 4.44Å; L62-I70 HydrophobicContact CD1-CD1 3.52Å; L62-I70 HydrophobicContact CD2-CD1 4.18Å
63	S	91.3	Very high	93	Very high	44 Å²	44	49.1 Å²	49.1	31%	0.308	25%	0.25	S	S	.	.			trans	-72.2	153	164.2	64.5	0	0	0	0	110.5	S65 N66 L67	S63-S65 PolarHBondContact O-N 3.48Å; S63-S65 PolarHBondContact OG-OG 3.27Å; S63-S65 VanDerWaalsContact OG-OG 3.12Å; S63-N66 PolarHBondContact O-N 2.7Å; S63-N66 WeakPolarHBondContact OG-CB 3.37Å; S63-N66 PolarHBondContact OG-N 3.47Å; S63-N66 PolarHBondContact OG-ND2 3.48Å; S63-N66 VanDerWaalsContact OG-ND2 3.14Å; S63-L67 PolarHBondContact O-N 3.29Å
64	P	90.6	Very high	92.9	Very high	110 Å²	110	49.4 Å²	49.4	71%	0.714	25%	0.251	S	S	*	.	H	α-helix	trans	-52.5	-42.6	175.9	-28.1	35.5	0	0	0	112.8	N66 L67 E68	P64-N66 PolarHBondContact O-N 3.11Å; P64-L67 PolarHBondContact O-N 3.02Å; P64-E68 WeakPolarHBondContact O-CB 3.45Å; P64-E68 PolarHBondContact O-N 3.35Å
65	S	88.8	Confident	92.8	Very high	63 Å²	63	54.6 Å²	54.6	44%	0.441	28%	0.275	S	S	.	.	H	α-helix	trans	-68.1	-12.5	176.9	57.9	0	0	0	0	115.5	S63 K69	S63-S65 PolarHBondContact O-N 3.48Å; S63-S65 PolarHBondContact OG-OG 3.27Å; S63-S65 VanDerWaalsContact OG-OG 3.12Å; S65-K69 WeakPolarHBondContact O-CD 3.42Å; S65-K69 WeakPolarHBondContact O-CE 3.45Å; S65-K69 WeakPolarHBondContact O-CG 3.34Å; S65-K69 PolarHBondContact O-NZ 2.68Å
66	N	88.8	Confident	92.8	Very high	41 Å²	41	52.6 Å²	52.6	22%	0.219	27%	0.267	C	S	.	.	H	α-helix	trans	-98	-34	170.4	-74.1	-26.2	0	0	0	111.3	L62 S63 P64 E68 K69 I70	L62-N66 HydrophobicContact CD2-CB 3.98Å; S63-N66 PolarHBondContact O-N 2.7Å; S63-N66 WeakPolarHBondContact OG-CB 3.37Å; S63-N66 PolarHBondContact OG-N 3.47Å; S63-N66 PolarHBondContact OG-ND2 3.48Å; S63-N66 VanDerWaalsContact OG-ND2 3.14Å; P64-N66 PolarHBondContact O-N 3.11Å; N66-E68 VanDerWaalsContact C-N 3.35Å; N66-K69 PolarHBondContact O-N 3.06Å; N66-K69 PolarHBondContact OD1-NZ 3.31Å; N66-I70 WeakPolarHBondContact O-CD1 3.43Å; N66-I70 WeakPolarHBondContact O-CG1 3.45Å; N66-I70 PolarHBondContact O-N 3Å
67	L	91.4	Very high	92.8	Very high	34 Å²	34	52 Å²	52	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-40.4	171.5	-177.6	59.6	0	0	0	111.8	K59 L62 S63 P64 K69 I70 Y71	K59-L67 HydrophobicContact CD-CD1 3.78Å; K59-L67 HydrophobicContact CD-CD2 4.37Å; K59-L67 HydrophobicContact CG-CD1 3.88Å; L62-L67 HydrophobicContact CD1-CD1 4.44Å; S63-L67 PolarHBondContact O-N 3.29Å; P64-L67 PolarHBondContact O-N 3.02Å; L67-K69 VanDerWaalsContact C-N 3.35Å; L67-K69 PolarHBondContact O-N 3.46Å; L67-I70 WeakPolarHBondContact O-CB 3.34Å; L67-I70 PolarHBondContact O-N 3.46Å; L67-I70 VanDerWaalsContact O-N 3.08Å; L67-Y71 HydrophobicContact CD1-CE1 4.5Å; L67-Y71 HydrophobicContact CD1-CE2 3.92Å; L67-Y71 HydrophobicContact CD2-CE2 3.96Å; L67-Y71 HydrophobicContact CG-CD2 4.13Å; L67-Y71 HydrophobicContact CG-CE2 3.54Å; L67-Y71 WeakPolarHBondContact O-CD2 3.41Å; L67-Y71 PolarHBondContact O-N 3.1Å
68	E	91.4	Very high	92.7	Very high	121 Å²	121	55.1 Å²	55.1	57%	0.565	28%	0.277	S	S	*	.	H	α-helix	trans	-56.5	-44	172.6	-172.1	-162.8	161.8	0	0	112.6	P64 N66 I70 Y71 R72	P64-E68 WeakPolarHBondContact O-CB 3.45Å; P64-E68 PolarHBondContact O-N 3.35Å; N66-E68 VanDerWaalsContact C-N 3.35Å; E68-I70 PolarHBondContact O-N 3.26Å; E68-Y71 PolarHBondContact O-N 3.18Å; E68-R72 PolarHBondContact O-N 3.26Å
69	K	90.5	Very high	92.6	Very high	84 Å²	84	58.7 Å²	58.7	37%	0.365	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-34	176.3	-64.2	166.4	-167.9	154.5	0	111.7	S65 N66 L67 R72 E73	S65-K69 WeakPolarHBondContact O-CD 3.42Å; S65-K69 WeakPolarHBondContact O-CE 3.45Å; S65-K69 WeakPolarHBondContact O-CG 3.34Å; S65-K69 PolarHBondContact O-NZ 2.68Å; N66-K69 PolarHBondContact O-N 3.06Å; N66-K69 PolarHBondContact OD1-NZ 3.31Å; L67-K69 VanDerWaalsContact C-N 3.35Å; L67-K69 PolarHBondContact O-N 3.46Å; K69-R72 PolarHBondContact O-N 2.98Å; K69-E73 PolarHBondContact O-N 3.35Å
70	I	93.1	Very high	92.5	Very high	23 Å²	23	57.7 Å²	57.7	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	-75.9	-38	178.9	-67.9	159.5	0	0	0	111.1	I57 L62 N66 L67 E68 R72 E73 V74 L98 I100	I57-I70 HydrophobicContact CD1-CD1 4.43Å; I57-I70 HydrophobicContact CD1-CG2 3.65Å; I57-I70 HydrophobicContact CG2-CD1 4.16Å; L62-I70 HydrophobicContact CD1-CD1 3.52Å; L62-I70 HydrophobicContact CD2-CD1 4.18Å; N66-I70 WeakPolarHBondContact O-CD1 3.43Å; N66-I70 WeakPolarHBondContact O-CG1 3.45Å; N66-I70 PolarHBondContact O-N 3Å; L67-I70 WeakPolarHBondContact O-CB 3.34Å; L67-I70 PolarHBondContact O-N 3.46Å; L67-I70 VanDerWaalsContact O-N 3.08Å; E68-I70 PolarHBondContact O-N 3.26Å; I70-R72 VanDerWaalsContact C-N 3.31Å; I70-R72 PolarHBondContact O-N 3.05Å; I70-E73 WeakPolarHBondContact O-CB 3.39Å; I70-E73 PolarHBondContact O-N 3.41Å; I70-V74 WeakPolarHBondContact O-CG2 3.11Å; I70-V74 PolarHBondContact O-N 3.3Å; I70-L98 HydrophobicContact CG2-CD2 3.59Å; I70-I100 HydrophobicContact CG2-CD1 4.45Å
71	Y	94.9	Very high	92.4	Very high	90 Å²	90	54.7 Å²	54.7	35%	0.353	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-36.7	169.2	-67.2	-49.4	0	0	0	111.8	L67 E68 V74 Q75 E93 L98	L67-Y71 HydrophobicContact CD1-CE1 4.5Å; L67-Y71 HydrophobicContact CD1-CE2 3.92Å; L67-Y71 HydrophobicContact CD2-CE2 3.96Å; L67-Y71 HydrophobicContact CG-CD2 4.13Å; L67-Y71 HydrophobicContact CG-CE2 3.54Å; L67-Y71 WeakPolarHBondContact O-CD2 3.41Å; L67-Y71 PolarHBondContact O-N 3.1Å; E68-Y71 PolarHBondContact O-N 3.18Å; Y71-V74 PolarHBondContact O-N 2.83Å; Y71-Q75 WeakPolarHBondContact O-CB 3.41Å; Y71-Q75 PolarHBondContact O-N 3.34Å; Y71-E93 PolarHBondContact OH-OE1 3.02Å; Y71-L98 HydrophobicContact CE1-CD2 4.47Å
72	R	95.2	Very high	92.5	Very high	44 Å²	44	48.9 Å²	48.9	17%	0.166	25%	0.25	C	S	.	.	H	α-helix	trans	-68.1	-38.5	172.6	-169.6	177.1	62.6	-112.4	-1.8	112.7	E68 K69 I70 V74 Q75 I76 G170 N171 F172	E68-R72 PolarHBondContact O-N 3.26Å; K69-R72 PolarHBondContact O-N 2.98Å; I70-R72 VanDerWaalsContact C-N 3.31Å; I70-R72 PolarHBondContact O-N 3.05Å; R72-V74 VanDerWaalsContact C-N 3.32Å; R72-V74 PolarHBondContact O-N 3Å; R72-Q75 PolarHBondContact O-N 2.97Å; R72-I76 HydrophobicContact CG-CD1 4.02Å; R72-I76 HydrophobicContact CG-CG1 4.4Å; R72-I76 WeakPolarHBondContact O-CB 3.45Å; R72-I76 WeakPolarHBondContact O-CG1 3.32Å; R72-I76 PolarHBondContact O-N 2.98Å; R72-G170 PolarHBondContact NE-O 2.94Å; R72-G170 PolarHBondContact NH2-O 2.83Å; R72-N171 WeakPolarHBondContact CD-OD1 3.28Å; R72-N171 PolarHBondContact NE-OD1 2.96Å; R72-F172 HydrophobicContact CG-CD2 4.37Å; R72-F172 HydrophobicContact CG-CE2 4.05Å
73	E	95	Very high	92.7	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-54.9	-49.9	170.3	-178.3	-173	177.4	0	0	110	K55 K69 I70 Q75 I76 M77 F167	K55-E73 IonicContact NZ-OE1 2.82Å; K55-E73 PolarHBondContact NZ-OE1 3.24Å; K55-E73 IonicContact NZ-OE2 3.76Å; K55-E73 PolarHBondContact NZ-OE2 3.39Å; K69-E73 PolarHBondContact O-N 3.35Å; I70-E73 WeakPolarHBondContact O-CB 3.39Å; I70-E73 PolarHBondContact O-N 3.41Å; E73-Q75 PolarHBondContact O-N 2.87Å; E73-I76 PolarHBondContact O-N 3.49Å; E73-M77 HydrophobicContact CG-SD 3.97Å; E73-M77 WeakPolarHBondContact O-CB 3.39Å; E73-M77 VanDerWaalsContact O-CG 3.26Å; E73-M77 WeakPolarHBondContact O-CG 3.39Å; E73-M77 PolarHBondContact O-N 2.96Å; E73-F167 HydrophobicContact CG-CB 4.1Å
74	V	95.6	Very high	92.9	Very high	15 Å²	15	47 Å²	47	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-46	175.5	169.9	0	0	0	0	111.8	I70 Y71 R72 I76 M77 K78 V91 I100	I70-V74 WeakPolarHBondContact O-CG2 3.11Å; I70-V74 PolarHBondContact O-N 3.3Å; Y71-V74 PolarHBondContact O-N 2.83Å; R72-V74 VanDerWaalsContact C-N 3.32Å; R72-V74 PolarHBondContact O-N 3Å; V74-I76 PolarHBondContact O-N 2.87Å; V74-M77 CarbonylContact O-C 3.5Å; V74-M77 PolarHBondContact O-N 2.97Å; V74-K78 HydrophobicContact CG1-CG 4.39Å; V74-K78 WeakPolarHBondContact O-CG 3.27Å; V74-K78 PolarHBondContact O-N 3.25Å; V74-V91 HydrophobicContact CG1-CG2 3.79Å; V74-I100 HydrophobicContact CG2-CD1 3.47Å; V74-I100 VanDerWaalsContact CG2-CD1 3.47Å; V74-I100 HydrophobicContact CG2-CG1 3.91Å
75	Q	95.6	Very high	93.2	Very high	109 Å²	109	42 Å²	42	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-42.5	179.8	-172.5	-178.1	-2.2	0	0	112.1	Y71 R72 E73 K78 L79 F172	Y71-Q75 WeakPolarHBondContact O-CB 3.41Å; Y71-Q75 PolarHBondContact O-N 3.34Å; R72-Q75 PolarHBondContact O-N 2.97Å; E73-Q75 PolarHBondContact O-N 2.87Å; Q75-K78 PolarHBondContact O-N 3.45Å; Q75-L79 WeakPolarHBondContact O-CG 3.18Å; Q75-L79 PolarHBondContact O-N 3.32Å; Q75-F172 HydrophobicContact CG-CE2 4.39Å; Q75-F172 HydrophobicContact CG-CZ 4.18Å
76	I	95.6	Very high	93.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-49.4	172.9	-74.9	169.9	0	0	0	110.1	R72 E73 V74 K78 L79 L80 I144 F167 F172	R72-I76 HydrophobicContact CG-CD1 4.02Å; R72-I76 HydrophobicContact CG-CG1 4.4Å; R72-I76 WeakPolarHBondContact O-CB 3.45Å; R72-I76 WeakPolarHBondContact O-CG1 3.32Å; R72-I76 PolarHBondContact O-N 2.98Å; E73-I76 PolarHBondContact O-N 3.49Å; V74-I76 PolarHBondContact O-N 2.87Å; I76-K78 VanDerWaalsContact C-N 3.27Å; I76-K78 PolarHBondContact O-N 3.04Å; I76-L79 PolarHBondContact O-N 3.18Å; I76-L79 VanDerWaalsContact O-N 3.08Å; I76-L80 HydrophobicContact CG2-CD1 3.66Å; I76-L80 HydrophobicContact CG2-CG 4.47Å; I76-L80 WeakPolarHBondContact O-CG 3.45Å; I76-L80 PolarHBondContact O-N 2.79Å; I76-I144 HydrophobicContact CD1-CG2 4.3Å; I76-I144 HydrophobicContact CG1-CD1 4.42Å; I76-I144 HydrophobicContact CG1-CG1 4.3Å; I76-I144 HydrophobicContact CG1-CG2 4.36Å; I76-I144 HydrophobicContact CG2-CD1 4.22Å; I76-I144 HydrophobicContact CG2-CG2 3.83Å; I76-F167 HydrophobicContact CG2-CB 3.96Å; I76-F167 HydrophobicContact CG2-CD1 3.55Å; I76-F167 HydrophobicContact CG2-CE1 4.16Å; I76-F167 HydrophobicContact CG2-CG 3.77Å; I76-F172 HydrophobicContact CG1-CE1 4.17Å; I76-F172 HydrophobicContact CG1-CE2 4.06Å; I76-F172 HydrophobicContact CG1-CZ 3.73Å
77	M	95.5	Very high	93.8	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.069	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-26	178.9	-69.5	176.3	70.8	0	0	113.8	E73 V74 L79 L88 I100 T102 F167	E73-M77 HydrophobicContact CG-SD 3.97Å; E73-M77 WeakPolarHBondContact O-CB 3.39Å; E73-M77 VanDerWaalsContact O-CG 3.26Å; E73-M77 WeakPolarHBondContact O-CG 3.39Å; E73-M77 PolarHBondContact O-N 2.96Å; V74-M77 CarbonylContact O-C 3.5Å; V74-M77 PolarHBondContact O-N 2.97Å; M77-L79 VanDerWaalsContact C-N 3.31Å; M77-L88 HydrophobicContact CB-CB 4.31Å; M77-L88 HydrophobicContact CB-CD2 4.17Å; M77-L88 HydrophobicContact CE-CB 4.41Å; M77-L88 HydrophobicContact CE-CD1 4.31Å; M77-I100 HydrophobicContact CE-CG2 4.31Å; M77-T102 HydrophobicContact CE-CG2 3.61Å; M77-F167 HydrophobicContact CG-CD2 4.05Å
78	K	93.9	Very high	94.1	Very high	69 Å²	69	38.2 Å²	38.2	30%	0.3	18%	0.177	S	C	.	.	H	α-helix	trans	-70.1	-25.6	173.1	-77.4	-161.6	168.9	-155.8	0	113.4	V74 Q75 I76 L88 S327 S328 Y329	V74-K78 HydrophobicContact CG1-CG 4.39Å; V74-K78 WeakPolarHBondContact O-CG 3.27Å; V74-K78 PolarHBondContact O-N 3.25Å; Q75-K78 PolarHBondContact O-N 3.45Å; I76-K78 VanDerWaalsContact C-N 3.27Å; I76-K78 PolarHBondContact O-N 3.04Å; K78-L88 HydrophobicContact CG-CD2 3.7Å; K78-S327 PolarHBondContact NZ-O 3.43Å; K78-S327 VanDerWaalsContact NZ-O 3.11Å; K78-S328 PolarHBondContact NZ-O 2.82Å; K78-Y329 HydrophobicContact CB-CD2 4.29Å; K78-Y329 HydrophobicContact CB-CE2 3.72Å; K78-Y329 HydrophobicContact CD-CD2 3.61Å; K78-Y329 HydrophobicContact CD-CE2 3.88Å; K78-Y329 VanDerWaalsContact CE-CD2 3.45Å; K78-Y329 HydrophobicContact CG-CD2 3.56Å; K78-Y329 HydrophobicContact CG-CE2 3.5Å; K78-Y329 HydrophobicContact CG-CG 4.34Å; K78-Y329 PolarHBondContact O-OH 3.26Å
79	L	92.2	Very high	94.3	Very high	90 Å²	90	32.6 Å²	32.6	47%	0.471	15%	0.151	S	C	.	.	H	α-helix	trans	-91.1	-23.6	-177.9	-66.4	168.5	0	0	0	113.3	Q75 I76 M77 I144 F172	Q75-L79 WeakPolarHBondContact O-CG 3.18Å; Q75-L79 PolarHBondContact O-N 3.32Å; I76-L79 PolarHBondContact O-N 3.18Å; I76-L79 VanDerWaalsContact O-N 3.08Å; M77-L79 VanDerWaalsContact C-N 3.31Å; L79-I144 HydrophobicContact CD1-CD1 4.46Å; L79-F172 HydrophobicContact CD1-CE1 3.69Å; L79-F172 HydrophobicContact CD1-CZ 3.81Å
80	L	92.3	Very high	94.6	Very high	7 Å²	7	29.1 Å²	29.1	4%	0.037	14%	0.136	C	C	.	.			trans	-94.6	116.8	-171.8	-64.1	172.7	0	0	0	112.7	I76 I85 Y138 H142 I144 F167	I76-L80 HydrophobicContact CG2-CD1 3.66Å; I76-L80 HydrophobicContact CG2-CG 4.47Å; I76-L80 WeakPolarHBondContact O-CG 3.45Å; I76-L80 PolarHBondContact O-N 2.79Å; L80-I85 HydrophobicContact CB-CD1 4.39Å; L80-I85 HydrophobicContact CD1-CD1 4.36Å; L80-I85 HydrophobicContact CD2-CD1 4.46Å; L80-Y138 HydrophobicContact CB-CE1 4.08Å; L80-Y138 HydrophobicContact CD2-CD1 3.78Å; L80-Y138 HydrophobicContact CD2-CE1 3.48Å; L80-Y138 VanDerWaalsContact CD2-CE1 3.48Å; L80-Y138 HydrophobicContact CG-CE1 4.39Å; L80-H142 HydrophobicContact CD2-CB 4.45Å; L80-I144 HydrophobicContact CD1-CD1 4.42Å; L80-I144 HydrophobicContact CD2-CD1 3.92Å; L80-I144 HydrophobicContact CG-CD1 4.13Å; L80-F167 HydrophobicContact CD1-CD1 4.17Å; L80-F167 HydrophobicContact CD1-CE1 3.47Å; L80-F167 VanDerWaalsContact CD1-CE1 3.47Å; L80-F167 HydrophobicContact CD1-CE2 4.09Å; L80-F167 HydrophobicContact CD1-CZ 3.44Å; L80-F167 VanDerWaalsContact CD1-CZ 3.44Å
81	N	90.4	Very high	94.8	Very high	28 Å²	28	29.5 Å²	29.5	15%	0.15	14%	0.139	C	C	.	.			trans	-129.8	88.7	175.7	-175.7	42.7	0	0	0	110	K87 Y138 N298	N81-K87 PolarHBondContact OD1-NZ 3.42Å; N81-Y138 PolarHBondContact N-OH 3.16Å; N81-Y138 PolarHBondContact O-OH 3.24Å; N81-N298 PolarHBondContact ND2-OD1 3.39Å
82	H	91.9	Very high	94.9	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.042	13%	0.128	C	C	.	.			trans	-139.2	139.1	-174.7	-177.6	-98.1	0	0	0	111.1	H84 I85 A135 Y138 Y295	H82-H84 AromaticContact CE1-CD2 3.98Å; H82-H84 PolarHBondContact ND1-N 3.34Å; H82-H84 VanDerWaalsContact ND1-N 3.13Å; H82-H84 PolarHBondContact O-N 3.13Å; H82-H84 VanDerWaalsContact O-N 3.07Å; H82-I85 HydrophobicContact CB-CB 4.17Å; H82-I85 HydrophobicContact CB-CD1 3.77Å; H82-I85 HydrophobicContact CB-CG1 3.87Å; H82-I85 PolarHBondContact O-N 2.95Å; H82-A135 VanDerWaalsContact CE1-CA 3.44Å; H82-A135 WeakPolarHBondContact CE1-CA 3.29Å; H82-A135 PolarHBondContact CE1-N 3.26Å; H82-A135 VanDerWaalsContact CE1-N 3.34Å; H82-Y138 HydrophobicContact CB-CD1 3.64Å; H82-Y138 HydrophobicContact CB-CE1 3.77Å; H82-Y138 HydrophobicContact CB-CG 4.09Å; H82-Y138 AromaticContact CD2-CG 3.83Å; H82-Y295 AromaticContact CD2-CE2 3.55Å; H82-Y295 AromaticContact CD2-CZ 3.77Å; H82-Y295 PolarHBondContact CD2-OH 2.88Å; H82-Y295 VanDerWaalsContact CD2-OH 3.24Å; H82-Y295 PolarHBondContact NE2-OH 2.8Å
83	P	92.2	Very high	94.9	Very high	18 Å²	18	28.9 Å²	28.9	12%	0.117	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.5	-176.5	18.7	-32.4	0	0	0	114.4	K163 H290	P83-K163 WeakPolarHBondContact O-CD 3.46Å; P83-K163 WeakPolarHBondContact O-CE 3.43Å; P83-K163 PolarHBondContact O-NZ 3.35Å; P83-H290 HydrophobicContact CG-CB 4.49Å
84	H	95.9	Very high	94.9	Very high	11 Å²	11	30.8 Å²	30.8	5%	0.051	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	22.6	178.7	-56.8	-55.8	0	0	0	114.6	H82 Q131 A135 I162 L164	H82-H84 AromaticContact CE1-CD2 3.98Å; H82-H84 PolarHBondContact ND1-N 3.34Å; H82-H84 VanDerWaalsContact ND1-N 3.13Å; H82-H84 PolarHBondContact O-N 3.13Å; H82-H84 VanDerWaalsContact O-N 3.07Å; H84-Q131 HydrophobicContact CB-CB 4.37Å; H84-Q131 VanDerWaalsContact CE1-CD 3.48Å; H84-Q131 PolarHBondContact CE1-NE2 3.23Å; H84-Q131 VanDerWaalsContact CE1-NE2 3.33Å; H84-A135 HydrophobicContact CB-CB 4.19Å; H84-I162 WeakPolarHBondContact CA-O 3.23Å; H84-I162 WeakPolarHBondContact CB-O 3.28Å; H84-I162 PolarHBondContact ND1-O 3.07Å; H84-L164 PolarHBondContact O-N 2.89Å
85	I	96.4	Very high	94.8	Very high	4 Å²	4	38 Å²	38	2%	0.021	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-120.4	143.2	168.9	-60.5	178.9	0	0	0	107.9	L80 H82 K87 A135 Y138 L164 F167	L80-I85 HydrophobicContact CB-CD1 4.39Å; L80-I85 HydrophobicContact CD1-CD1 4.36Å; L80-I85 HydrophobicContact CD2-CD1 4.46Å; H82-I85 HydrophobicContact CB-CB 4.17Å; H82-I85 HydrophobicContact CB-CD1 3.77Å; H82-I85 HydrophobicContact CB-CG1 3.87Å; H82-I85 PolarHBondContact O-N 2.95Å; I85-K87 PolarHBondContact O-N 2.78Å; I85-A135 HydrophobicContact CD1-CB 4.31Å; I85-A135 HydrophobicContact CG1-CB 3.8Å; I85-Y138 HydrophobicContact CD1-CD1 3.75Å; I85-Y138 HydrophobicContact CD1-CE1 4.27Å; I85-L164 HydrophobicContact CG1-CB 4.31Å; I85-F167 HydrophobicContact CD1-CZ 4.48Å; I85-F167 HydrophobicContact CG2-CE2 3.71Å; I85-F167 HydrophobicContact CG2-CZ 3.81Å
86	I	96	Very high	94.7	Very high	14 Å²	14	35 Å²	35	7%	0.072	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-61.3	118.9	173.8	-73.9	-66.3	0	0	0	109.9	T102 E103 A105 L155 K163 L164 A165	I86-T102 HydrophobicContact CG2-CG2 4.22Å; I86-E103 HydrophobicContact CD1-CB 4.14Å; I86-E103 HydrophobicContact CG2-CB 4.26Å; I86-A105 HydrophobicContact CD1-CB 4.21Å; I86-L155 HydrophobicContact CD1-CD1 4.13Å; I86-L155 HydrophobicContact CG1-CD1 4.19Å; I86-K163 HydrophobicContact CD1-CB 3.61Å; I86-K163 HydrophobicContact CD1-CG 4.19Å; I86-K163 HydrophobicContact CG1-CB 3.94Å; I86-L164 PolarHBondContact N-O 3.23Å; I86-A165 HydrophobicContact CG1-CB 3.81Å
87	K	94.8	Very high	94.7	Very high	43 Å²	43	36.5 Å²	36.5	19%	0.187	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-74	138.2	-179.7	-173	155.4	-173.3	144.5	0	112.5	N81 I85 Y89 T102 E103	N81-K87 PolarHBondContact OD1-NZ 3.42Å; I85-K87 PolarHBondContact O-N 2.78Å; K87-Y89 HydrophobicContact CB-CE1 4.49Å; K87-Y89 HydrophobicContact CD-CE1 4.33Å; K87-Y89 HydrophobicContact CG-CD1 4.37Å; K87-Y89 HydrophobicContact CG-CE1 4.19Å; K87-T102 CarbonylContact O-C 3.59Å; K87-T102 WeakPolarHBondContact O-CA 3.24Å; K87-T102 WeakPolarHBondContact O-CB 3.13Å; K87-E103 HydrophobicContact CB-CB 4.34Å; K87-E103 PolarHBondContact N-OE2 3.09Å; K87-E103 PolarHBondContact O-N 3.31Å
88	L	96.8	Very high	94.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.3	165.2	-177.6	66.9	0	0	0	109.8	M77 K78 V91 I100 Y329	M77-L88 HydrophobicContact CB-CB 4.31Å; M77-L88 HydrophobicContact CB-CD2 4.17Å; M77-L88 HydrophobicContact CE-CB 4.41Å; M77-L88 HydrophobicContact CE-CD1 4.31Å; K78-L88 HydrophobicContact CG-CD2 3.7Å; L88-V91 HydrophobicContact CD1-CG2 4.17Å; L88-V91 HydrophobicContact CD2-CG2 4.15Å; L88-I100 HydrophobicContact CD1-CG2 3.5Å; L88-Y329 HydrophobicContact CB-CD1 4.31Å; L88-Y329 HydrophobicContact CB-CE1 4.03Å; L88-Y329 HydrophobicContact CD2-CD1 3.73Å; L88-Y329 HydrophobicContact CD2-CD2 4.42Å; L88-Y329 HydrophobicContact CD2-CE1 3.88Å; L88-Y329 HydrophobicContact CD2-CG 4.01Å; L88-Y329 HydrophobicContact CG-CD1 3.72Å; L88-Y329 HydrophobicContact CG-CE1 3.93Å; L88-Y329 HydrophobicContact CG-CG 4.4Å; L88-Y329 WeakPolarHBondContact O-CE1 3.44Å
89	Y	96.3	Very high	94.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-41.9	171.7	-53.4	-65.2	0	0	0	112.5	V52 K87 V101 T102 E103 A334 L338 E341	V52-Y89 HydrophobicContact CG1-CD2 4.01Å; V52-Y89 HydrophobicContact CG1-CE2 3.92Å; K87-Y89 HydrophobicContact CB-CE1 4.49Å; K87-Y89 HydrophobicContact CD-CE1 4.33Å; K87-Y89 HydrophobicContact CG-CD1 4.37Å; K87-Y89 HydrophobicContact CG-CE1 4.19Å; Y89-V101 HydrophobicContact CD2-CG1 4.48Å; Y89-V101 PolarHBondContact N-O 2.85Å; Y89-T102 WeakPolarHBondContact CE2-O 3.44Å; Y89-E103 HydrophobicContact CE2-CB 4.31Å; Y89-A334 WeakPolarHBondContact O-CA 3.43Å; Y89-A334 WeakPolarHBondContact O-CB 3.03Å; Y89-L338 HydrophobicContact CD1-CD2 3.95Å; Y89-L338 HydrophobicContact CD1-CG 4.19Å; Y89-L338 HydrophobicContact CD2-CD2 3.77Å; Y89-L338 HydrophobicContact CD2-CG 4.47Å; Y89-L338 HydrophobicContact CE1-CD2 3.8Å; Y89-L338 HydrophobicContact CE1-CG 4.43Å; Y89-L338 HydrophobicContact CE2-CD2 3.59Å; Y89-L338 HydrophobicContact CG-CD2 3.93Å; Y89-L338 HydrophobicContact CG-CG 4.21Å; Y89-E341 WeakPolarHBondContact CE1-OE2 3.41Å; Y89-E341 PolarHBondContact OH-OE2 3.12Å
90	Q	97.4	Very high	95.1	Very high	11 Å²	11	29 Å²	29	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.6	-174.6	-153.3	176.7	-22.8	0	0	112.4	Y26 M92 V101 Y329 A334	Y26-Q90 VanDerWaalsContact CE2-OE1 3.26Å; Y26-Q90 PolarHBondContact OH-OE1 3.13Å; Q90-M92 HydrophobicContact CG-CG 4.17Å; Q90-M92 VanDerWaalsContact NE2-CG 3.3Å; Q90-V101 HydrophobicContact CB-CB 3.92Å; Q90-V101 HydrophobicContact CB-CG2 4.05Å; Q90-V101 PolarHBondContact N-O 3.42Å; Q90-V101 PolarHBondContact O-N 3.31Å; Q90-Y329 WeakPolarHBondContact CA-O 3.37Å; Q90-Y329 VanDerWaalsContact CG-O 3.25Å; Q90-Y329 WeakPolarHBondContact CG-O 3.38Å; Q90-A334 HydrophobicContact CB-CB 3.76Å; Q90-A334 HydrophobicContact CG-CB 3.96Å
91	V	97.4	Very high	95.4	Very high	30 Å²	30	28.6 Å²	28.6	18%	0.182	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.7	161.1	-173.5	0	0	0	0	107.7	V74 L88 L98 Y99 Y329	V74-V91 HydrophobicContact CG1-CG2 3.79Å; L88-V91 HydrophobicContact CD1-CG2 4.17Å; L88-V91 HydrophobicContact CD2-CG2 4.15Å; V91-L98 HydrophobicContact CG1-CD1 3.72Å; V91-Y99 WeakPolarHBondContact CA-O 3.41Å; V91-Y329 PolarHBondContact N-O 2.85Å
92	M	96.7	Very high	95.7	Very high	25 Å²	25	28.2 Å²	28.2	12%	0.123	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.5	171.2	-55.2	173.2	-69.6	0	0	108	V23 Y26 Q90 Y99 V101	V23-M92 HydrophobicContact CG1-CE 3.65Å; V23-M92 HydrophobicContact CG1-SD 4.48Å; Y26-M92 HydrophobicContact CD2-CE 3.98Å; Y26-M92 HydrophobicContact CE2-CE 4.03Å; Y26-M92 HydrophobicContact CE2-SD 4.27Å; Q90-M92 HydrophobicContact CG-CG 4.17Å; Q90-M92 VanDerWaalsContact NE2-CG 3.3Å; M92-Y99 HydrophobicContact CB-CD2 4.38Å; M92-Y99 HydrophobicContact CE-CG 4.45Å; M92-Y99 PolarHBondContact N-O 3.42Å; M92-Y99 PolarHBondContact O-N 3.33Å; M92-V101 HydrophobicContact CE-CG2 3.81Å
93	E	95.2	Very high	95.9	Very high	97 Å²	97	28.6 Å²	28.6	45%	0.453	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.5	-175.4	-174.9	169.2	171.7	0	0	110.2	K59 Y71 L98	K59-E93 IonicContact NZ-OE1 3.36Å; K59-E93 PolarHBondContact NZ-OE1 2.81Å; Y71-E93 PolarHBondContact OH-OE1 3.02Å; E93-L98 HydrophobicContact CB-CD1 3.89Å; E93-L98 HydrophobicContact CG-CD1 4.06Å
94	T	94.8	Very high	96.1	Very high	46 Å²	46	29.6 Å²	29.6	28%	0.282	14%	0.142	S	C	.	.			trans	-117.5	-177.9	166.4	74.5	0	0	0	0	108.8	K59 D96 M97 Y99 I438	K59-T94 WeakPolarHBondContact CE-O 3.15Å; K59-T94 PolarHBondContact NZ-O 3.27Å; T94-D96 VanDerWaalsContact C-N 3.26Å; T94-D96 PolarHBondContact O-N 3.23Å; T94-D96 PolarHBondContact OG1-N 3.38Å; T94-M97 PolarHBondContact N-O 2.85Å; T94-M97 PolarHBondContact OG1-N 2.78Å; T94-M97 VanDerWaalsContact OG1-N 3.08Å; T94-Y99 HydrophobicContact CG2-CE2 4.45Å; T94-I438 HydrophobicContact CG2-CD1 3.63Å
95	K	93.9	Very high	96.2	Very high	166 Å²	166	29.4 Å²	29.4	72%	0.722	14%	0.142	S	C	*	.	S	Bend	trans	-52.2	-47.1	173.3	-179.8	-178.9	153.3	-95.1	0	112.1	K59	K59-K95 WeakPolarHBondContact CE-O 3.1Å; K59-K95 PolarHBondContact NZ-O 3.39Å
96	D	93.8	Very high	96	Very high	48 Å²	48	33.6 Å²	33.6	26%	0.257	16%	0.161	S	C	.	.	S	Bend	trans	-112.7	-12.6	-165	-59.2	-67.4	0	0	0	113.7	K59 T60 T94	K59-D96 WeakPolarHBondContact CB-O 3.27Å; K59-D96 PolarHBondContact N-O 3.47Å; T60-D96 HydrophobicContact CG2-CB 3.76Å; T94-D96 VanDerWaalsContact C-N 3.26Å; T94-D96 PolarHBondContact O-N 3.23Å; T94-D96 PolarHBondContact OG1-N 3.38Å
97	M	94.5	Very high	96	Very high	30 Å²	30	36.7 Å²	36.7	15%	0.148	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.1	-179.5	-66	-74.3	169.2	0	0	112.6	I57 D58 T94 Y99 P444	I57-M97 WeakPolarHBondContact O-CA 3.17Å; D58-M97 HydrophobicContact CB-CE 4.06Å; D58-M97 HydrophobicContact CB-SD 4.01Å; T94-M97 PolarHBondContact N-O 2.85Å; T94-M97 PolarHBondContact OG1-N 2.78Å; T94-M97 VanDerWaalsContact OG1-N 3.08Å; M97-Y99 HydrophobicContact CB-CD2 4.43Å; M97-Y99 HydrophobicContact CB-CE2 3.6Å; M97-P444 HydrophobicContact CE-CG 4.36Å
98	L	96.3	Very high	95.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	135	171.3	178.8	67.8	0	0	0	109.9	I57 K59 I70 Y71 V91 E93 I100	I57-L98 HydrophobicContact CB-CB 4.34Å; I57-L98 PolarHBondContact N-O 3.17Å; I57-L98 PolarHBondContact O-N 3.28Å; K59-L98 HydrophobicContact CD-CB 4.28Å; K59-L98 HydrophobicContact CG-CB 4.3Å; I70-L98 HydrophobicContact CG2-CD2 3.59Å; Y71-L98 HydrophobicContact CE1-CD2 4.47Å; V91-L98 HydrophobicContact CG1-CD1 3.72Å; E93-L98 HydrophobicContact CB-CD1 3.89Å; E93-L98 HydrophobicContact CG-CD1 4.06Å; L98-I100 HydrophobicContact CD2-CD1 4.44Å; L98-I100 HydrophobicContact CG-CG1 4.37Å
99	Y	97.2	Very high	95.8	Very high	13 Å²	13	39.5 Å²	39.5	5%	0.051	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	118.3	-177.4	-54	-100	0	0	0	109.6	V23 I54 I56 V91 M92 T94 M97	V23-Y99 HydrophobicContact CB-CE1 4.48Å; V23-Y99 HydrophobicContact CG1-CD1 3.66Å; V23-Y99 HydrophobicContact CG1-CD2 4.46Å; V23-Y99 HydrophobicContact CG1-CE1 3.69Å; V23-Y99 HydrophobicContact CG1-CE2 4.49Å; V23-Y99 HydrophobicContact CG1-CG 4.08Å; V23-Y99 HydrophobicContact CG2-CD1 4.37Å; V23-Y99 HydrophobicContact CG2-CE1 3.93Å; I54-Y99 HydrophobicContact CG2-CD1 4.36Å; I56-Y99 HydrophobicContact CB-CD1 4.31Å; I56-Y99 HydrophobicContact CB-CE1 4.48Å; I56-Y99 HydrophobicContact CD1-CD1 4.46Å; I56-Y99 HydrophobicContact CD1-CE1 4.38Å; I56-Y99 HydrophobicContact CG1-CD1 3.94Å; I56-Y99 HydrophobicContact CG1-CE1 4.25Å; I56-Y99 HydrophobicContact CG2-CD1 3.9Å; I56-Y99 HydrophobicContact CG2-CE1 3.65Å; V91-Y99 WeakPolarHBondContact CA-O 3.41Å; M92-Y99 HydrophobicContact CB-CD2 4.38Å; M92-Y99 HydrophobicContact CE-CG 4.45Å; M92-Y99 PolarHBondContact N-O 3.42Å; M92-Y99 PolarHBondContact O-N 3.33Å; T94-Y99 HydrophobicContact CG2-CE2 4.45Å; M97-Y99 HydrophobicContact CB-CD2 4.43Å; M97-Y99 HydrophobicContact CB-CE2 3.6Å
100	I	97.3	Very high	95.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.3	179.2	-52.3	170.2	0	0	0	107.8	I54 K55 I57 I70 V74 M77 L88 L98 T102	I54-I100 WeakPolarHBondContact CA-O 3.38Å; K55-I100 HydrophobicContact CB-CB 4.27Å; K55-I100 HydrophobicContact CD-CD1 4.42Å; K55-I100 PolarHBondContact N-O 3.47Å; K55-I100 PolarHBondContact O-N 3.01Å; I57-I100 HydrophobicContact CD1-CD1 3.97Å; I70-I100 HydrophobicContact CG2-CD1 4.45Å; V74-I100 HydrophobicContact CG2-CD1 3.47Å; V74-I100 VanDerWaalsContact CG2-CD1 3.47Å; V74-I100 HydrophobicContact CG2-CG1 3.91Å; M77-I100 HydrophobicContact CE-CG2 4.31Å; L88-I100 HydrophobicContact CD1-CG2 3.5Å; L98-I100 HydrophobicContact CD2-CD1 4.44Å; L98-I100 HydrophobicContact CG-CG1 4.37Å; I100-T102 HydrophobicContact CG2-CG2 4.09Å
101	V	97.9	Very high	95.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.5	-174.8	-174	0	0	0	0	110.2	Y26 V52 A53 I54 Y89 Q90 M92	Y26-V101 HydrophobicContact CD1-CG1 4.46Å; Y26-V101 HydrophobicContact CD2-CG2 4.45Å; Y26-V101 HydrophobicContact CE1-CG1 3.82Å; Y26-V101 HydrophobicContact CE2-CG1 4.39Å; Y26-V101 HydrophobicContact CE2-CG2 4Å; V52-V101 HydrophobicContact CB-CG1 3.89Å; V52-V101 HydrophobicContact CG1-CG1 4.24Å; V52-V101 HydrophobicContact CG2-CG1 3.77Å; A53-V101 WeakPolarHBondContact O-CA 3.31Å; I54-V101 HydrophobicContact CD1-CG2 4.25Å; I54-V101 HydrophobicContact CG1-CG1 4.26Å; I54-V101 HydrophobicContact CG1-CG2 4.13Å; I54-V101 HydrophobicContact CG2-CG2 4.31Å; Y89-V101 HydrophobicContact CD2-CG1 4.48Å; Y89-V101 PolarHBondContact N-O 2.85Å; Q90-V101 HydrophobicContact CB-CB 3.92Å; Q90-V101 HydrophobicContact CB-CG2 4.05Å; Q90-V101 PolarHBondContact N-O 3.42Å; Q90-V101 PolarHBondContact O-N 3.31Å; M92-V101 HydrophobicContact CE-CG2 3.81Å
102	T	97.4	Very high	95.1	Very high	19 Å²	19	43 Å²	43	12%	0.117	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	169.5	-170.1	72.7	0	0	0	0	113.2	V52 A53 M77 I86 K87 Y89 I100	V52-T102 WeakPolarHBondContact CA-O 3.44Å; V52-T102 WeakPolarHBondContact CB-O 3.37Å; A53-T102 PolarHBondContact N-O 2.94Å; A53-T102 PolarHBondContact O-N 2.93Å; M77-T102 HydrophobicContact CE-CG2 3.61Å; I86-T102 HydrophobicContact CG2-CG2 4.22Å; K87-T102 CarbonylContact O-C 3.59Å; K87-T102 WeakPolarHBondContact O-CA 3.24Å; K87-T102 WeakPolarHBondContact O-CB 3.13Å; Y89-T102 WeakPolarHBondContact CE2-O 3.44Å; I100-T102 HydrophobicContact CG2-CG2 4.09Å
103	E	96.4	Very high	95	Very high	18 Å²	18	43.7 Å²	43.7	8%	0.084	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.7	144	165.7	-165.5	-172.9	156.1	0	0	111.8	I86 K87 Y89 K163	I86-E103 HydrophobicContact CD1-CB 4.14Å; I86-E103 HydrophobicContact CG2-CB 4.26Å; K87-E103 HydrophobicContact CB-CB 4.34Å; K87-E103 PolarHBondContact N-OE2 3.09Å; K87-E103 PolarHBondContact O-N 3.31Å; Y89-E103 HydrophobicContact CE2-CB 4.31Å; E103-K163 WeakPolarHBondContact OE1-CE 3.36Å; E103-K163 IonicContact OE1-NZ 3.14Å; E103-K163 PolarHBondContact OE1-NZ 3.43Å; E103-K163 WeakPolarHBondContact OE2-CE 3.24Å; E103-K163 IonicContact OE2-NZ 3.42Å; E103-K163 PolarHBondContact OE2-NZ 3.49Å
104	Y	96.6	Very high	94.9	Very high	38 Å²	38	39.5 Å²	39.5	15%	0.149	20%	0.2	C	C	.	.			trans	-106.8	103	174.8	174.2	-130.9	0	0	0	111.9	R30 L32 L42 Q51 K106	R30-Y104 PolarHBondContact NH2-OH 2.7Å; L32-Y104 HydrophobicContact CD1-CD2 4Å; L32-Y104 HydrophobicContact CD1-CE2 3.93Å; L32-Y104 HydrophobicContact CD2-CE2 3.94Å; L42-Y104 HydrophobicContact CD1-CD1 3.42Å; L42-Y104 VanDerWaalsContact CD1-CD1 3.42Å; L42-Y104 HydrophobicContact CD1-CD2 4.07Å; L42-Y104 HydrophobicContact CD1-CE1 3.52Å; L42-Y104 HydrophobicContact CD1-CE2 4.19Å; L42-Y104 HydrophobicContact CD1-CG 3.72Å; L42-Y104 HydrophobicContact CD2-CE1 4.18Å; Q51-Y104 HydrophobicContact CB-CD1 3.96Å; Y104-K106 HydrophobicContact CD1-CG 3.9Å; Y104-K106 HydrophobicContact CE1-CB 4.34Å; Y104-K106 HydrophobicContact CE1-CG 3.83Å; Y104-K106 PolarHBondContact O-N 2.65Å; Y104-K106 VanDerWaalsContact O-N 3.12Å
105	A	96.1	Very high	94.7	Very high	7 Å²	7	38.6 Å²	38.6	6%	0.058	19%	0.194	C	C	.	.			trans	-68.9	101.2	170.3	0	0	0	0	0	111	I86 N107 G108 L155 L156	I86-A105 HydrophobicContact CD1-CB 4.21Å; A105-N107 VanDerWaalsContact C-N 3.33Å; A105-N107 PolarHBondContact O-N 3.44Å; A105-G108 PolarHBondContact O-N 2.71Å; A105-L155 HydrophobicContact CB-CB 3.45Å; A105-L155 VanDerWaalsContact CB-CB 3.45Å; A105-L155 HydrophobicContact CB-CD1 4.02Å; A105-L155 HydrophobicContact CB-CG 4.37Å; A105-L156 CarbonylContact C-O 3.59Å; A105-L156 WeakPolarHBondContact CB-O 3.33Å
106	K	94	Very high	94.6	Very high	93 Å²	93	35.1 Å²	35.1	40%	0.404	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.6	-169	-61.8	-178.7	-169.8	146	0	114.2	Y104 L156 A158	Y104-K106 HydrophobicContact CD1-CG 3.9Å; Y104-K106 HydrophobicContact CE1-CB 4.34Å; Y104-K106 HydrophobicContact CE1-CG 3.83Å; Y104-K106 PolarHBondContact O-N 2.65Å; Y104-K106 VanDerWaalsContact O-N 3.12Å; K106-L156 PolarHBondContact N-O 2.96Å; K106-A158 HydrophobicContact CD-CB 3.93Å
107	N	94.8	Very high	94.5	Very high	79 Å²	79	37.9 Å²	37.9	42%	0.422	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	12.4	-175	-70.7	-45	0	0	0	113.7	A105 L156 D157 M160	A105-N107 VanDerWaalsContact C-N 3.33Å; A105-N107 PolarHBondContact O-N 3.44Å; N107-L156 HydrophobicContact CB-CB 3.75Å; N107-L156 PolarHBondContact N-O 3.44Å; N107-D157 PolarHBondContact ND2-O 3.06Å; N107-M160 HydrophobicContact CB-SD 3.79Å; N107-M160 PolarHBondContact ND2-SD 3.42Å
108	G	93.2	Very high	94.4	Very high	31 Å²	31	37.2 Å²	37.2	32%	0.32	21%	0.207	S	C	.	.			trans	75.9	-153.9	168.8	0	0	0	0	0	114.5	A105 L155 L156	A105-G108 PolarHBondContact O-N 2.71Å; G108-L155 CarbonylContact O-C 3.47Å; G108-L155 VanDerWaalsContact O-CA 3.32Å; G108-L155 WeakPolarHBondContact O-CA 3.48Å; G108-L156 PolarHBondContact O-N 2.96Å
109	E	93.7	Very high	94.2	Very high	72 Å²	72	43.4 Å²	43.4	34%	0.336	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-82.1	141.2	-178.4	-64.2	-179.8	-153.1	0	0	112	F111 D112 H113 E152 L155	E109-F111 HydrophobicContact CB-CB 4.26Å; E109-F111 PolarHBondContact O-N 3.39Å; E109-D112 PolarHBondContact O-N 3.37Å; E109-D112 VanDerWaalsContact O-N 3.09Å; E109-H113 PolarHBondContact O-N 3.12Å; E109-E152 WeakPolarHBondContact OE2-CA 3.35Å; E109-E152 WeakPolarHBondContact OE2-CB 3.38Å; E109-L155 HydrophobicContact CB-CD2 4.4Å; E109-L155 HydrophobicContact CG-CD2 3.72Å
110	M	94.3	Very high	94.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-28.8	172	-177.6	68.4	-132.3	0	0	111.4	H113 L114 M120 L154 L156 I162 L216	M110-H113 HydrophobicContact CE-CB 4.48Å; M110-H113 PolarHBondContact O-N 3.23Å; M110-L114 HydrophobicContact CE-CD1 4.19Å; M110-L114 HydrophobicContact CE-CD2 3.61Å; M110-L114 HydrophobicContact CE-CG 3.54Å; M110-L114 WeakPolarHBondContact O-CG 3.28Å; M110-L114 PolarHBondContact O-N 2.88Å; M110-M120 HydrophobicContact CE-CE 3.63Å; M110-M120 HydrophobicContact CE-SD 3.88Å; M110-M120 HydrophobicContact SD-CE 4.36Å; M110-L154 HydrophobicContact CB-CB 3.94Å; M110-L154 WeakPolarHBondContact CB-O 3.5Å; M110-L154 PolarHBondContact N-O 2.91Å; M110-L156 HydrophobicContact SD-CD1 4.2Å; M110-L156 HydrophobicContact SD-CD2 4.03Å; M110-L156 HydrophobicContact SD-CG 4.44Å; M110-I162 HydrophobicContact SD-CD1 4.25Å; M110-L216 HydrophobicContact CE-CD2 3.61Å; M110-L216 HydrophobicContact CG-CD2 4.17Å; M110-L216 HydrophobicContact SD-CD2 4.22Å
111	F	91.6	Very high	94	Very high	32 Å²	32	46.1 Å²	46.1	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-48.2	170.4	175.8	-86.5	0	0	0	113.4	E109 L114 T115 T151 E152 F573	E109-F111 HydrophobicContact CB-CB 4.26Å; E109-F111 PolarHBondContact O-N 3.39Å; F111-L114 PolarHBondContact O-N 2.92Å; F111-T115 WeakPolarHBondContact O-CB 3.25Å; F111-T115 PolarHBondContact O-N 3.42Å; F111-T115 PolarHBondContact O-OG1 3.06Å; F111-T151 PolarHBondContact N-O 2.79Å; F111-E152 HydrophobicContact CB-CG 4.01Å; F111-E152 HydrophobicContact CD2-CG 3.89Å; F111-E152 HydrophobicContact CG-CG 3.99Å; F111-F573 HydrophobicContact CD2-CD2 4.28Å; F111-F573 HydrophobicContact CD2-CE2 4.2Å; F111-F573 HydrophobicContact CE2-CB 4.12Å; F111-F573 HydrophobicContact CE2-CD1 4.43Å; F111-F573 AromaticContact CE2-CD2 3.24Å; F111-F573 HydrophobicContact CE2-CD2 3.24Å; F111-F573 AromaticContact CE2-CE2 3.56Å; F111-F573 HydrophobicContact CE2-CE2 3.56Å; F111-F573 AromaticContact CE2-CG 3.71Å; F111-F573 HydrophobicContact CE2-CG 3.71Å; F111-F573 HydrophobicContact CE2-CZ 4.26Å; F111-F573 HydrophobicContact CZ-CB 3.9Å; F111-F573 AromaticContact CZ-CD2 3.44Å; F111-F573 HydrophobicContact CZ-CD2 3.44Å; F111-F573 VanDerWaalsContact CZ-CD2 3.44Å; F111-F573 HydrophobicContact CZ-CE2 4.15Å; F111-F573 AromaticContact CZ-CG 3.92Å; F111-F573 HydrophobicContact CZ-CG 3.92Å
112	D	91.9	Very high	93.9	Very high	87 Å²	87	47.8 Å²	47.8	47%	0.465	26%	0.257	S	S	.	.	H	α-helix	trans	-68.9	-36.7	179.8	-81.2	-24.6	0	0	0	111.4	E109 T115 S116	E109-D112 PolarHBondContact O-N 3.37Å; E109-D112 VanDerWaalsContact O-N 3.09Å; D112-T115 PolarHBondContact O-N 3.04Å; D112-S116 WeakPolarHBondContact O-CB 3.2Å; D112-S116 PolarHBondContact O-N 3.29Å; D112-S116 PolarHBondContact O-OG 2.88Å
113	H	93.6	Very high	93.8	Very high	39 Å²	39	51 Å²	51	18%	0.181	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-47.2	172.9	180	-90.4	0	0	0	111.9	E109 M110 T115 S116 N117 L156 M160	E109-H113 PolarHBondContact O-N 3.12Å; M110-H113 HydrophobicContact CE-CB 4.48Å; M110-H113 PolarHBondContact O-N 3.23Å; H113-T115 VanDerWaalsContact C-N 3.33Å; H113-T115 PolarHBondContact O-N 3.14Å; H113-S116 PolarHBondContact O-N 3.33Å; H113-N117 PolarHBondContact CD2-ND2 2.87Å; H113-N117 VanDerWaalsContact CD2-ND2 3.31Å; H113-N117 PolarHBondContact NE2-ND2 3.5Å; H113-N117 WeakPolarHBondContact O-CB 3.4Å; H113-N117 PolarHBondContact O-N 3.48Å; H113-L156 HydrophobicContact CB-CD1 3.74Å; H113-M160 VanDerWaalsContact CD2-CE 3.43Å; H113-M160 WeakPolarHBondContact CD2-CE 3.49Å
114	L	92.8	Very high	93.7	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-65.2	-35.3	174.7	-69.5	175.1	0	0	0	112.7	M110 F111 S116 G118 M120 T151 V215 L216	M110-L114 HydrophobicContact CE-CD1 4.19Å; M110-L114 HydrophobicContact CE-CD2 3.61Å; M110-L114 HydrophobicContact CE-CG 3.54Å; M110-L114 WeakPolarHBondContact O-CG 3.28Å; M110-L114 PolarHBondContact O-N 2.88Å; F111-L114 PolarHBondContact O-N 2.92Å; L114-S116 VanDerWaalsContact C-N 3.33Å; L114-G118 WeakPolarHBondContact CD2-O 3.5Å; L114-G118 CarbonylContact O-C 3.5Å; L114-G118 WeakPolarHBondContact O-CA 3.37Å; L114-G118 PolarHBondContact O-N 2.76Å; L114-M120 HydrophobicContact CD2-CG 4.43Å; L114-T151 HydrophobicContact CD1-CG2 4.07Å; L114-V215 HydrophobicContact CD1-CG1 3.73Å; L114-L216 HydrophobicContact CD1-CD2 4.35Å; L114-L216 HydrophobicContact CD2-CD2 4.49Å
115	T	90.9	Very high	93.7	Very high	28 Å²	28	53 Å²	53	17%	0.172	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-35.6	178.4	-63.1	0	0	0	0	111.7	F111 D112 H113 Q576	F111-T115 WeakPolarHBondContact O-CB 3.25Å; F111-T115 PolarHBondContact O-N 3.42Å; F111-T115 PolarHBondContact O-OG1 3.06Å; D112-T115 PolarHBondContact O-N 3.04Å; H113-T115 VanDerWaalsContact C-N 3.33Å; H113-T115 PolarHBondContact O-N 3.14Å; T115-Q576 HydrophobicContact CG2-CG 3.99Å
116	S	92.4	Very high	93.7	Very high	92 Å²	92	53.2 Å²	53.2	64%	0.643	28%	0.284	S	S	*	.	H	α-helix	trans	-79.4	-53	179.9	-55.5	0	0	0	0	112.5	D112 H113 L114	D112-S116 WeakPolarHBondContact O-CB 3.2Å; D112-S116 PolarHBondContact O-N 3.29Å; D112-S116 PolarHBondContact O-OG 2.88Å; H113-S116 PolarHBondContact O-N 3.33Å; L114-S116 VanDerWaalsContact C-N 3.33Å
117	N	91.4	Very high	93.8	Very high	106 Å²	106	52.3 Å²	52.3	57%	0.567	28%	0.279	S	S	*	.	H	α-helix	trans	-93.4	-25.3	-170.6	-64.3	-13.7	0	0	0	112.3	H113	H113-N117 PolarHBondContact CD2-ND2 2.87Å; H113-N117 VanDerWaalsContact CD2-ND2 3.31Å; H113-N117 PolarHBondContact NE2-ND2 3.5Å; H113-N117 WeakPolarHBondContact O-CB 3.4Å; H113-N117 PolarHBondContact O-N 3.48Å
118	G	91.9	Very high	93.8	Very high	17 Å²	17	50 Å²	50	18%	0.175	27%	0.266	C	S	.	.			trans	96.6	-163.8	-172.7	0	0	0	0	0	112.5	L114	L114-G118 WeakPolarHBondContact CD2-O 3.5Å; L114-G118 CarbonylContact O-C 3.5Å; L114-G118 WeakPolarHBondContact O-CA 3.37Å; L114-G118 PolarHBondContact O-N 2.76Å
119	R	91.9	Very high	94	Very high	130 Å²	130	48.5 Å²	48.5	49%	0.491	25%	0.251	S	S	.	.	S	Bend	trans	-61.9	149	174.8	81.8	-165.8	-163.6	-160.9	6.4	111.4	V217 F245	R119-V217 WeakPolarHBondContact CB-O 3.21Å; R119-V217 VanDerWaalsContact CD-O 3.31Å; R119-V217 WeakPolarHBondContact CD-O 3.38Å; R119-F245 VanDerWaalsContact CZ-CE2 3.46Å
120	M	95.1	Very high	94.1	Very high	19 Å²	19	45.4 Å²	45.4	9%	0.094	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-78.9	162.3	171.9	-75.7	179.6	153.5	0	0	111.9	M110 L114 E124 A125 K128 L216	M110-M120 HydrophobicContact CE-CE 3.63Å; M110-M120 HydrophobicContact CE-SD 3.88Å; M110-M120 HydrophobicContact SD-CE 4.36Å; L114-M120 HydrophobicContact CD2-CG 4.43Å; M120-E124 HydrophobicContact CB-CB 4.13Å; M120-E124 HydrophobicContact CG-CB 4.32Å; M120-E124 HydrophobicContact SD-CB 4.29Å; M120-A125 HydrophobicContact CB-CB 4.17Å; M120-K128 HydrophobicContact CE-CG 4.03Å; M120-K128 HydrophobicContact SD-CG 4.04Å; M120-L216 PolarHBondContact N-O 3.27Å; M120-L216 HydrophobicContact SD-CD2 4.17Å
121	S	96	Very high	94.2	Very high	53 Å²	53	46.3 Å²	46.3	37%	0.371	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-65.8	159.1	157.3	65.8	0	0	0	0	110.5	D123 E124 A125	S121-D123 PolarHBondContact O-N 3.23Å; S121-E124 VanDerWaalsContact CB-OE2 3.28Å; S121-E124 WeakPolarHBondContact CB-OE2 3.49Å; S121-E124 PolarHBondContact N-OE2 3.37Å; S121-E124 PolarHBondContact O-N 2.57Å; S121-E124 WeakPolarHBondContact OG-CB 3.4Å; S121-E124 VanDerWaalsContact OG-CD 3.26Å; S121-E124 VanDerWaalsContact OG-CG 3.24Å; S121-E124 WeakPolarHBondContact OG-CG 3.44Å; S121-E124 PolarHBondContact OG-N 2.99Å; S121-E124 PolarHBondContact OG-OE2 3.48Å; S121-A125 VanDerWaalsContact O-CB 3.27Å; S121-A125 WeakPolarHBondContact O-CB 3.35Å; S121-A125 PolarHBondContact O-N 3.29Å
122	E	96.3	Very high	94.5	Very high	35 Å²	35	44.9 Å²	44.9	16%	0.164	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-29.1	176.8	-71.8	-169.5	-161.7	0	0	112.5	R126 V217 S247 C250 W276	E122-R126 WeakPolarHBondContact O-CB 3.3Å; E122-R126 PolarHBondContact O-N 2.99Å; E122-V217 HydrophobicContact CG-CG1 4.21Å; E122-S247 PolarHBondContact OE1-N 2.83Å; E122-S247 PolarHBondContact OE1-OG 3.17Å; E122-S247 WeakPolarHBondContact OE2-CB 3.48Å; E122-S247 PolarHBondContact OE2-OG 3.09Å; E122-C250 WeakPolarHBondContact OE2-CB 3.1Å; E122-W276 HydrophobicContact CB-CZ2 4.03Å; E122-W276 HydrophobicContact CG-CZ2 4.41Å; E122-W276 WeakPolarHBondContact O-CZ2 3.35Å; E122-W276 PolarHBondContact OE2-NE1 3.37Å
123	D	94.8	Very high	94.7	Very high	86 Å²	86	40.7 Å²	40.7	46%	0.46	21%	0.211	S	C	.	.	H	α-helix	trans	-75.6	-38.1	-179.4	-56	-39.2	0	0	0	112.6	S121 R126 K127	S121-D123 PolarHBondContact O-N 3.23Å; D123-R126 IonicContact OD1-CZ 3.76Å; D123-R126 IonicContact OD1-NH1 2.65Å; D123-R126 PolarHBondContact OD1-NH1 3.09Å; D123-R126 IonicContact OD1-NH2 2.73Å; D123-R126 PolarHBondContact OD1-NH2 2.99Å; D123-K127 WeakPolarHBondContact O-CG 3.49Å; D123-K127 PolarHBondContact O-N 3.47Å
124	E	94.6	Very high	94.8	Very high	99 Å²	99	39 Å²	39	46%	0.463	20%	0.203	S	C	.	.	H	α-helix	trans	-66.9	-45.7	169.8	-68.4	163.9	123.7	0	0	110.9	M120 S121 R126 K127 K128	M120-E124 HydrophobicContact CB-CB 4.13Å; M120-E124 HydrophobicContact CG-CB 4.32Å; M120-E124 HydrophobicContact SD-CB 4.29Å; S121-E124 VanDerWaalsContact CB-OE2 3.28Å; S121-E124 WeakPolarHBondContact CB-OE2 3.49Å; S121-E124 PolarHBondContact N-OE2 3.37Å; S121-E124 PolarHBondContact O-N 2.57Å; S121-E124 WeakPolarHBondContact OG-CB 3.4Å; S121-E124 VanDerWaalsContact OG-CD 3.26Å; S121-E124 VanDerWaalsContact OG-CG 3.24Å; S121-E124 WeakPolarHBondContact OG-CG 3.44Å; S121-E124 PolarHBondContact OG-N 2.99Å; S121-E124 PolarHBondContact OG-OE2 3.48Å; E124-R126 VanDerWaalsContact C-N 3.32Å; E124-R126 PolarHBondContact O-N 3.5Å; E124-K127 WeakPolarHBondContact O-CB 2.92Å; E124-K127 PolarHBondContact O-N 2.9Å; E124-K128 PolarHBondContact O-N 3.13Å
125	A	96.6	Very high	95	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-41.3	178.1	0	0	0	0	0	111.4	M120 S121 K127 K128 F129 L216 V217 W276	M120-A125 HydrophobicContact CB-CB 4.17Å; S121-A125 VanDerWaalsContact O-CB 3.27Å; S121-A125 WeakPolarHBondContact O-CB 3.35Å; S121-A125 PolarHBondContact O-N 3.29Å; A125-K127 VanDerWaalsContact C-N 3.34Å; A125-K127 PolarHBondContact O-N 3.35Å; A125-K128 PolarHBondContact O-N 3.39Å; A125-F129 WeakPolarHBondContact O-CB 3.26Å; A125-F129 PolarHBondContact O-N 3.34Å; A125-L216 HydrophobicContact CB-CB 4.11Å; A125-V217 HydrophobicContact CB-CG1 3.54Å; A125-W276 HydrophobicContact CB-CH2 4.4Å
126	R	96.4	Very high	95.3	Very high	11 Å²	11	37.2 Å²	37.2	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-40.6	175.6	-168.4	-170.1	-53.8	111.3	15.4	112	E122 D123 E124 F129 W130 W276 M277	E122-R126 WeakPolarHBondContact O-CB 3.3Å; E122-R126 PolarHBondContact O-N 2.99Å; D123-R126 IonicContact OD1-CZ 3.76Å; D123-R126 IonicContact OD1-NH1 2.65Å; D123-R126 PolarHBondContact OD1-NH1 3.09Å; D123-R126 IonicContact OD1-NH2 2.73Å; D123-R126 PolarHBondContact OD1-NH2 2.99Å; E124-R126 VanDerWaalsContact C-N 3.32Å; E124-R126 PolarHBondContact O-N 3.5Å; R126-F129 PolarHBondContact O-N 2.94Å; R126-W130 PolarHBondContact O-N 3.41Å; R126-W276 VanDerWaalsContact CA-CH2 3.43Å; R126-W276 HydrophobicContact CB-CH2 3.61Å; R126-W276 HydrophobicContact CB-CZ2 4Å; R126-W276 HydrophobicContact CB-CZ3 3.92Å; R126-W276 WeakPolarHBondContact CD-O 3.44Å; R126-W276 HydrophobicContact CG-CE3 4.21Å; R126-W276 HydrophobicContact CG-CH2 4.15Å; R126-W276 HydrophobicContact CG-CZ3 3.93Å; R126-W276 PolarHBondContact NE-O 2.7Å; R126-M277 HydrophobicContact CG-SD 4.27Å
127	K	95	Very high	95.4	Very high	73 Å²	73	33.8 Å²	33.8	32%	0.317	17%	0.167	S	C	.	.	H	α-helix	trans	-62.4	-45.7	174.9	-77.6	162.5	178.2	148	0	111.8	D123 E124 A125 Q131 D280 A283	D123-K127 WeakPolarHBondContact O-CG 3.49Å; D123-K127 PolarHBondContact O-N 3.47Å; E124-K127 WeakPolarHBondContact O-CB 2.92Å; E124-K127 PolarHBondContact O-N 2.9Å; A125-K127 VanDerWaalsContact C-N 3.34Å; A125-K127 PolarHBondContact O-N 3.35Å; K127-Q131 WeakPolarHBondContact O-CG 3.4Å; K127-Q131 PolarHBondContact O-N 3.41Å; K127-D280 WeakPolarHBondContact CE-OD2 3.48Å; K127-D280 IonicContact NZ-OD2 2.71Å; K127-D280 PolarHBondContact NZ-OD2 2.91Å; K127-A283 HydrophobicContact CG-CB 3.6Å
128	K	96.1	Very high	95.6	Very high	31 Å²	31	29.1 Å²	29.1	14%	0.135	14%	0.142	C	C	.	.	H	α-helix	trans	-67.6	-39.2	174.3	-55.3	-51.3	164	-165.4	0	112.1	M120 E124 A125 W130 Q131 I132 M160 I162	M120-K128 HydrophobicContact CE-CG 4.03Å; M120-K128 HydrophobicContact SD-CG 4.04Å; E124-K128 PolarHBondContact O-N 3.13Å; A125-K128 PolarHBondContact O-N 3.39Å; K128-W130 PolarHBondContact O-N 2.97Å; K128-Q131 WeakPolarHBondContact O-CB 3.27Å; K128-Q131 PolarHBondContact O-N 3.33Å; K128-Q131 VanDerWaalsContact O-N 3.12Å; K128-I132 VanDerWaalsContact O-CG1 3.29Å; K128-I132 WeakPolarHBondContact O-CG1 3.48Å; K128-I132 PolarHBondContact O-N 2.78Å; K128-M160 WeakPolarHBondContact CE-O 3.35Å; K128-M160 PolarHBondContact NZ-O 3.25Å; K128-I162 HydrophobicContact CB-CD1 4.13Å; K128-I162 HydrophobicContact CB-CG1 3.93Å; K128-I162 HydrophobicContact CD-CD1 4.29Å; K128-I162 HydrophobicContact CD-CG1 4.03Å; K128-I162 HydrophobicContact CG-CD1 4.45Å; K128-I162 HydrophobicContact CG-CG1 4.43Å
129	F	97.4	Very high	95.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70	-31.8	-178.4	-161.8	-106.9	0	0	0	112.9	A125 R126 I132 L133 L209 L213 M257 I271 W276 M277	A125-F129 WeakPolarHBondContact O-CB 3.26Å; A125-F129 PolarHBondContact O-N 3.34Å; R126-F129 PolarHBondContact O-N 2.94Å; F129-I132 HydrophobicContact CD2-CD1 4.37Å; F129-I132 PolarHBondContact O-N 2.83Å; F129-L133 WeakPolarHBondContact O-CB 3.38Å; F129-L133 PolarHBondContact O-N 2.96Å; F129-L209 HydrophobicContact CE2-CB 4.1Å; F129-L209 HydrophobicContact CE2-CD2 4.17Å; F129-L209 WeakPolarHBondContact CE2-O 3.22Å; F129-L209 HydrophobicContact CZ-CB 4.06Å; F129-L213 HydrophobicContact CB-CD1 4.37Å; F129-L213 HydrophobicContact CD1-CD2 4.43Å; F129-L213 HydrophobicContact CD2-CB 4Å; F129-L213 HydrophobicContact CD2-CD1 4.19Å; F129-L213 HydrophobicContact CE1-CD2 4.24Å; F129-L213 HydrophobicContact CE2-CB 3.76Å; F129-L213 HydrophobicContact CG-CD1 4.12Å; F129-L213 HydrophobicContact CZ-CB 4.19Å; F129-L213 HydrophobicContact CZ-CD2 4.34Å; F129-M257 HydrophobicContact CE1-CE 4.09Å; F129-M257 HydrophobicContact CE1-SD 4.41Å; F129-M257 HydrophobicContact CE2-CE 4.42Å; F129-M257 HydrophobicContact CZ-CE 3.59Å; F129-M257 HydrophobicContact CZ-SD 3.8Å; F129-I271 HydrophobicContact CE1-CG2 4.03Å; F129-W276 HydrophobicContact CB-CZ3 4.41Å; F129-W276 HydrophobicContact CD1-CZ3 4.26Å; F129-M277 HydrophobicContact CD1-CE 3.82Å; F129-M277 HydrophobicContact CD1-SD 3.68Å; F129-M277 HydrophobicContact CE1-CE 4.49Å; F129-M277 HydrophobicContact CE1-SD 4.35Å
130	W	95.8	Very high	95.9	Very high	7 Å²	7	22.9 Å²	22.9	3%	0.027	11%	0.114	C	C	.	.	H	α-helix	trans	-58.8	-44.8	166.6	-92.7	112.2	0	0	0	112	R126 K128 L133 T134 K272 M277 A284	R126-W130 PolarHBondContact O-N 3.41Å; K128-W130 PolarHBondContact O-N 2.97Å; W130-L133 PolarHBondContact O-N 2.92Å; W130-T134 HydrophobicContact CE3-CG2 4.48Å; W130-T134 WeakPolarHBondContact O-CG2 3.25Å; W130-T134 PolarHBondContact O-N 2.97Å; W130-T134 PolarHBondContact O-OG1 3.4Å; W130-K272 HydrophobicContact CH2-CB 4.02Å; W130-K272 HydrophobicContact CH2-CG 4.13Å; W130-K272 HydrophobicContact CZ3-CB 4.24Å; W130-K272 HydrophobicContact CZ3-CD 4.18Å; W130-K272 HydrophobicContact CZ3-CG 3.84Å; W130-M277 HydrophobicContact CB-CE 4.37Å; W130-M277 HydrophobicContact CD2-CE 3.53Å; W130-M277 HydrophobicContact CE3-CE 4.1Å; W130-M277 HydrophobicContact CG-CE 3.64Å; W130-M277 HydrophobicContact CZ2-CB 3.91Å; W130-M277 HydrophobicContact CZ2-CE 4.18Å; W130-M277 PolarHBondContact NE1-O 3.12Å; W130-A284 HydrophobicContact CD2-CB 4.31Å; W130-A284 HydrophobicContact CH2-CB 4.11Å; W130-A284 HydrophobicContact CZ2-CB 3.62Å
131	Q	96	Very high	95.8	Very high	18 Å²	18	29.6 Å²	29.6	8%	0.084	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-41	178.6	-62.7	-178.8	-28.6	0	0	112.6	H84 K127 K128 T134 A135 N161 I162 T287	H84-Q131 HydrophobicContact CB-CB 4.37Å; H84-Q131 VanDerWaalsContact CE1-CD 3.48Å; H84-Q131 PolarHBondContact CE1-NE2 3.23Å; H84-Q131 VanDerWaalsContact CE1-NE2 3.33Å; K127-Q131 WeakPolarHBondContact O-CG 3.4Å; K127-Q131 PolarHBondContact O-N 3.41Å; K128-Q131 WeakPolarHBondContact O-CB 3.27Å; K128-Q131 PolarHBondContact O-N 3.33Å; K128-Q131 VanDerWaalsContact O-N 3.12Å; Q131-T134 PolarHBondContact O-OG1 3.11Å; Q131-A135 PolarHBondContact O-N 3.46Å; Q131-N161 PolarHBondContact NE2-OD1 3.13Å; Q131-I162 HydrophobicContact CB-CB 3.92Å; Q131-I162 HydrophobicContact CB-CG1 4.18Å; Q131-T287 HydrophobicContact CG-CG2 4.26Å
132	I	97.8	Very high	95.7	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-64.3	-49	174.6	-61	159.4	0	0	0	110.2	K128 F129 T134 A135 V136 L154 I162 L209 V212 L216	K128-I132 VanDerWaalsContact O-CG1 3.29Å; K128-I132 WeakPolarHBondContact O-CG1 3.48Å; K128-I132 PolarHBondContact O-N 2.78Å; F129-I132 HydrophobicContact CD2-CD1 4.37Å; F129-I132 PolarHBondContact O-N 2.83Å; I132-T134 PolarHBondContact O-N 3.15Å; I132-A135 WeakPolarHBondContact O-CB 3.4Å; I132-A135 PolarHBondContact O-N 3.34Å; I132-V136 HydrophobicContact CG2-CG2 4.49Å; I132-V136 WeakPolarHBondContact O-CG2 3.42Å; I132-V136 PolarHBondContact O-N 3.41Å; I132-L154 HydrophobicContact CD1-CD1 3.66Å; I132-L154 HydrophobicContact CG1-CD1 4.04Å; I132-L154 HydrophobicContact CG1-CD2 4.1Å; I132-L154 HydrophobicContact CG2-CD2 4.38Å; I132-I162 HydrophobicContact CD1-CD1 4.43Å; I132-I162 HydrophobicContact CD1-CG1 4.47Å; I132-I162 HydrophobicContact CG1-CB 4.39Å; I132-I162 HydrophobicContact CG1-CD1 4.34Å; I132-I162 HydrophobicContact CG1-CG1 4.01Å; I132-I162 HydrophobicContact CG1-CG2 3.78Å; I132-L209 HydrophobicContact CG2-CD2 3.37Å; I132-V212 HydrophobicContact CD1-CG1 4.07Å; I132-L216 HydrophobicContact CD1-CD1 4.14Å
133	L	97.1	Very high	95.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.3	-33.8	-175.2	-175.3	68.8	0	0	0	112.6	F129 W130 D137 L209 V268 I271 K272 M277	F129-L133 WeakPolarHBondContact O-CB 3.38Å; F129-L133 PolarHBondContact O-N 2.96Å; W130-L133 PolarHBondContact O-N 2.92Å; L133-D137 WeakPolarHBondContact O-CB 3.23Å; L133-D137 PolarHBondContact O-N 2.96Å; L133-L209 HydrophobicContact CD1-CD1 3.95Å; L133-V268 HydrophobicContact CD1-CG1 4.08Å; L133-V268 HydrophobicContact CD1-CG2 4.42Å; L133-V268 HydrophobicContact CG-CG1 4.49Å; L133-I271 HydrophobicContact CD1-CB 4.41Å; L133-I271 HydrophobicContact CD1-CD1 4.19Å; L133-I271 HydrophobicContact CD1-CG2 4.08Å; L133-I271 HydrophobicContact CD2-CB 4.07Å; L133-I271 HydrophobicContact CD2-CG2 3.4Å; L133-I271 VanDerWaalsContact CD2-CG2 3.4Å; L133-I271 HydrophobicContact CG-CG2 4.4Å; L133-K272 HydrophobicContact CD2-CG 3.61Å; L133-K272 HydrophobicContact CG-CG 4.36Å; L133-M277 HydrophobicContact CD2-CE 3.84Å
134	T	95.3	Very high	95.7	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-70.6	-37.3	173.4	49.6	0	0	0	0	112.3	W130 Q131 I132 Y138 T287	W130-T134 HydrophobicContact CE3-CG2 4.48Å; W130-T134 WeakPolarHBondContact O-CG2 3.25Å; W130-T134 PolarHBondContact O-N 2.97Å; W130-T134 PolarHBondContact O-OG1 3.4Å; Q131-T134 PolarHBondContact O-OG1 3.11Å; I132-T134 PolarHBondContact O-N 3.15Å; T134-Y138 VanDerWaalsContact O-CB 3.3Å; T134-Y138 WeakPolarHBondContact O-CB 3.34Å; T134-Y138 PolarHBondContact O-N 3.37Å; T134-T287 HydrophobicContact CG2-CG2 3.8Å; T134-T287 WeakPolarHBondContact OG1-CG2 3.49Å
135	A	96	Very high	95.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.5	-45.1	172.8	0	0	0	0	0	112.3	H82 H84 I85 Q131 I132 Y138 C139 L164	H82-A135 VanDerWaalsContact CE1-CA 3.44Å; H82-A135 WeakPolarHBondContact CE1-CA 3.29Å; H82-A135 PolarHBondContact CE1-N 3.26Å; H82-A135 VanDerWaalsContact CE1-N 3.34Å; H84-A135 HydrophobicContact CB-CB 4.19Å; I85-A135 HydrophobicContact CD1-CB 4.31Å; I85-A135 HydrophobicContact CG1-CB 3.8Å; Q131-A135 PolarHBondContact O-N 3.46Å; I132-A135 WeakPolarHBondContact O-CB 3.4Å; I132-A135 PolarHBondContact O-N 3.34Å; A135-Y138 WeakPolarHBondContact O-CB 2.91Å; A135-Y138 PolarHBondContact O-N 2.71Å; A135-C139 PolarHBondContact O-N 3.17Å; A135-C139 PolarHBondContact O-SG 3.49Å; A135-C139 VanDerWaalsContact O-SG 3.32Å; A135-L164 HydrophobicContact CB-CB 4.41Å; A135-L164 HydrophobicContact CB-CD2 4.26Å
136	V	96.8	Very high	95.6	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-70.5	-40.8	179.6	176.2	0	0	0	0	112	I132 Y138 C139 H140 L149 L164 D205 L209	I132-V136 HydrophobicContact CG2-CG2 4.49Å; I132-V136 WeakPolarHBondContact O-CG2 3.42Å; I132-V136 PolarHBondContact O-N 3.41Å; V136-Y138 VanDerWaalsContact C-N 3.27Å; V136-Y138 PolarHBondContact O-N 2.73Å; V136-C139 PolarHBondContact O-N 3.1Å; V136-H140 VanDerWaalsContact CG1-CE1 3.44Å; V136-H140 WeakPolarHBondContact CG1-CE1 3.43Å; V136-H140 PolarHBondContact O-N 2.76Å; V136-L149 HydrophobicContact CG1-CD1 4.42Å; V136-L149 HydrophobicContact CG2-CD1 3.86Å; V136-L149 HydrophobicContact CG2-CD2 4.09Å; V136-L164 HydrophobicContact CG2-CD2 4.29Å; V136-D205 HydrophobicContact CG1-CB 4.28Å; V136-L209 HydrophobicContact CB-CD1 4.37Å; V136-L209 HydrophobicContact CG1-CD1 4.16Å; V136-L209 HydrophobicContact CG2-CD2 4.27Å
137	D	95.7	Very high	95.5	Very high	19 Å²	19	24.9 Å²	24.9	10%	0.102	11%	0.107	C	C	.	.	H	α-helix	trans	-57.2	-40.8	171	-174.2	19.8	0	0	0	111.6	L133 H140 R141 V268 K272	L133-D137 WeakPolarHBondContact O-CB 3.23Å; L133-D137 PolarHBondContact O-N 2.96Å; D137-H140 PolarHBondContact O-N 3.47Å; D137-R141 WeakPolarHBondContact O-CB 3.45Å; D137-R141 WeakPolarHBondContact O-CD 2.89Å; D137-R141 WeakPolarHBondContact O-CG 3.35Å; D137-R141 PolarHBondContact O-N 3.11Å; D137-R141 IonicContact OD1-CZ 3.6Å; D137-R141 IonicContact OD1-NE 2.69Å; D137-R141 PolarHBondContact OD1-NE 3.42Å; D137-R141 IonicContact OD1-NH2 2.78Å; D137-R141 PolarHBondContact OD1-NH2 3.3Å; D137-R141 IonicContact OD2-CZ 2.85Å; D137-R141 IonicContact OD2-NE 3.86Å; D137-R141 PolarHBondContact OD2-NE 2.85Å; D137-R141 IonicContact OD2-NH2 2.82Å; D137-R141 PolarHBondContact OD2-NH2 3.37Å; D137-V268 HydrophobicContact CB-CG1 3.63Å; D137-K272 WeakPolarHBondContact OD2-CE 3.49Å; D137-K272 IonicContact OD2-NZ 2.79Å; D137-K272 PolarHBondContact OD2-NZ 3Å
138	Y	95.3	Very high	95.3	Very high	9 Å²	9	21.5 Å²	21.5	4%	0.035	9%	0.093	C	C	.	.	H	α-helix	trans	-64	-43.6	176	177	-98.4	0	0	0	112.3	L80 N81 H82 I85 T134 A135 V136 R141 H142 Y295	L80-Y138 HydrophobicContact CB-CE1 4.08Å; L80-Y138 HydrophobicContact CD2-CD1 3.78Å; L80-Y138 HydrophobicContact CD2-CE1 3.48Å; L80-Y138 VanDerWaalsContact CD2-CE1 3.48Å; L80-Y138 HydrophobicContact CG-CE1 4.39Å; N81-Y138 PolarHBondContact N-OH 3.16Å; N81-Y138 PolarHBondContact O-OH 3.24Å; H82-Y138 HydrophobicContact CB-CD1 3.64Å; H82-Y138 HydrophobicContact CB-CE1 3.77Å; H82-Y138 HydrophobicContact CB-CG 4.09Å; H82-Y138 AromaticContact CD2-CG 3.83Å; I85-Y138 HydrophobicContact CD1-CD1 3.75Å; I85-Y138 HydrophobicContact CD1-CE1 4.27Å; T134-Y138 VanDerWaalsContact O-CB 3.3Å; T134-Y138 WeakPolarHBondContact O-CB 3.34Å; T134-Y138 PolarHBondContact O-N 3.37Å; A135-Y138 WeakPolarHBondContact O-CB 2.91Å; A135-Y138 PolarHBondContact O-N 2.71Å; V136-Y138 VanDerWaalsContact C-N 3.27Å; V136-Y138 PolarHBondContact O-N 2.73Å; Y138-R141 PolarHBondContact O-N 3.16Å; Y138-H142 AromaticContact CD2-CE1 3.65Å; Y138-H142 AromaticContact CD2-ND1 3.94Å; Y138-H142 AromaticContact CE2-CE1 3.18Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.46Å; Y138-H142 AromaticContact CE2-ND1 3.8Å; Y138-H142 AromaticContact CE2-NE2 3.99Å; Y138-H142 AromaticContact CZ-CE1 3.51Å; Y138-H142 AromaticContact CZ-ND1 3.92Å; Y138-H142 PolarHBondContact O-N 3.25Å; Y138-H142 PolarHBondContact O-ND1 3.2Å; Y138-Y295 HydrophobicContact CD2-CD1 4.34Å; Y138-Y295 AromaticContact CD2-CE1 3.55Å; Y138-Y295 HydrophobicContact CD2-CE1 3.55Å; Y138-Y295 HydrophobicContact CD2-CE2 4.11Å; Y138-Y295 AromaticContact CD2-CZ 3.43Å; Y138-Y295 VanDerWaalsContact CD2-CZ 3.43Å; Y138-Y295 WeakPolarHBondContact CD2-OH 3.48Å; Y138-Y295 HydrophobicContact CE2-CD1 4.28Å; Y138-Y295 AromaticContact CE2-CE1 3.93Å; Y138-Y295 HydrophobicContact CE2-CE1 3.93Å; Y138-Y295 HydrophobicContact CE2-CE2 4.32Å; Y138-Y295 AromaticContact CE2-CZ 3.98Å
139	C	95.8	Very high	95.3	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.007	9%	0.087	C	C	.	.	H	α-helix	trans	-60	-49	172.8	-65	0	0	0	0	111.9	A135 V136 R141 H142 H143 I144	A135-C139 PolarHBondContact O-N 3.17Å; A135-C139 PolarHBondContact O-SG 3.49Å; A135-C139 VanDerWaalsContact O-SG 3.32Å; V136-C139 PolarHBondContact O-N 3.1Å; C139-R141 VanDerWaalsContact C-N 3.31Å; C139-R141 PolarHBondContact O-N 3.43Å; C139-H142 CarbonylContact O-C 3.34Å; C139-H142 WeakPolarHBondContact O-CA 3.43Å; C139-H142 PolarHBondContact O-N 2.96Å; C139-H143 PolarHBondContact O-N 2.66Å; C139-I144 CarbonylContact C-O 3.14Å; C139-I144 HydrophobicContact CB-CB 4.37Å; C139-I144 HydrophobicContact CB-CG2 4.32Å; C139-I144 WeakPolarHBondContact CB-O 3.09Å; C139-I144 PolarHBondContact O-N 2.99Å; C139-I144 VanDerWaalsContact O-O 3.12Å
140	H	94.9	Very high	95.1	Very high	14 Å²	14	20.9 Å²	20.9	7%	0.065	9%	0.09	C	C	.	.	H	α-helix	trans	-60.1	-40.2	-178.7	-67.4	178	0	0	0	111.6	V136 D137 H142 H143 I144 Y173 D205	V136-H140 VanDerWaalsContact CG1-CE1 3.44Å; V136-H140 WeakPolarHBondContact CG1-CE1 3.43Å; V136-H140 PolarHBondContact O-N 2.76Å; D137-H140 PolarHBondContact O-N 3.47Å; H140-H142 PolarHBondContact O-N 2.78Å; H140-H143 PolarHBondContact O-N 3.26Å; H140-I144 PolarHBondContact CD2-O 3.02Å; H140-I144 PolarHBondContact N-O 2.85Å; H140-Y173 PolarHBondContact O-OH 2.84Å; H140-Y173 VanDerWaalsContact O-OH 3.12Å; H140-D205 IonicContact CD2-OD2 2.69Å; H140-D205 IonicContact CE1-OD2 2.78Å; H140-D205 IonicContact NE2-OD2 3.14Å; H140-D205 PolarHBondContact NE2-OD2 2.89Å
141	R	93.1	Very high	95	Very high	160 Å²	160	20.5 Å²	20.5	60%	0.604	9%	0.089	S	C	*	.	H	α-helix	trans	-64.2	-21.5	173.4	-70	166.3	-170.1	-133.3	5.4	114.8	D137 Y138 C139 H143	D137-R141 WeakPolarHBondContact O-CB 3.45Å; D137-R141 WeakPolarHBondContact O-CD 2.89Å; D137-R141 WeakPolarHBondContact O-CG 3.35Å; D137-R141 PolarHBondContact O-N 3.11Å; D137-R141 IonicContact OD1-CZ 3.6Å; D137-R141 IonicContact OD1-NE 2.69Å; D137-R141 PolarHBondContact OD1-NE 3.42Å; D137-R141 IonicContact OD1-NH2 2.78Å; D137-R141 PolarHBondContact OD1-NH2 3.3Å; D137-R141 IonicContact OD2-CZ 2.85Å; D137-R141 IonicContact OD2-NE 3.86Å; D137-R141 PolarHBondContact OD2-NE 2.85Å; D137-R141 IonicContact OD2-NH2 2.82Å; D137-R141 PolarHBondContact OD2-NH2 3.37Å; Y138-R141 PolarHBondContact O-N 3.16Å; C139-R141 VanDerWaalsContact C-N 3.31Å; C139-R141 PolarHBondContact O-N 3.43Å; R141-H143 VanDerWaalsContact C-N 3.31Å
142	H	93.6	Very high	94.7	Very high	77 Å²	77	21.6 Å²	21.6	36%	0.356	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	19.4	173.8	-68.3	76.8	0	0	0	111.8	L80 Y138 C139 H140 I144	L80-H142 HydrophobicContact CD2-CB 4.45Å; Y138-H142 AromaticContact CD2-CE1 3.65Å; Y138-H142 AromaticContact CD2-ND1 3.94Å; Y138-H142 AromaticContact CE2-CE1 3.18Å; Y138-H142 WeakPolarHBondContact CE2-CE1 3.46Å; Y138-H142 AromaticContact CE2-ND1 3.8Å; Y138-H142 AromaticContact CE2-NE2 3.99Å; Y138-H142 AromaticContact CZ-CE1 3.51Å; Y138-H142 AromaticContact CZ-ND1 3.92Å; Y138-H142 PolarHBondContact O-N 3.25Å; Y138-H142 PolarHBondContact O-ND1 3.2Å; C139-H142 CarbonylContact O-C 3.34Å; C139-H142 WeakPolarHBondContact O-CA 3.43Å; C139-H142 PolarHBondContact O-N 2.96Å; H140-H142 PolarHBondContact O-N 2.78Å; H142-I144 HydrophobicContact CB-CD1 3.99Å; H142-I144 WeakPolarHBondContact O-CG1 3.36Å; H142-I144 PolarHBondContact O-N 2.97Å
143	H	94.4	Very high	94.6	Very high	96 Å²	96	22 Å²	22	44%	0.444	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	29.5	-178.5	-68.9	-91.6	0	0	0	113.6	C139 H140 R141 F172 Y173	C139-H143 PolarHBondContact O-N 2.66Å; H140-H143 PolarHBondContact O-N 3.26Å; R141-H143 VanDerWaalsContact C-N 3.31Å; H143-F172 CarbonylContact O-C 3.45Å; H143-F172 WeakPolarHBondContact O-CA 3.4Å; H143-Y173 VanDerWaalsContact C-CD1 3.41Å; H143-Y173 VanDerWaalsContact C-CE1 3.48Å; H143-Y173 WeakPolarHBondContact CB-O 3.5Å; H143-Y173 PolarHBondContact ND1-O 3.14Å; H143-Y173 VanDerWaalsContact O-CD1 3.31Å; H143-Y173 WeakPolarHBondContact O-CD1 3.32Å; H143-Y173 PolarHBondContact O-N 2.95Å
144	I	95.3	Very high	94.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.8	-178.3	-68.2	156.1	0	0	0	110.1	I76 L79 L80 C139 H140 H142 N171 F172	I76-I144 HydrophobicContact CD1-CG2 4.3Å; I76-I144 HydrophobicContact CG1-CD1 4.42Å; I76-I144 HydrophobicContact CG1-CG1 4.3Å; I76-I144 HydrophobicContact CG1-CG2 4.36Å; I76-I144 HydrophobicContact CG2-CD1 4.22Å; I76-I144 HydrophobicContact CG2-CG2 3.83Å; L79-I144 HydrophobicContact CD1-CD1 4.46Å; L80-I144 HydrophobicContact CD1-CD1 4.42Å; L80-I144 HydrophobicContact CD2-CD1 3.92Å; L80-I144 HydrophobicContact CG-CD1 4.13Å; C139-I144 CarbonylContact C-O 3.14Å; C139-I144 HydrophobicContact CB-CB 4.37Å; C139-I144 HydrophobicContact CB-CG2 4.32Å; C139-I144 WeakPolarHBondContact CB-O 3.09Å; C139-I144 PolarHBondContact O-N 2.99Å; C139-I144 VanDerWaalsContact O-O 3.12Å; H140-I144 PolarHBondContact CD2-O 3.02Å; H140-I144 PolarHBondContact N-O 2.85Å; H142-I144 HydrophobicContact CB-CD1 3.99Å; H142-I144 WeakPolarHBondContact O-CG1 3.36Å; H142-I144 PolarHBondContact O-N 2.97Å; I144-N171 WeakPolarHBondContact CA-O 3.49Å; I144-F172 HydrophobicContact CD1-CD1 4.46Å; I144-F172 HydrophobicContact CD1-CE1 3.91Å; I144-F172 HydrophobicContact CG1-CD1 3.66Å; I144-F172 HydrophobicContact CG1-CE1 3.58Å
145	V	95.1	Very high	94.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	143.7	171.9	-74.8	0	0	0	0	111.1	R147 G170 N171 Y173 L179 P202 D205	V145-R147 HydrophobicContact CB-CG 4.24Å; V145-R147 HydrophobicContact CG2-CG 4.01Å; V145-G170 VanDerWaalsContact O-CA 3.28Å; V145-G170 WeakPolarHBondContact O-CA 3.49Å; V145-N171 PolarHBondContact N-O 3.11Å; V145-N171 PolarHBondContact O-N 2.78Å; V145-N171 VanDerWaalsContact O-N 3.1Å; V145-Y173 HydrophobicContact CB-CD1 4.39Å; V145-Y173 HydrophobicContact CG1-CD1 3.53Å; V145-Y173 HydrophobicContact CG1-CE1 3.8Å; V145-Y173 HydrophobicContact CG1-CG 4.19Å; V145-Y173 HydrophobicContact CG2-CD1 4.27Å; V145-L179 HydrophobicContact CG2-CD1 3.95Å; V145-P202 HydrophobicContact CG1-CG 4.02Å; V145-D205 WeakPolarHBondContact CA-OD2 3.14Å
146	H	95	Very high	94.6	Very high	2 Å²	2	24 Å²	24	1%	0.009	11%	0.106	C	C	.	.			trans	-87.5	-42.4	-170	-166.3	-80	0	0	0	112.8	D148 L149 A165 D166 F167 D205	H146-D148 PolarHBondContact CE1-O 2.9Å; H146-D148 PolarHBondContact ND1-O 3.12Å; H146-D148 PolarHBondContact O-N 3.1Å; H146-L149 HydrophobicContact CB-CD1 4.49Å; H146-L149 HydrophobicContact CB-CD2 3.88Å; H146-L149 HydrophobicContact CB-CG 3.9Å; H146-A165 PolarHBondContact NE2-O 3.3Å; H146-D166 PolarHBondContact CE1-O 3.35Å; H146-F167 AromaticContact CD2-CD1 3.68Å; H146-F167 AromaticContact CD2-CE1 3.55Å; H146-D205 PolarHBondContact N-OD1 3Å; H146-D205 PolarHBondContact N-OD2 2.85Å
147	R	93.3	Very high	94.5	Very high	10 Å²	10	24.9 Å²	24.9	4%	0.038	11%	0.111	C	C	.	.	S	Bend	trans	61.7	-8.3	175.2	-50.1	-169.4	-60.9	174.5	-1.8	117.6	V145 F169 T181 G184 Y199 L204 D205	V145-R147 HydrophobicContact CB-CG 4.24Å; V145-R147 HydrophobicContact CG2-CG 4.01Å; R147-F169 PolarHBondContact NE-O 2.93Å; R147-F169 PolarHBondContact NH2-O 3.07Å; R147-T181 PolarHBondContact NH1-OG1 2.96Å; R147-G184 WeakPolarHBondContact O-CA 3.29Å; R147-Y199 PolarHBondContact NH1-OH 3.39Å; R147-L204 HydrophobicContact CB-CD2 4.43Å; R147-D205 PolarHBondContact N-OD1 2.85Å
148	D	92.7	Very high	94.3	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.011	13%	0.126	C	C	.	.			trans	-132.9	53.5	169.6	-162.9	32.2	0	0	0	112	H146 K150 N153 F169 G184 S185	H146-D148 PolarHBondContact CE1-O 2.9Å; H146-D148 PolarHBondContact ND1-O 3.12Å; H146-D148 PolarHBondContact O-N 3.1Å; D148-K150 PolarHBondContact O-N 2.79Å; D148-K150 IonicContact OD1-NZ 3.29Å; D148-K150 IonicContact OD2-NZ 3.37Å; D148-K150 PolarHBondContact OD2-NZ 3.03Å; D148-N153 PolarHBondContact O-ND2 2.87Å; D148-F169 HydrophobicContact CB-CB 3.95Å; D148-F169 HydrophobicContact CB-CD2 3.62Å; D148-F169 HydrophobicContact CB-CG 4.09Å; D148-F169 WeakPolarHBondContact OD2-CD2 3.5Å; D148-G184 WeakPolarHBondContact OD1-CA 3.46Å; D148-S185 VanDerWaalsContact OD1-CB 3.25Å; D148-S185 WeakPolarHBondContact OD1-CB 3.43Å; D148-S185 PolarHBondContact OD1-N 2.93Å; D148-S185 PolarHBondContact OD1-OG 3.31Å
149	L	95.5	Very high	94.1	Very high	3 Å²	3	32 Å²	32	2%	0.016	16%	0.157	C	C	.	.			trans	-75.2	115	173.9	-69.2	174.3	0	0	0	110.3	V136 H146 L164 Y188 D205 L209	V136-L149 HydrophobicContact CG1-CD1 4.42Å; V136-L149 HydrophobicContact CG2-CD1 3.86Å; V136-L149 HydrophobicContact CG2-CD2 4.09Å; H146-L149 HydrophobicContact CB-CD1 4.49Å; H146-L149 HydrophobicContact CB-CD2 3.88Å; H146-L149 HydrophobicContact CB-CG 3.9Å; L149-L164 HydrophobicContact CD2-CD1 3.57Å; L149-L164 HydrophobicContact CD2-CD2 4.32Å; L149-Y188 WeakPolarHBondContact O-CD1 3.38Å; L149-D205 HydrophobicContact CD1-CB 3.72Å; L149-L209 HydrophobicContact CD1-CD2 4.11Å; L149-L209 HydrophobicContact CD1-CG 4.08Å
150	K	93.6	Very high	94	Very high	15 Å²	15	35 Å²	35	7%	0.065	17%	0.171	C	C	.	.			trans	-150.8	161.1	-177.6	63.1	-176.5	-167	-77.5	0	111	D148 E152 N153 L154 S185 Y188	D148-K150 PolarHBondContact O-N 2.79Å; D148-K150 IonicContact OD1-NZ 3.29Å; D148-K150 IonicContact OD2-NZ 3.37Å; D148-K150 PolarHBondContact OD2-NZ 3.03Å; K150-E152 WeakPolarHBondContact CB-OE2 3.39Å; K150-E152 HydrophobicContact CD-CB 4.2Å; K150-E152 HydrophobicContact CG-CB 4.09Å; K150-E152 PolarHBondContact O-N 2.87Å; K150-N153 WeakPolarHBondContact CE-OD1 3.25Å; K150-N153 HydrophobicContact CG-CB 3.87Å; K150-N153 PolarHBondContact NZ-ND2 3.45Å; K150-N153 PolarHBondContact NZ-OD1 2.82Å; K150-N153 PolarHBondContact O-N 2.86Å; K150-L154 PolarHBondContact O-N 2.99Å; K150-S185 WeakPolarHBondContact CD-OG 3.37Å; K150-Y188 HydrophobicContact CB-CD1 4.15Å; K150-Y188 HydrophobicContact CB-CD2 3.63Å; K150-Y188 HydrophobicContact CB-CE1 3.98Å; K150-Y188 HydrophobicContact CB-CE2 3.39Å; K150-Y188 HydrophobicContact CB-CG 3.99Å
151	T	92.1	Very high	94	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-66.9	-20.3	-177.9	50.9	0	0	0	0	113.8	F111 L114 Y188 V215	F111-T151 PolarHBondContact N-O 2.79Å; L114-T151 HydrophobicContact CD1-CG2 4.07Å; T151-Y188 PolarHBondContact N-OH 2.57Å; T151-Y188 PolarHBondContact OG1-OH 3.35Å; T151-V215 HydrophobicContact CG2-CB 4.37Å; T151-V215 HydrophobicContact CG2-CG1 3.73Å
152	E	91.1	Very high	94.2	Very high	41 Å²	41	28.9 Å²	28.9	19%	0.192	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-72.5	-30.3	172.6	-50	93.3	108.8	0	0	111.9	E109 F111 K150 L154 Y188	E109-E152 WeakPolarHBondContact OE2-CA 3.35Å; E109-E152 WeakPolarHBondContact OE2-CB 3.38Å; F111-E152 HydrophobicContact CB-CG 4.01Å; F111-E152 HydrophobicContact CD2-CG 3.89Å; F111-E152 HydrophobicContact CG-CG 3.99Å; K150-E152 WeakPolarHBondContact CB-OE2 3.39Å; K150-E152 HydrophobicContact CD-CB 4.2Å; K150-E152 HydrophobicContact CG-CB 4.09Å; K150-E152 PolarHBondContact O-N 2.87Å; E152-L154 VanDerWaalsContact C-N 3.31Å; E152-Y188 PolarHBondContact OE2-OH 2.9Å
153	N	94.4	Very high	94.4	Very high	11 Å²	11	26.1 Å²	26.1	6%	0.059	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-90.2	7.8	176.5	-76	8.7	0	0	0	113	D148 K150 A165	D148-N153 PolarHBondContact O-ND2 2.87Å; K150-N153 WeakPolarHBondContact CE-OD1 3.25Å; K150-N153 HydrophobicContact CG-CB 3.87Å; K150-N153 PolarHBondContact NZ-ND2 3.45Å; K150-N153 PolarHBondContact NZ-OD1 2.82Å; K150-N153 PolarHBondContact O-N 2.86Å; N153-A165 WeakPolarHBondContact CB-O 3.19Å; N153-A165 PolarHBondContact O-N 3.33Å
154	L	96.8	Very high	94.5	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	110.1	174.4	-66.1	175.9	0	0	0	108.3	M110 I132 K150 E152 I162 L164 V212	M110-L154 HydrophobicContact CB-CB 3.94Å; M110-L154 WeakPolarHBondContact CB-O 3.5Å; M110-L154 PolarHBondContact N-O 2.91Å; I132-L154 HydrophobicContact CD1-CD1 3.66Å; I132-L154 HydrophobicContact CG1-CD1 4.04Å; I132-L154 HydrophobicContact CG1-CD2 4.1Å; I132-L154 HydrophobicContact CG2-CD2 4.38Å; K150-L154 PolarHBondContact O-N 2.99Å; E152-L154 VanDerWaalsContact C-N 3.31Å; L154-I162 HydrophobicContact CD2-CG2 3.96Å; L154-L164 HydrophobicContact CD2-CB 4.49Å; L154-L164 HydrophobicContact CD2-CD1 3.8Å; L154-V212 HydrophobicContact CD1-CG1 3.78Å
155	L	96.7	Very high	94.5	Very high	39 Å²	39	22.1 Å²	22.1	20%	0.204	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	163.3	-178.6	-50.5	-176.8	0	0	0	111.5	I86 A105 G108 E109 I162 K163 A165	I86-L155 HydrophobicContact CD1-CD1 4.13Å; I86-L155 HydrophobicContact CG1-CD1 4.19Å; A105-L155 HydrophobicContact CB-CB 3.45Å; A105-L155 VanDerWaalsContact CB-CB 3.45Å; A105-L155 HydrophobicContact CB-CD1 4.02Å; A105-L155 HydrophobicContact CB-CG 4.37Å; G108-L155 CarbonylContact O-C 3.47Å; G108-L155 VanDerWaalsContact O-CA 3.32Å; G108-L155 WeakPolarHBondContact O-CA 3.48Å; E109-L155 HydrophobicContact CB-CD2 4.4Å; E109-L155 HydrophobicContact CG-CD2 3.72Å; L155-I162 CarbonylContact O-C 3.58Å; L155-I162 WeakPolarHBondContact O-CA 3.18Å; L155-K163 HydrophobicContact CB-CB 4.36Å; L155-K163 PolarHBondContact N-O 2.78Å; L155-K163 PolarHBondContact O-N 2.84Å; L155-A165 HydrophobicContact CD1-CB 3.74Å; L155-A165 HydrophobicContact CG-CB 3.89Å
156	L	96.4	Very high	94.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.1	-178.2	-65.9	169.9	0	0	0	111.7	A105 K106 N107 G108 M110 H113 M160 N161 I162	A105-L156 CarbonylContact C-O 3.59Å; A105-L156 WeakPolarHBondContact CB-O 3.33Å; K106-L156 PolarHBondContact N-O 2.96Å; N107-L156 HydrophobicContact CB-CB 3.75Å; N107-L156 PolarHBondContact N-O 3.44Å; G108-L156 PolarHBondContact O-N 2.96Å; M110-L156 HydrophobicContact SD-CD1 4.2Å; M110-L156 HydrophobicContact SD-CD2 4.03Å; M110-L156 HydrophobicContact SD-CG 4.44Å; H113-L156 HydrophobicContact CB-CD1 3.74Å; L156-M160 HydrophobicContact CD1-CE 3.87Å; L156-M160 HydrophobicContact CD1-SD 4.45Å; L156-N161 WeakPolarHBondContact CA-O 3.22Å; L156-I162 HydrophobicContact CD2-CD1 4.1Å
157	D	93.8	Very high	94	Very high	21 Å²	21	24.9 Å²	24.9	11%	0.112	14%	0.136	C	C	.	.			trans	-70.1	178.9	175.6	82.7	1.4	0	0	0	112.4	N107 N159 M160 N161 K163	N107-D157 PolarHBondContact ND2-O 3.06Å; D157-N159 PolarHBondContact O-N 3.36Å; D157-N159 VanDerWaalsContact O-N 3.1Å; D157-N159 VanDerWaalsContact OD1-CA 3.25Å; D157-N159 WeakPolarHBondContact OD1-CA 3.47Å; D157-N159 WeakPolarHBondContact OD1-CB 3.46Å; D157-N159 PolarHBondContact OD1-N 3.32Å; D157-M160 PolarHBondContact O-N 2.77Å; D157-M160 PolarHBondContact OD1-N 2.78Å; D157-N161 PolarHBondContact N-O 3.03Å; D157-N161 PolarHBondContact OD1-N 3.36Å; D157-N161 PolarHBondContact OD1-ND2 3.5Å; D157-N161 WeakPolarHBondContact OD2-CB 3.18Å; D157-N161 PolarHBondContact OD2-ND2 3.43Å; D157-K163 HydrophobicContact CB-CG 4.1Å
158	A	91.6	Very high	93.7	Very high	50 Å²	50	25.4 Å²	25.4	41%	0.413	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.1	179.7	0	0	0	0	0	114.4	K106	K106-A158 HydrophobicContact CD-CB 3.93Å
159	N	91.3	Very high	93.3	Very high	128 Å²	128	28 Å²	28	68%	0.684	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	12.7	-177.8	-66.8	83.3	0	0	0	111.8	D157 N161	D157-N159 PolarHBondContact O-N 3.36Å; D157-N159 VanDerWaalsContact O-N 3.1Å; D157-N159 VanDerWaalsContact OD1-CA 3.25Å; D157-N159 WeakPolarHBondContact OD1-CA 3.47Å; D157-N159 WeakPolarHBondContact OD1-CB 3.46Å; D157-N159 PolarHBondContact OD1-N 3.32Å; N159-N161 VanDerWaalsContact C-N 3.26Å; N159-N161 PolarHBondContact O-N 3.23Å
160	M	94.1	Very high	93	Very high	62 Å²	62	28 Å²	28	31%	0.305	16%	0.156	S	C	.	.	S	Bend	trans	64.6	17.1	-176.4	-58.9	-69.1	-71.8	0	0	114.8	N107 H113 K128 L156 D157	N107-M160 HydrophobicContact CB-SD 3.79Å; N107-M160 PolarHBondContact ND2-SD 3.42Å; H113-M160 VanDerWaalsContact CD2-CE 3.43Å; H113-M160 WeakPolarHBondContact CD2-CE 3.49Å; K128-M160 WeakPolarHBondContact CE-O 3.35Å; K128-M160 PolarHBondContact NZ-O 3.25Å; L156-M160 HydrophobicContact CD1-CE 3.87Å; L156-M160 HydrophobicContact CD1-SD 4.45Å; D157-M160 PolarHBondContact O-N 2.77Å; D157-M160 PolarHBondContact OD1-N 2.78Å
161	N	94.9	Very high	93	Very high	47 Å²	47	28.8 Å²	28.8	25%	0.251	16%	0.161	S	C	.	.			trans	-74.6	153.4	171.9	-53.5	-62.8	0	0	0	111.3	Q131 L156 D157 N159	Q131-N161 PolarHBondContact NE2-OD1 3.13Å; L156-N161 WeakPolarHBondContact CA-O 3.22Å; D157-N161 PolarHBondContact N-O 3.03Å; D157-N161 PolarHBondContact OD1-N 3.36Å; D157-N161 PolarHBondContact OD1-ND2 3.5Å; D157-N161 WeakPolarHBondContact OD2-CB 3.18Å; D157-N161 PolarHBondContact OD2-ND2 3.43Å; N159-N161 VanDerWaalsContact C-N 3.26Å; N159-N161 PolarHBondContact O-N 3.23Å
162	I	96.9	Very high	92.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	139	173.5	-62.9	-67.2	0	0	0	110.9	H84 M110 K128 Q131 I132 L154 L155 L156	H84-I162 WeakPolarHBondContact CA-O 3.23Å; H84-I162 WeakPolarHBondContact CB-O 3.28Å; H84-I162 PolarHBondContact ND1-O 3.07Å; M110-I162 HydrophobicContact SD-CD1 4.25Å; K128-I162 HydrophobicContact CB-CD1 4.13Å; K128-I162 HydrophobicContact CB-CG1 3.93Å; K128-I162 HydrophobicContact CD-CD1 4.29Å; K128-I162 HydrophobicContact CD-CG1 4.03Å; K128-I162 HydrophobicContact CG-CD1 4.45Å; K128-I162 HydrophobicContact CG-CG1 4.43Å; Q131-I162 HydrophobicContact CB-CB 3.92Å; Q131-I162 HydrophobicContact CB-CG1 4.18Å; I132-I162 HydrophobicContact CD1-CD1 4.43Å; I132-I162 HydrophobicContact CD1-CG1 4.47Å; I132-I162 HydrophobicContact CG1-CB 4.39Å; I132-I162 HydrophobicContact CG1-CD1 4.34Å; I132-I162 HydrophobicContact CG1-CG1 4.01Å; I132-I162 HydrophobicContact CG1-CG2 3.78Å; L154-I162 HydrophobicContact CD2-CG2 3.96Å; L155-I162 CarbonylContact O-C 3.58Å; L155-I162 WeakPolarHBondContact O-CA 3.18Å; L156-I162 HydrophobicContact CD2-CD1 4.1Å
163	K	97.1	Very high	92.9	Very high	18 Å²	18	31.2 Å²	31.2	8%	0.078	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	109.3	165.4	-65.4	-72.1	-177.6	154	0	109.1	P83 I86 E103 L155 D157	P83-K163 WeakPolarHBondContact O-CD 3.46Å; P83-K163 WeakPolarHBondContact O-CE 3.43Å; P83-K163 PolarHBondContact O-NZ 3.35Å; I86-K163 HydrophobicContact CD1-CB 3.61Å; I86-K163 HydrophobicContact CD1-CG 4.19Å; I86-K163 HydrophobicContact CG1-CB 3.94Å; E103-K163 WeakPolarHBondContact OE1-CE 3.36Å; E103-K163 IonicContact OE1-NZ 3.14Å; E103-K163 PolarHBondContact OE1-NZ 3.43Å; E103-K163 WeakPolarHBondContact OE2-CE 3.24Å; E103-K163 IonicContact OE2-NZ 3.42Å; E103-K163 PolarHBondContact OE2-NZ 3.49Å; L155-K163 HydrophobicContact CB-CB 4.36Å; L155-K163 PolarHBondContact N-O 2.78Å; L155-K163 PolarHBondContact O-N 2.84Å; D157-K163 HydrophobicContact CB-CG 4.1Å
164	L	97.4	Very high	92.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.4	175.5	178.2	62.3	0	0	0	110.8	H84 I85 I86 A135 V136 L149 L154 F167	H84-L164 PolarHBondContact O-N 2.89Å; I85-L164 HydrophobicContact CG1-CB 4.31Å; I86-L164 PolarHBondContact N-O 3.23Å; A135-L164 HydrophobicContact CB-CB 4.41Å; A135-L164 HydrophobicContact CB-CD2 4.26Å; V136-L164 HydrophobicContact CG2-CD2 4.29Å; L149-L164 HydrophobicContact CD2-CD1 3.57Å; L149-L164 HydrophobicContact CD2-CD2 4.32Å; L154-L164 HydrophobicContact CD2-CB 4.49Å; L154-L164 HydrophobicContact CD2-CD1 3.8Å; L164-F167 HydrophobicContact CD2-CZ 4.19Å; L164-F167 HydrophobicContact CG-CZ 4.34Å
165	A	94.9	Very high	91.8	Very high	12 Å²	12	38.7 Å²	38.7	10%	0.099	22%	0.223	C	C	.	.			trans	-140.7	166.6	-171.8	0	0	0	0	0	113.3	I86 H146 N153 L155	I86-A165 HydrophobicContact CG1-CB 3.81Å; H146-A165 PolarHBondContact NE2-O 3.3Å; N153-A165 WeakPolarHBondContact CB-O 3.19Å; N153-A165 PolarHBondContact O-N 3.33Å; L155-A165 HydrophobicContact CD1-CB 3.74Å; L155-A165 HydrophobicContact CG-CB 3.89Å
166	D	88.9	Confident	91	Very high	55 Å²	55	39.9 Å²	39.9	29%	0.294	24%	0.244	S	C	.	.			trans	59.7	75.8	177.8	-167.5	28.6	0	0	0	115.7	K55 H146 G168	K55-D166 IonicContact NZ-OD1 3.4Å; K55-D166 PolarHBondContact NZ-OD1 2.96Å; H146-D166 PolarHBondContact CE1-O 3.35Å; D166-G168 PolarHBondContact O-N 2.9Å; D166-G168 PolarHBondContact OD1-N 3.46Å
167	F	91.4	Very high	90.5	Very high	5 Å²	5	45.4 Å²	45.4	2%	0.022	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-77.7	17.4	171.4	-66.3	-92.2	0	0	0	113.3	E73 I76 M77 L80 I85 H146 L164 F169 G170	E73-F167 HydrophobicContact CG-CB 4.1Å; I76-F167 HydrophobicContact CG2-CB 3.96Å; I76-F167 HydrophobicContact CG2-CD1 3.55Å; I76-F167 HydrophobicContact CG2-CE1 4.16Å; I76-F167 HydrophobicContact CG2-CG 3.77Å; M77-F167 HydrophobicContact CG-CD2 4.05Å; L80-F167 HydrophobicContact CD1-CD1 4.17Å; L80-F167 HydrophobicContact CD1-CE1 3.47Å; L80-F167 VanDerWaalsContact CD1-CE1 3.47Å; L80-F167 HydrophobicContact CD1-CE2 4.09Å; L80-F167 HydrophobicContact CD1-CZ 3.44Å; L80-F167 VanDerWaalsContact CD1-CZ 3.44Å; I85-F167 HydrophobicContact CD1-CZ 4.48Å; I85-F167 HydrophobicContact CG2-CE2 3.71Å; I85-F167 HydrophobicContact CG2-CZ 3.81Å; H146-F167 AromaticContact CD2-CD1 3.68Å; H146-F167 AromaticContact CD2-CE1 3.55Å; L164-F167 HydrophobicContact CD2-CZ 4.19Å; L164-F167 HydrophobicContact CG-CZ 4.34Å; F167-F169 PolarHBondContact O-N 3.24Å; F167-F169 VanDerWaalsContact O-N 3.16Å; F167-G170 WeakPolarHBondContact O-CA 3.45Å; F167-G170 PolarHBondContact O-N 3.35Å
168	G	86.2	Confident	89.9	Confident	20 Å²	20	47.5 Å²	47.5	21%	0.206	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-61.5	-21.6	-178.6	0	0	0	0	0	115.2	D166	D166-G168 PolarHBondContact O-N 2.9Å; D166-G168 PolarHBondContact OD1-N 3.46Å
169	F	84.3	Confident	89.6	Confident	58 Å²	58	46.1 Å²	46.1	25%	0.254	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-99.7	-3	169.4	-69.9	-72.4	0	0	0	114	R147 D148 F167 C183	R147-F169 PolarHBondContact NE-O 2.93Å; R147-F169 PolarHBondContact NH2-O 3.07Å; D148-F169 HydrophobicContact CB-CB 3.95Å; D148-F169 HydrophobicContact CB-CD2 3.62Å; D148-F169 HydrophobicContact CB-CG 4.09Å; D148-F169 WeakPolarHBondContact OD2-CD2 3.5Å; F167-F169 PolarHBondContact O-N 3.24Å; F167-F169 VanDerWaalsContact O-N 3.16Å; F169-C183 HydrophobicContact CD1-CB 3.89Å
170	G	89.7	Confident	89.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.01	26%	0.263	C	S	.	.			trans	-61.6	154.6	-177.8	0	0	0	0	0	113.3	R72 V145 F167	R72-G170 PolarHBondContact NE-O 2.94Å; R72-G170 PolarHBondContact NH2-O 2.83Å; V145-G170 VanDerWaalsContact O-CA 3.28Å; V145-G170 WeakPolarHBondContact O-CA 3.49Å; F167-G170 WeakPolarHBondContact O-CA 3.45Å; F167-G170 PolarHBondContact O-N 3.35Å
171	N	92.1	Very high	88.5	Confident	33 Å²	33	44 Å²	44	18%	0.176	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	160.6	172.1	-155.2	33.1	0	0	0	111.4	R72 I144 V145 L179	R72-N171 WeakPolarHBondContact CD-OD1 3.28Å; R72-N171 PolarHBondContact NE-OD1 2.96Å; I144-N171 WeakPolarHBondContact CA-O 3.49Å; V145-N171 PolarHBondContact N-O 3.11Å; V145-N171 PolarHBondContact O-N 2.78Å; V145-N171 VanDerWaalsContact O-N 3.1Å; N171-L179 VanDerWaalsContact ND2-CD2 3.29Å; N171-L179 WeakPolarHBondContact ND2-CD2 3.46Å
172	F	92.1	Very high	87.8	Confident	56 Å²	56	48.6 Å²	48.6	25%	0.246	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	154.8	159.7	-59	-74.7	0	0	0	110.1	R72 Q75 I76 L79 H143 I144	R72-F172 HydrophobicContact CG-CD2 4.37Å; R72-F172 HydrophobicContact CG-CE2 4.05Å; Q75-F172 HydrophobicContact CG-CE2 4.39Å; Q75-F172 HydrophobicContact CG-CZ 4.18Å; I76-F172 HydrophobicContact CG1-CE1 4.17Å; I76-F172 HydrophobicContact CG1-CE2 4.06Å; I76-F172 HydrophobicContact CG1-CZ 3.73Å; L79-F172 HydrophobicContact CD1-CE1 3.69Å; L79-F172 HydrophobicContact CD1-CZ 3.81Å; H143-F172 CarbonylContact O-C 3.45Å; H143-F172 WeakPolarHBondContact O-CA 3.4Å; I144-F172 HydrophobicContact CD1-CD1 4.46Å; I144-F172 HydrophobicContact CD1-CE1 3.91Å; I144-F172 HydrophobicContact CG1-CD1 3.66Å; I144-F172 HydrophobicContact CG1-CE1 3.58Å
173	Y	90.9	Very high	87	Confident	35 Å²	35	49.4 Å²	49.4	14%	0.137	29%	0.288	C	S	.	.			trans	-141.9	141.2	172.8	80.9	-81.7	0	0	0	111	H140 H143 V145 E200 P202	H140-Y173 PolarHBondContact O-OH 2.84Å; H140-Y173 VanDerWaalsContact O-OH 3.12Å; H143-Y173 VanDerWaalsContact C-CD1 3.41Å; H143-Y173 VanDerWaalsContact C-CE1 3.48Å; H143-Y173 WeakPolarHBondContact CB-O 3.5Å; H143-Y173 PolarHBondContact ND1-O 3.14Å; H143-Y173 VanDerWaalsContact O-CD1 3.31Å; H143-Y173 WeakPolarHBondContact O-CD1 3.32Å; H143-Y173 PolarHBondContact O-N 2.95Å; V145-Y173 HydrophobicContact CB-CD1 4.39Å; V145-Y173 HydrophobicContact CG1-CD1 3.53Å; V145-Y173 HydrophobicContact CG1-CE1 3.8Å; V145-Y173 HydrophobicContact CG1-CG 4.19Å; V145-Y173 HydrophobicContact CG2-CD1 4.27Å; Y173-E200 WeakPolarHBondContact CB-O 3.45Å; Y173-P202 HydrophobicContact CD2-CG 4.16Å; Y173-P202 HydrophobicContact CE1-CG 3.91Å; Y173-P202 HydrophobicContact CE2-CG 3.53Å; Y173-P202 WeakPolarHBondContact OH-CG 3.34Å
174	N	86.6	Confident	86.2	Confident	83 Å²	83	49 Å²	49	44%	0.444	29%	0.288	S	S	.	.			trans	-111.8	144.9	173.2	-62.8	-44.3	0	0	0	109.1	G176 E177	N174-G176 PolarHBondContact O-N 2.95Å; N174-E177 HydrophobicContact CB-CB 4.08Å; N174-E177 HydrophobicContact CB-CG 4.03Å; N174-E177 WeakPolarHBondContact CB-OE2 3.49Å; N174-E177 PolarHBondContact ND2-OE2 3.08Å; N174-E177 PolarHBondContact O-N 3.31Å; N174-E177 VanDerWaalsContact O-N 3.11Å
175	A	81.2	Confident	85.6	Confident	88 Å²	88	49.2 Å²	49.2	73%	0.727	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	124.9	177	0	0	0	0	0	109.7
176	G	78.6	Confident	85.4	Confident	63 Å²	63	50.8 Å²	50.8	65%	0.649	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-5.5	-173.9	0	0	0	0	0	116.1	N174 P178	N174-G176 PolarHBondContact O-N 2.95Å; G176-P178 WeakPolarHBondContact O-CD 3.17Å
177	E	85.6	Confident	85.5	Confident	117 Å²	117	48.6 Å²	48.6	55%	0.547	29%	0.288	S	S	.	.			trans	-103.2	103.6	171.5	-65.9	-170.8	157.3	0	0	110.3	N174	N174-E177 HydrophobicContact CB-CB 4.08Å; N174-E177 HydrophobicContact CB-CG 4.03Å; N174-E177 WeakPolarHBondContact CB-OE2 3.49Å; N174-E177 PolarHBondContact ND2-OE2 3.08Å; N174-E177 PolarHBondContact O-N 3.31Å; N174-E177 VanDerWaalsContact O-N 3.11Å
178	P	82.2	Confident	85.6	Confident	66 Å²	66	48.8 Å²	48.8	43%	0.429	29%	0.289	S	S	.	.			trans	-73.8	145.3	-175.2	27	-33.1	0	0	0	113.6	G176 E198	G176-P178 WeakPolarHBondContact O-CD 3.17Å; P178-E198 HydrophobicContact CB-CB 3.65Å; P178-E198 HydrophobicContact CB-CG 3.85Å; P178-E198 HydrophobicContact CG-CB 4.34Å; P178-E198 HydrophobicContact CG-CG 4.19Å; P178-E198 WeakPolarHBondContact CG-OE2 3.19Å
179	L	84.4	Confident	86	Confident	20 Å²	20	48.2 Å²	48.2	11%	0.105	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-94.6	134.8	167.6	-58.8	176.1	0	0	0	109.6	V145 N171 E198 Y199	V145-L179 HydrophobicContact CG2-CD1 3.95Å; N171-L179 VanDerWaalsContact ND2-CD2 3.29Å; N171-L179 WeakPolarHBondContact ND2-CD2 3.46Å; L179-E198 WeakPolarHBondContact O-CA 3.45Å; L179-Y199 HydrophobicContact CB-CD2 3.89Å; L179-Y199 HydrophobicContact CB-CE1 4.45Å; L179-Y199 HydrophobicContact CB-CE2 3.45Å; L179-Y199 VanDerWaalsContact CB-CE2 3.45Å; L179-Y199 WeakPolarHBondContact CB-O 3.41Å; L179-Y199 HydrophobicContact CD1-CD2 4.49Å; L179-Y199 HydrophobicContact CD1-CE2 3.9Å; L179-Y199 HydrophobicContact CG-CE2 4.29Å; L179-Y199 PolarHBondContact N-O 3.48Å; L179-Y199 WeakPolarHBondContact O-CD1 3.45Å; L179-Y199 WeakPolarHBondContact O-CE1 3.43Å; L179-Y199 PolarHBondContact O-N 3.29Å
180	S	81.5	Confident	86.4	Confident	76 Å²	76	45.4 Å²	45.4	53%	0.531	27%	0.27	S	S	.	.			trans	-115.1	0.8	179.6	57	0	0	0	0	113.8	W182	S180-W182 PolarHBondContact O-N 2.91Å
181	T	81.7	Confident	86.6	Confident	71 Å²	71	45.4 Å²	45.4	44%	0.436	27%	0.27	S	S	.	.			trans	-71.7	121.2	-173.2	-33.7	0	0	0	0	112.2	R147 C183 Y199	R147-T181 PolarHBondContact NH1-OG1 2.96Å; T181-C183 PolarHBondContact O-N 2.6Å; T181-C183 PolarHBondContact O-SG 3.49Å; T181-Y199 PolarHBondContact O-OH 3.19Å
182	W	79.7	Confident	86.7	Confident	143 Å²	143	44.1 Å²	44.1	54%	0.542	26%	0.263	S	S	.	.			trans	-63	114.7	160.6	-95.1	69.5	0	0	0	109.9	S180 V193 F194	S180-W182 PolarHBondContact O-N 2.91Å; W182-V193 HydrophobicContact CD2-CG1 4.35Å; W182-V193 HydrophobicContact CG-CG1 4.39Å; W182-V193 VanDerWaalsContact CZ2-O 3.25Å; W182-V193 WeakPolarHBondContact CZ2-O 3.49Å; W182-V193 PolarHBondContact NE1-O 2.91Å; W182-F194 AromaticContact CH2-CD1 3.99Å; W182-F194 HydrophobicContact CH2-CD1 3.99Å; W182-F194 WeakPolarHBondContact CZ2-O 3.44Å; W182-F194 HydrophobicContact CZ3-CD1 4.41Å
183	C	80	Confident	86.6	Confident	17 Å²	17	41.6 Å²	41.6	12%	0.115	25%	0.252	C	S	.	.			trans	-154.1	179	-178.7	56.4	0	0	0	0	111.5	F169 T181	F169-C183 HydrophobicContact CD1-CB 3.89Å; T181-C183 PolarHBondContact O-N 2.6Å; T181-C183 PolarHBondContact O-SG 3.49Å
184	G	80.1	Confident	86.4	Confident	8 Å²	8	40.1 Å²	40.1	8%	0.082	25%	0.246	C	C	.	.	S	Bend	trans	82.8	-172.4	-175.3	0	0	0	0	0	114.5	R147 D148 R560	R147-G184 WeakPolarHBondContact O-CA 3.29Å; D148-G184 WeakPolarHBondContact OD1-CA 3.46Å; G184-R560 PolarHBondContact O-NH2 2.79Å; G184-R560 VanDerWaalsContact O-NH2 3.09Å
185	S	86.5	Confident	86.4	Confident	6 Å²	6	39.2 Å²	39.2	4%	0.042	24%	0.239	C	C	.	.			trans	-106.6	124.2	-178.2	-63.3	0	0	0	0	110.4	D148 K150 P187 Y188 A189	D148-S185 VanDerWaalsContact OD1-CB 3.25Å; D148-S185 WeakPolarHBondContact OD1-CB 3.43Å; D148-S185 PolarHBondContact OD1-N 2.93Å; D148-S185 PolarHBondContact OD1-OG 3.31Å; K150-S185 WeakPolarHBondContact CD-OG 3.37Å; S185-P187 VanDerWaalsContact C-CD 3.43Å; S185-P187 WeakPolarHBondContact O-CD 3.46Å; S185-Y188 PolarHBondContact O-N 3.27Å; S185-A189 PolarHBondContact O-N 3.29Å; S185-A189 VanDerWaalsContact O-N 3.16Å
186	P	89.4	Confident	86.5	Confident	46 Å²	46	37.2 Å²	37.2	30%	0.299	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-35.6	-165.3	-30.5	34.8	0	0	0	118	Y188 F194 L228 L231	P186-Y188 PolarHBondContact O-N 3.42Å; P186-F194 HydrophobicContact CB-CZ 4.09Å; P186-F194 WeakPolarHBondContact O-CE2 3.34Å; P186-F194 VanDerWaalsContact O-CZ 3.28Å; P186-F194 WeakPolarHBondContact O-CZ 3.47Å; P186-L228 HydrophobicContact CB-CD1 3.91Å; P186-L228 HydrophobicContact CG-CD1 4.27Å; P186-L231 HydrophobicContact CB-CD2 3.93Å
187	P	91.4	Very high	86.9	Confident	9 Å²	9	40 Å²	40	6%	0.058	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.2	176.8	-20	34.1	0	0	0	115	S185 L221 L570	S185-P187 VanDerWaalsContact C-CD 3.43Å; S185-P187 WeakPolarHBondContact O-CD 3.46Å; P187-L221 HydrophobicContact CB-CD1 3.77Å; P187-L221 HydrophobicContact CB-CD2 3.77Å; P187-L221 HydrophobicContact CB-CG 4.39Å; P187-L221 HydrophobicContact CG-CD1 4.28Å; P187-L570 HydrophobicContact CG-CD1 4.36Å; P187-L570 HydrophobicContact CG-CD2 4.11Å
188	Y	94.5	Very high	87	Confident	8 Å²	8	40.9 Å²	40.9	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-12.8	-178.9	-60.9	-89.4	0	0	0	113.2	L149 K150 T151 E152 S185 P186 S208 V211 V212 L221	L149-Y188 WeakPolarHBondContact O-CD1 3.38Å; K150-Y188 HydrophobicContact CB-CD1 4.15Å; K150-Y188 HydrophobicContact CB-CD2 3.63Å; K150-Y188 HydrophobicContact CB-CE1 3.98Å; K150-Y188 HydrophobicContact CB-CE2 3.39Å; K150-Y188 HydrophobicContact CB-CG 3.99Å; T151-Y188 PolarHBondContact N-OH 2.57Å; T151-Y188 PolarHBondContact OG1-OH 3.35Å; E152-Y188 PolarHBondContact OE2-OH 2.9Å; S185-Y188 PolarHBondContact O-N 3.27Å; P186-Y188 PolarHBondContact O-N 3.42Å; Y188-S208 PolarHBondContact O-OG 3.15Å; Y188-V211 HydrophobicContact CD1-CB 3.88Å; Y188-V211 HydrophobicContact CD1-CG1 3.34Å; Y188-V211 HydrophobicContact CE1-CG1 3.74Å; Y188-V211 HydrophobicContact CG-CG1 4.1Å; Y188-V212 HydrophobicContact CD1-CG2 4.22Å; Y188-V212 HydrophobicContact CE1-CG2 4.03Å; Y188-L221 HydrophobicContact CE1-CD2 4.39Å
189	A	93.1	Very high	87.1	Confident	8 Å²	8	38.4 Å²	38.4	7%	0.066	21%	0.208	C	C	.	.			trans	-69.8	144.5	-177.7	0	0	0	0	0	112.2	S185 F194 W207	S185-A189 PolarHBondContact O-N 3.29Å; S185-A189 VanDerWaalsContact O-N 3.16Å; A189-F194 HydrophobicContact CB-CD2 4.36Å; A189-F194 HydrophobicContact CB-CE2 3.86Å; A189-W207 PolarHBondContact O-NE1 2.95Å
190	A	93.8	Very high	87	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.			trans	-78.4	152.8	-179.3	0	0	0	0	0	112.1	E192 V193 F194 L204 W207	A190-E192 VanDerWaalsContact C-N 3.28Å; A190-E192 VanDerWaalsContact CB-CD 3.4Å; A190-E192 HydrophobicContact CB-CG 4.26Å; A190-E192 WeakPolarHBondContact CB-OE1 3.45Å; A190-E192 WeakPolarHBondContact CB-OE2 3.48Å; A190-E192 PolarHBondContact O-N 3.43Å; A190-V193 HydrophobicContact CB-CG2 4.35Å; A190-V193 WeakPolarHBondContact O-CB 3.3Å; A190-V193 PolarHBondContact O-N 2.85Å; A190-F194 PolarHBondContact O-N 2.79Å; A190-L204 HydrophobicContact CB-CB 4.49Å; A190-L204 HydrophobicContact CB-CG 4.12Å; A190-W207 VanDerWaalsContact CA-CD1 3.46Å; A190-W207 HydrophobicContact CB-CB 3.84Å; A190-W207 HydrophobicContact CB-CD2 4.3Å; A190-W207 HydrophobicContact CB-CG 3.72Å
191	P	93.8	Very high	87.3	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-33.6	-176	20.7	-30.8	0	0	0	113.4	V193 F194 E195 W207 V235 V260	P191-V193 VanDerWaalsContact C-N 3.25Å; P191-V193 PolarHBondContact O-N 2.69Å; P191-F194 WeakPolarHBondContact O-CB 3.41Å; P191-F194 PolarHBondContact O-N 2.87Å; P191-F194 VanDerWaalsContact O-N 3.12Å; P191-E195 WeakPolarHBondContact O-CG 3.46Å; P191-E195 PolarHBondContact O-N 2.98Å; P191-W207 HydrophobicContact CG-CE3 4.32Å; P191-W207 HydrophobicContact CG-CH2 4.12Å; P191-W207 HydrophobicContact CG-CZ3 4Å; P191-V235 HydrophobicContact CB-CG1 3.95Å; P191-V260 HydrophobicContact CB-CG1 4.1Å; P191-V260 HydrophobicContact CG-CB 4.28Å; P191-V260 HydrophobicContact CG-CG1 3.86Å
192	E	93	Very high	87.8	Confident	7 Å²	7	35.4 Å²	35.4	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-58.9	-35.4	174.2	59.3	-89.3	-154.2	0	0	112.8	A190 E195 G196 K197 R265	A190-E192 VanDerWaalsContact C-N 3.28Å; A190-E192 VanDerWaalsContact CB-CD 3.4Å; A190-E192 HydrophobicContact CB-CG 4.26Å; A190-E192 WeakPolarHBondContact CB-OE1 3.45Å; A190-E192 WeakPolarHBondContact CB-OE2 3.48Å; A190-E192 PolarHBondContact O-N 3.43Å; E192-E195 PolarHBondContact O-N 2.77Å; E192-G196 PolarHBondContact O-N 3.34Å; E192-K197 HydrophobicContact CB-CB 4.27Å; E192-K197 PolarHBondContact O-N 3.22Å; E192-R265 IonicContact OE1-CZ 2.69Å; E192-R265 IonicContact OE1-NH1 2.79Å; E192-R265 PolarHBondContact OE1-NH1 3.01Å; E192-R265 IonicContact OE1-NH2 3.64Å; E192-R265 PolarHBondContact OE1-NH2 2.66Å; E192-R265 IonicContact OE2-CZ 2.73Å; E192-R265 IonicContact OE2-NH1 3.62Å; E192-R265 IonicContact OE2-NH2 3.52Å; E192-R265 PolarHBondContact OE2-NH2 2.76Å
193	V	89.9	Confident	88.5	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-47.6	174.1	-171.5	0	0	0	0	109.8	W182 A190 P191 E195 G196 Y199 L204	W182-V193 HydrophobicContact CD2-CG1 4.35Å; W182-V193 HydrophobicContact CG-CG1 4.39Å; W182-V193 VanDerWaalsContact CZ2-O 3.25Å; W182-V193 WeakPolarHBondContact CZ2-O 3.49Å; W182-V193 PolarHBondContact NE1-O 2.91Å; A190-V193 HydrophobicContact CB-CG2 4.35Å; A190-V193 WeakPolarHBondContact O-CB 3.3Å; A190-V193 PolarHBondContact O-N 2.85Å; P191-V193 VanDerWaalsContact C-N 3.25Å; P191-V193 PolarHBondContact O-N 2.69Å; V193-E195 PolarHBondContact O-N 3.16Å; V193-E195 VanDerWaalsContact O-N 3.12Å; V193-G196 PolarHBondContact O-N 2.68Å; V193-Y199 HydrophobicContact CG2-CE1 4.4Å; V193-L204 HydrophobicContact CG2-CD1 3.45Å; V193-L204 VanDerWaalsContact CG2-CD1 3.45Å; V193-L204 HydrophobicContact CG2-CG 3.95Å
194	F	86.8	Confident	89.2	Confident	4 Å²	4	30 Å²	30	2%	0.018	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-21.2	177.5	-83.8	-75.6	0	0	0	114.1	W182 P186 A189 A190 P191 L228 L231 R232 V235	W182-F194 AromaticContact CH2-CD1 3.99Å; W182-F194 HydrophobicContact CH2-CD1 3.99Å; W182-F194 WeakPolarHBondContact CZ2-O 3.44Å; W182-F194 HydrophobicContact CZ3-CD1 4.41Å; P186-F194 HydrophobicContact CB-CZ 4.09Å; P186-F194 WeakPolarHBondContact O-CE2 3.34Å; P186-F194 VanDerWaalsContact O-CZ 3.28Å; P186-F194 WeakPolarHBondContact O-CZ 3.47Å; A189-F194 HydrophobicContact CB-CD2 4.36Å; A189-F194 HydrophobicContact CB-CE2 3.86Å; A190-F194 PolarHBondContact O-N 2.79Å; P191-F194 WeakPolarHBondContact O-CB 3.41Å; P191-F194 PolarHBondContact O-N 2.87Å; P191-F194 VanDerWaalsContact O-N 3.12Å; F194-L228 HydrophobicContact CE1-CD1 3.94Å; F194-L231 HydrophobicContact CZ-CD2 4.38Å; F194-L231 HydrophobicContact CZ-CG 4.42Å; F194-R232 HydrophobicContact CB-CG 4.03Å; F194-R232 HydrophobicContact CD1-CB 3.7Å; F194-R232 HydrophobicContact CD1-CG 3.96Å; F194-R232 HydrophobicContact CE1-CB 4.07Å; F194-R232 HydrophobicContact CG-CB 4.32Å; F194-R232 HydrophobicContact CG-CG 4.24Å; F194-R232 PolarHBondContact O-NE 3.48Å; F194-R232 VanDerWaalsContact O-NE 3.1Å; F194-R232 PolarHBondContact O-NH1 3.22Å; F194-R232 PolarHBondContact O-NH2 3.27Å; F194-V235 HydrophobicContact CD2-CB 4.27Å; F194-V235 HydrophobicContact CD2-CG1 3.66Å; F194-V235 HydrophobicContact CE2-CB 4.23Å; F194-V235 HydrophobicContact CE2-CG1 3.88Å; F194-V235 HydrophobicContact CE2-CG2 4.12Å
195	E	86.6	Confident	90	Very high	64 Å²	64	29.6 Å²	29.6	30%	0.299	16%	0.157	S	C	.	.	H	α-helix	trans	-92.9	-8.9	176.9	-69.4	173.8	173	0	0	113.1	P191 E192 V193 K197 T236	P191-E195 WeakPolarHBondContact O-CG 3.46Å; P191-E195 PolarHBondContact O-N 2.98Å; E192-E195 PolarHBondContact O-N 2.77Å; V193-E195 PolarHBondContact O-N 3.16Å; V193-E195 VanDerWaalsContact O-N 3.12Å; E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 HydrophobicContact CB-CD 4.17Å; E195-K197 HydrophobicContact CB-CG 4.08Å; E195-K197 WeakPolarHBondContact OE2-CD 3.45Å; E195-K197 WeakPolarHBondContact OE2-CE 3.47Å; E195-K197 IonicContact OE2-NZ 3.77Å; E195-K197 PolarHBondContact OE2-NZ 3.05Å; E195-T236 VanDerWaalsContact OE1-CG2 3.26Å; E195-T236 WeakPolarHBondContact OE1-CG2 3.48Å
196	G	84.5	Confident	90.5	Very high	46 Å²	46	29.8 Å²	29.8	47%	0.474	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	24	-174.5	0	0	0	0	0	113.3	E192 V193	E192-G196 PolarHBondContact O-N 3.34Å; V193-G196 PolarHBondContact O-N 2.68Å
197	K	86.5	Confident	90.9	Very high	120 Å²	120	27.6 Å²	27.6	52%	0.522	14%	0.143	S	C	.	.			trans	-78.1	153.2	176.4	-72.7	173.9	175.1	165.4	0	110.9	E192 E195 Y199	E192-K197 HydrophobicContact CB-CB 4.27Å; E192-K197 PolarHBondContact O-N 3.22Å; E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 HydrophobicContact CB-CD 4.17Å; E195-K197 HydrophobicContact CB-CG 4.08Å; E195-K197 WeakPolarHBondContact OE2-CD 3.45Å; E195-K197 WeakPolarHBondContact OE2-CE 3.47Å; E195-K197 IonicContact OE2-NZ 3.77Å; E195-K197 PolarHBondContact OE2-NZ 3.05Å; K197-Y199 WeakPolarHBondContact O-CD1 3.38Å
198	E	87	Confident	91.2	Very high	136 Å²	136	27.2 Å²	27.2	64%	0.636	14%	0.141	S	C	*	.			trans	-68.8	142.9	167.2	-86.9	172.9	-172.1	0	0	111.7	P178 L179	P178-E198 HydrophobicContact CB-CB 3.65Å; P178-E198 HydrophobicContact CB-CG 3.85Å; P178-E198 HydrophobicContact CG-CB 4.34Å; P178-E198 HydrophobicContact CG-CG 4.19Å; P178-E198 WeakPolarHBondContact CG-OE2 3.19Å; L179-E198 WeakPolarHBondContact O-CA 3.45Å
199	Y	85.5	Confident	91.4	Very high	14 Å²	14	26.9 Å²	26.9	6%	0.055	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-146.1	144.3	-175.3	59.5	-97.3	0	0	0	111.9	R147 L179 T181 V193 K197 L204	R147-Y199 PolarHBondContact NH1-OH 3.39Å; L179-Y199 HydrophobicContact CB-CD2 3.89Å; L179-Y199 HydrophobicContact CB-CE1 4.45Å; L179-Y199 HydrophobicContact CB-CE2 3.45Å; L179-Y199 VanDerWaalsContact CB-CE2 3.45Å; L179-Y199 WeakPolarHBondContact CB-O 3.41Å; L179-Y199 HydrophobicContact CD1-CD2 4.49Å; L179-Y199 HydrophobicContact CD1-CE2 3.9Å; L179-Y199 HydrophobicContact CG-CE2 4.29Å; L179-Y199 PolarHBondContact N-O 3.48Å; L179-Y199 WeakPolarHBondContact O-CD1 3.45Å; L179-Y199 WeakPolarHBondContact O-CE1 3.43Å; L179-Y199 PolarHBondContact O-N 3.29Å; T181-Y199 PolarHBondContact O-OH 3.19Å; V193-Y199 HydrophobicContact CG2-CE1 4.4Å; K197-Y199 WeakPolarHBondContact O-CD1 3.38Å; Y199-L204 HydrophobicContact CD1-CD1 4.42Å; Y199-L204 HydrophobicContact CD2-CD1 3.81Å; Y199-L204 HydrophobicContact CE1-CD1 4.16Å; Y199-L204 HydrophobicContact CE2-CD1 3.5Å; Y199-L204 VanDerWaalsContact CE2-CD1 3.5Å; Y199-L204 HydrophobicContact CG-CD1 4.28Å
200	E	82.7	Confident	91.6	Very high	87 Å²	87	26.5 Å²	26.5	41%	0.407	14%	0.136	S	C	.	.			trans	-71.3	-33.2	178.5	-59.7	-176.7	127.8	0	0	112.7	Y173 P202 Q203	Y173-E200 WeakPolarHBondContact CB-O 3.45Å; E200-P202 VanDerWaalsContact C-CD 3.44Å; E200-P202 WeakPolarHBondContact O-CD 3.27Å; E200-Q203 PolarHBondContact OE2-NE2 3.42Å
201	G	86.1	Confident	91.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	124.5	-55.6	173.2	0	0	0	0	0	115	Q203 L204 D205	G201-Q203 PolarHBondContact O-N 3.35Å; G201-Q203 VanDerWaalsContact O-N 3.14Å; G201-L204 VanDerWaalsContact O-CB 3.3Å; G201-L204 WeakPolarHBondContact O-CB 3.4Å; G201-L204 PolarHBondContact O-N 2.93Å; G201-D205 PolarHBondContact O-N 3.12Å
202	P	93.3	Very high	92	Very high	18 Å²	18	26.6 Å²	26.6	12%	0.117	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-34.1	-175.1	-30.4	38.2	0	0	0	114.4	V145 Y173 E200 L204 D205 I206	V145-P202 HydrophobicContact CG1-CG 4.02Å; Y173-P202 HydrophobicContact CD2-CG 4.16Å; Y173-P202 HydrophobicContact CE1-CG 3.91Å; Y173-P202 HydrophobicContact CE2-CG 3.53Å; Y173-P202 WeakPolarHBondContact OH-CG 3.34Å; E200-P202 VanDerWaalsContact C-CD 3.44Å; E200-P202 WeakPolarHBondContact O-CD 3.27Å; P202-L204 VanDerWaalsContact C-N 3.32Å; P202-L204 PolarHBondContact O-N 3.46Å; P202-D205 PolarHBondContact O-N 3.48Å; P202-I206 WeakPolarHBondContact O-CD1 3.44Å; P202-I206 VanDerWaalsContact O-CG1 3.31Å; P202-I206 WeakPolarHBondContact O-CG1 3.32Å; P202-I206 PolarHBondContact O-N 3.43Å; P202-I206 VanDerWaalsContact O-N 3.1Å
203	Q	94.8	Very high	92.3	Very high	43 Å²	43	26.2 Å²	26.2	20%	0.201	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-32.7	178.3	-54.6	83.6	-7.3	0	0	112.4	E200 G201 I206 W207 P262 R265	E200-Q203 PolarHBondContact OE2-NE2 3.42Å; G201-Q203 PolarHBondContact O-N 3.35Å; G201-Q203 VanDerWaalsContact O-N 3.14Å; Q203-I206 PolarHBondContact O-N 3.19Å; Q203-W207 PolarHBondContact O-N 3.34Å; Q203-P262 HydrophobicContact CB-CB 4.02Å; Q203-P262 HydrophobicContact CG-CB 4.36Å; Q203-R265 VanDerWaalsContact C-NH1 3.33Å; Q203-R265 WeakPolarHBondContact O-CD 3.02Å; Q203-R265 PolarHBondContact O-NH1 2.89Å
204	L	93.7	Very high	92.7	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-67	-46.9	177.5	-175.9	173	0	0	0	109.7	R147 A190 V193 Y199 G201 P202 I206 W207 S208	R147-L204 HydrophobicContact CB-CD2 4.43Å; A190-L204 HydrophobicContact CB-CB 4.49Å; A190-L204 HydrophobicContact CB-CG 4.12Å; V193-L204 HydrophobicContact CG2-CD1 3.45Å; V193-L204 VanDerWaalsContact CG2-CD1 3.45Å; V193-L204 HydrophobicContact CG2-CG 3.95Å; Y199-L204 HydrophobicContact CD1-CD1 4.42Å; Y199-L204 HydrophobicContact CD2-CD1 3.81Å; Y199-L204 HydrophobicContact CE1-CD1 4.16Å; Y199-L204 HydrophobicContact CE2-CD1 3.5Å; Y199-L204 VanDerWaalsContact CE2-CD1 3.5Å; Y199-L204 HydrophobicContact CG-CD1 4.28Å; G201-L204 VanDerWaalsContact O-CB 3.3Å; G201-L204 WeakPolarHBondContact O-CB 3.4Å; G201-L204 PolarHBondContact O-N 2.93Å; P202-L204 VanDerWaalsContact C-N 3.32Å; P202-L204 PolarHBondContact O-N 3.46Å; L204-I206 VanDerWaalsContact C-N 3.28Å; L204-I206 PolarHBondContact O-N 3.11Å; L204-W207 PolarHBondContact O-N 3.09Å; L204-S208 PolarHBondContact O-N 3.47Å; L204-S208 VanDerWaalsContact O-N 3.08Å; L204-S208 PolarHBondContact O-OG 3.48Å
205	D	96.3	Very high	93.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-39.3	173.7	-77.7	-19.8	0	0	0	111.4	V136 H140 V145 H146 R147 L149 G201 P202 W207 S208 L209	V136-D205 HydrophobicContact CG1-CB 4.28Å; H140-D205 IonicContact CD2-OD2 2.69Å; H140-D205 IonicContact CE1-OD2 2.78Å; H140-D205 IonicContact NE2-OD2 3.14Å; H140-D205 PolarHBondContact NE2-OD2 2.89Å; V145-D205 WeakPolarHBondContact CA-OD2 3.14Å; H146-D205 PolarHBondContact N-OD1 3Å; H146-D205 PolarHBondContact N-OD2 2.85Å; R147-D205 PolarHBondContact N-OD1 2.85Å; L149-D205 HydrophobicContact CD1-CB 3.72Å; G201-D205 PolarHBondContact O-N 3.12Å; P202-D205 PolarHBondContact O-N 3.48Å; D205-W207 PolarHBondContact O-N 2.84Å; D205-S208 CarbonylContact O-C 3.58Å; D205-S208 PolarHBondContact O-N 3.27Å; D205-L209 WeakPolarHBondContact O-CG 3.17Å; D205-L209 PolarHBondContact O-N 3Å
206	I	97.9	Very high	93.7	Very high	9 Å²	9	23.6 Å²	23.6	5%	0.046	12%	0.122	C	C	.	.	H	α-helix	trans	-63.9	-39.4	176.8	-69	162.4	0	0	0	112.5	P202 Q203 L204 S208 L209 G210 M257 R265 I266 V268 I271	P202-I206 WeakPolarHBondContact O-CD1 3.44Å; P202-I206 VanDerWaalsContact O-CG1 3.31Å; P202-I206 WeakPolarHBondContact O-CG1 3.32Å; P202-I206 PolarHBondContact O-N 3.43Å; P202-I206 VanDerWaalsContact O-N 3.1Å; Q203-I206 PolarHBondContact O-N 3.19Å; L204-I206 VanDerWaalsContact C-N 3.28Å; L204-I206 PolarHBondContact O-N 3.11Å; I206-S208 VanDerWaalsContact C-N 3.35Å; I206-L209 WeakPolarHBondContact O-CB 3.37Å; I206-L209 PolarHBondContact O-N 3.01Å; I206-G210 PolarHBondContact O-N 3.03Å; I206-M257 HydrophobicContact CG2-CB 4.39Å; I206-M257 HydrophobicContact CG2-CG 4.19Å; I206-R265 HydrophobicContact CG2-CG 3.98Å; I206-I266 HydrophobicContact CG2-CG2 4.41Å; I206-I266 WeakPolarHBondContact CG2-O 3.38Å; I206-V268 HydrophobicContact CD1-CG2 4.03Å; I206-V268 HydrophobicContact CG1-CG2 4.09Å; I206-I271 HydrophobicContact CG2-CD1 4.2Å
207	W	97.8	Very high	94.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.4	-46.4	172.4	172.4	-81.7	0	0	0	110.6	A189 A190 P191 Q203 L204 D205 L209 G210 V211 F223 V235 L258 V260	A189-W207 PolarHBondContact O-NE1 2.95Å; A190-W207 VanDerWaalsContact CA-CD1 3.46Å; A190-W207 HydrophobicContact CB-CB 3.84Å; A190-W207 HydrophobicContact CB-CD2 4.3Å; A190-W207 HydrophobicContact CB-CG 3.72Å; P191-W207 HydrophobicContact CG-CE3 4.32Å; P191-W207 HydrophobicContact CG-CH2 4.12Å; P191-W207 HydrophobicContact CG-CZ3 4Å; Q203-W207 PolarHBondContact O-N 3.34Å; L204-W207 PolarHBondContact O-N 3.09Å; D205-W207 PolarHBondContact O-N 2.84Å; W207-L209 VanDerWaalsContact C-N 3.31Å; W207-L209 PolarHBondContact O-N 2.87Å; W207-G210 WeakPolarHBondContact O-CA 3.47Å; W207-G210 PolarHBondContact O-N 2.89Å; W207-V211 PolarHBondContact O-N 2.98Å; W207-F223 AromaticContact CH2-CE2 3.99Å; W207-F223 HydrophobicContact CH2-CE2 3.99Å; W207-F223 AromaticContact CH2-CZ 3.86Å; W207-F223 HydrophobicContact CH2-CZ 3.86Å; W207-F223 HydrophobicContact CZ2-CD2 4.23Å; W207-F223 AromaticContact CZ2-CE2 3.39Å; W207-F223 HydrophobicContact CZ2-CE2 3.39Å; W207-F223 AromaticContact CZ2-CZ 3.74Å; W207-F223 HydrophobicContact CZ2-CZ 3.74Å; W207-V235 HydrophobicContact CH2-CG1 4.48Å; W207-V235 HydrophobicContact CZ2-CG1 3.84Å; W207-L258 HydrophobicContact CD2-CD2 3.78Å; W207-L258 HydrophobicContact CE3-CB 4.42Å; W207-L258 HydrophobicContact CE3-CD2 4.05Å; W207-L258 HydrophobicContact CG-CD2 4.19Å; W207-L258 HydrophobicContact CH2-CB 4.48Å; W207-L258 HydrophobicContact CH2-CD2 4.49Å; W207-L258 HydrophobicContact CZ2-CD2 4.24Å; W207-L258 VanDerWaalsContact CZ3-C 3.46Å; W207-L258 HydrophobicContact CZ3-CB 4.18Å; W207-L258 HydrophobicContact CZ3-CD2 4.4Å; W207-L258 WeakPolarHBondContact O-CD2 3.32Å; W207-V260 HydrophobicContact CZ3-CG2 4.45Å
208	S	97.6	Very high	94.7	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.014	8%	0.081	C	C	.	.	H	α-helix	trans	-62.3	-35.7	177.2	-55.1	0	0	0	0	112.5	Y188 L204 D205 I206 G210 V211 V212	Y188-S208 PolarHBondContact O-OG 3.15Å; L204-S208 PolarHBondContact O-N 3.47Å; L204-S208 VanDerWaalsContact O-N 3.08Å; L204-S208 PolarHBondContact O-OG 3.48Å; D205-S208 CarbonylContact O-C 3.58Å; D205-S208 PolarHBondContact O-N 3.27Å; I206-S208 VanDerWaalsContact C-N 3.35Å; S208-G210 VanDerWaalsContact C-N 3.33Å; S208-G210 PolarHBondContact O-N 2.85Å; S208-V211 PolarHBondContact O-N 2.91Å; S208-V212 WeakPolarHBondContact O-CG2 3.14Å; S208-V212 PolarHBondContact O-N 2.81Å
209	L	98.4	Very high	95	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-62.1	-37.4	169.6	-72.3	177.9	0	0	0	112.5	F129 I132 L133 V136 L149 D205 I206 W207 V212 L213 M257	F129-L209 HydrophobicContact CE2-CB 4.1Å; F129-L209 HydrophobicContact CE2-CD2 4.17Å; F129-L209 WeakPolarHBondContact CE2-O 3.22Å; F129-L209 HydrophobicContact CZ-CB 4.06Å; I132-L209 HydrophobicContact CG2-CD2 3.37Å; L133-L209 HydrophobicContact CD1-CD1 3.95Å; V136-L209 HydrophobicContact CB-CD1 4.37Å; V136-L209 HydrophobicContact CG1-CD1 4.16Å; V136-L209 HydrophobicContact CG2-CD2 4.27Å; L149-L209 HydrophobicContact CD1-CD2 4.11Å; L149-L209 HydrophobicContact CD1-CG 4.08Å; D205-L209 WeakPolarHBondContact O-CG 3.17Å; D205-L209 PolarHBondContact O-N 3Å; I206-L209 WeakPolarHBondContact O-CB 3.37Å; I206-L209 PolarHBondContact O-N 3.01Å; W207-L209 VanDerWaalsContact C-N 3.31Å; W207-L209 PolarHBondContact O-N 2.87Å; L209-V212 PolarHBondContact O-N 3.24Å; L209-L213 WeakPolarHBondContact O-CB 3.48Å; L209-L213 PolarHBondContact O-N 2.97Å; L209-M257 HydrophobicContact CB-SD 4.09Å
210	G	98.3	Very high	95.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.2	-42.9	171.3	0	0	0	0	0	112.8	I206 W207 S208 Y214	I206-G210 PolarHBondContact O-N 3.03Å; W207-G210 WeakPolarHBondContact O-CA 3.47Å; W207-G210 PolarHBondContact O-N 2.89Å; S208-G210 VanDerWaalsContact C-N 3.33Å; S208-G210 PolarHBondContact O-N 2.85Å; G210-Y214 PolarHBondContact O-N 2.6Å; G210-Y214 VanDerWaalsContact O-N 3.14Å
211	V	98.1	Very high	95.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-65.8	-46.1	174.9	-179.8	0	0	0	0	110.9	Y188 W207 S208 Y214 V215 L221 P222 L258	Y188-V211 HydrophobicContact CD1-CB 3.88Å; Y188-V211 HydrophobicContact CD1-CG1 3.34Å; Y188-V211 HydrophobicContact CE1-CG1 3.74Å; Y188-V211 HydrophobicContact CG-CG1 4.1Å; W207-V211 PolarHBondContact O-N 2.98Å; S208-V211 PolarHBondContact O-N 2.91Å; V211-Y214 PolarHBondContact O-N 2.73Å; V211-V215 HydrophobicContact CG1-CG2 4.42Å; V211-V215 VanDerWaalsContact O-CG2 3.3Å; V211-V215 WeakPolarHBondContact O-CG2 3.28Å; V211-V215 PolarHBondContact O-N 3.29Å; V211-L221 HydrophobicContact CG1-CD2 3.93Å; V211-P222 HydrophobicContact CB-CG 4.35Å; V211-P222 HydrophobicContact CG1-CG 3.99Å; V211-P222 HydrophobicContact CG2-CG 4.16Å; V211-L258 HydrophobicContact CG2-CD2 3.84Å
212	V	98.1	Very high	96.3	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.006	6%	0.059	C	C	.	.	H	α-helix	trans	-60.4	-46.6	177.7	166.8	0	0	0	0	111.6	I132 L154 Y188 S208 L209 Y214 V215 L216	I132-V212 HydrophobicContact CD1-CG1 4.07Å; L154-V212 HydrophobicContact CD1-CG1 3.78Å; Y188-V212 HydrophobicContact CD1-CG2 4.22Å; Y188-V212 HydrophobicContact CE1-CG2 4.03Å; S208-V212 WeakPolarHBondContact O-CG2 3.14Å; S208-V212 PolarHBondContact O-N 2.81Å; L209-V212 PolarHBondContact O-N 3.24Å; V212-Y214 PolarHBondContact O-N 3.41Å; V212-V215 PolarHBondContact O-N 3.34Å; V212-V215 VanDerWaalsContact O-N 3.15Å; V212-L216 HydrophobicContact CG1-CD1 4.23Å; V212-L216 HydrophobicContact CG1-CG 4.47Å; V212-L216 WeakPolarHBondContact O-CG 3.41Å; V212-L216 PolarHBondContact O-N 3.32Å
213	L	98.4	Very high	96.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60.4	-45.5	178	178.5	57	0	0	0	111.4	F129 L209 V215 L216 V217 L253 I254 M257 W276	F129-L213 HydrophobicContact CB-CD1 4.37Å; F129-L213 HydrophobicContact CD1-CD2 4.43Å; F129-L213 HydrophobicContact CD2-CB 4Å; F129-L213 HydrophobicContact CD2-CD1 4.19Å; F129-L213 HydrophobicContact CE1-CD2 4.24Å; F129-L213 HydrophobicContact CE2-CB 3.76Å; F129-L213 HydrophobicContact CG-CD1 4.12Å; F129-L213 HydrophobicContact CZ-CB 4.19Å; F129-L213 HydrophobicContact CZ-CD2 4.34Å; L209-L213 WeakPolarHBondContact O-CB 3.48Å; L209-L213 PolarHBondContact O-N 2.97Å; L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 3.44Å; L213-L216 PolarHBondContact O-N 3.48Å; L213-V217 HydrophobicContact CD1-CG1 4.23Å; L213-V217 WeakPolarHBondContact O-CG2 3.44Å; L213-V217 PolarHBondContact O-N 3.37Å; L213-L253 HydrophobicContact CD2-CD2 3.83Å; L213-L253 HydrophobicContact CD2-CG 4.16Å; L213-I254 HydrophobicContact CB-CG1 4.47Å; L213-I254 HydrophobicContact CD2-CD1 4.39Å; L213-I254 HydrophobicContact CD2-CG1 3.75Å; L213-I254 HydrophobicContact CG-CD1 4.17Å; L213-I254 HydrophobicContact CG-CG1 3.96Å; L213-M257 HydrophobicContact CB-CE 4Å; L213-M257 HydrophobicContact CD2-CE 3.52Å; L213-M257 HydrophobicContact CG-CE 4.39Å; L213-W276 HydrophobicContact CD1-CH2 3.48Å; L213-W276 VanDerWaalsContact CD1-CH2 3.48Å; L213-W276 HydrophobicContact CD1-CZ2 4.24Å; L213-W276 HydrophobicContact CD1-CZ3 3.82Å; L213-W276 HydrophobicContact CD2-CE3 4.49Å; L213-W276 HydrophobicContact CD2-CH2 4.48Å; L213-W276 HydrophobicContact CD2-CZ3 4.13Å
214	Y	98.1	Very high	96.2	Very high	14 Å²	14	8.8 Å²	8.8	6%	0.055	6%	0.055	C	C	.	.	H	α-helix	trans	-59.4	-43.4	175	-176.3	-80.7	0	0	0	111.3	G210 V211 V212 L216 V217 C218 S220 P222 F240 R241 M246 I254	G210-Y214 PolarHBondContact O-N 2.6Å; G210-Y214 VanDerWaalsContact O-N 3.14Å; V211-Y214 PolarHBondContact O-N 2.73Å; V212-Y214 PolarHBondContact O-N 3.41Å; Y214-L216 PolarHBondContact O-N 2.8Å; Y214-V217 PolarHBondContact O-N 3.3Å; Y214-C218 HydrophobicContact CD1-CB 3.93Å; Y214-C218 HydrophobicContact CE1-CB 3.6Å; Y214-C218 HydrophobicContact CE2-CB 4.44Å; Y214-C218 WeakPolarHBondContact CE2-SG 3.42Å; Y214-C218 HydrophobicContact CG-CB 4.48Å; Y214-C218 WeakPolarHBondContact O-CB 3.12Å; Y214-C218 PolarHBondContact O-N 3.08Å; Y214-S220 WeakPolarHBondContact CD1-O 3.44Å; Y214-S220 VanDerWaalsContact CE1-O 3.23Å; Y214-S220 WeakPolarHBondContact CE1-O 3.21Å; Y214-P222 HydrophobicContact CD1-CB 3.73Å; Y214-P222 VanDerWaalsContact CD1-CD 3.5Å; Y214-P222 HydrophobicContact CD1-CG 4Å; Y214-P222 HydrophobicContact CD2-CB 4.18Å; Y214-P222 HydrophobicContact CE1-CB 3.95Å; Y214-P222 HydrophobicContact CE2-CB 4.37Å; Y214-P222 HydrophobicContact CG-CB 3.85Å; Y214-P222 HydrophobicContact CG-CG 4.17Å; Y214-F240 HydrophobicContact CD2-CD2 4.08Å; Y214-F240 HydrophobicContact CD2-CE2 4.25Å; Y214-F240 AromaticContact CE2-CD2 3.94Å; Y214-F240 HydrophobicContact CE2-CD2 3.94Å; Y214-F240 HydrophobicContact CE2-CE2 4.43Å; Y214-R241 VanDerWaalsContact CE2-O 3.29Å; Y214-R241 WeakPolarHBondContact CE2-O 3.44Å; Y214-R241 PolarHBondContact OH-O 2.76Å; Y214-M246 HydrophobicContact CD2-CE 4.1Å; Y214-M246 HydrophobicContact CE2-CE 4.26Å; Y214-I254 HydrophobicContact CD2-CD1 4.35Å; Y214-I254 HydrophobicContact CD2-CG2 4.36Å
215	V	97.1	Very high	95.9	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.006	6%	0.055	C	C	.	.	H	α-helix	trans	-62.6	-39	177.5	171.6	0	0	0	0	112	L114 T151 V211 V212 L213 G219 S220 L221	L114-V215 HydrophobicContact CD1-CG1 3.73Å; T151-V215 HydrophobicContact CG2-CB 4.37Å; T151-V215 HydrophobicContact CG2-CG1 3.73Å; V211-V215 HydrophobicContact CG1-CG2 4.42Å; V211-V215 VanDerWaalsContact O-CG2 3.3Å; V211-V215 WeakPolarHBondContact O-CG2 3.28Å; V211-V215 PolarHBondContact O-N 3.29Å; V212-V215 PolarHBondContact O-N 3.34Å; V212-V215 VanDerWaalsContact O-N 3.15Å; L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 3.44Å; V215-G219 VanDerWaalsContact O-CA 3.24Å; V215-G219 WeakPolarHBondContact O-CA 3.19Å; V215-G219 PolarHBondContact O-N 3.32Å; V215-S220 WeakPolarHBondContact CA-O 3.49Å; V215-S220 WeakPolarHBondContact CG2-O 3.47Å; V215-L221 HydrophobicContact CG2-CD2 3.83Å; V215-L221 HydrophobicContact CG2-CG 4.29Å
216	L	97.4	Very high	95.5	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.7	-49.7	176.1	-69.7	170.3	0	0	0	112.4	M110 L114 M120 A125 I132 V212 L213 Y214	M110-L216 HydrophobicContact CE-CD2 3.61Å; M110-L216 HydrophobicContact CG-CD2 4.17Å; M110-L216 HydrophobicContact SD-CD2 4.22Å; L114-L216 HydrophobicContact CD1-CD2 4.35Å; L114-L216 HydrophobicContact CD2-CD2 4.49Å; M120-L216 PolarHBondContact N-O 3.27Å; M120-L216 HydrophobicContact SD-CD2 4.17Å; A125-L216 HydrophobicContact CB-CB 4.11Å; I132-L216 HydrophobicContact CD1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CD1 4.23Å; V212-L216 HydrophobicContact CG1-CG 4.47Å; V212-L216 WeakPolarHBondContact O-CG 3.41Å; V212-L216 PolarHBondContact O-N 3.32Å; L213-L216 PolarHBondContact O-N 3.48Å; Y214-L216 PolarHBondContact O-N 2.8Å
217	V	97.3	Very high	95.2	Very high	6 Å²	6	16.8 Å²	16.8	4%	0.036	11%	0.109	C	C	.	.	H	α-helix	trans	-86.9	-25.1	-173.7	-56.5	0	0	0	0	114	R119 E122 A125 L213 Y214 M246 I254	R119-V217 WeakPolarHBondContact CB-O 3.21Å; R119-V217 VanDerWaalsContact CD-O 3.31Å; R119-V217 WeakPolarHBondContact CD-O 3.38Å; E122-V217 HydrophobicContact CG-CG1 4.21Å; A125-V217 HydrophobicContact CB-CG1 3.54Å; L213-V217 HydrophobicContact CD1-CG1 4.23Å; L213-V217 WeakPolarHBondContact O-CG2 3.44Å; L213-V217 PolarHBondContact O-N 3.37Å; Y214-V217 PolarHBondContact O-N 3.3Å; V217-M246 HydrophobicContact CG2-CE 3.69Å; V217-I254 HydrophobicContact CG2-CD1 4.27Å
218	C	95.3	Very high	94.8	Very high	14 Å²	14	21.2 Å²	21.2	10%	0.095	13%	0.132	C	C	.	.	H	α-helix	trans	-99.4	-20.8	179.2	-62.8	0	0	0	0	113.6	Y214 S220 M246	Y214-C218 HydrophobicContact CD1-CB 3.93Å; Y214-C218 HydrophobicContact CE1-CB 3.6Å; Y214-C218 HydrophobicContact CE2-CB 4.44Å; Y214-C218 WeakPolarHBondContact CE2-SG 3.42Å; Y214-C218 HydrophobicContact CG-CB 4.48Å; Y214-C218 WeakPolarHBondContact O-CB 3.12Å; Y214-C218 PolarHBondContact O-N 3.08Å; C218-S220 PolarHBondContact O-N 3.42Å; C218-S220 PolarHBondContact O-OG 3.3Å; C218-M246 VanDerWaalsContact SG-CE 3.5Å
219	G	93.4	Very high	94.5	Very high	15 Å²	15	25.8 Å²	25.8	16%	0.155	16%	0.162	C	C	.	.	S	Bend	trans	62.8	28	-171.8	0	0	0	0	0	113	V215 L577	V215-G219 VanDerWaalsContact O-CA 3.24Å; V215-G219 WeakPolarHBondContact O-CA 3.19Å; V215-G219 PolarHBondContact O-N 3.32Å; G219-L577 VanDerWaalsContact O-CD1 3.31Å; G219-L577 WeakPolarHBondContact O-CD1 3.5Å; G219-L577 VanDerWaalsContact O-CD2 3.22Å; G219-L577 WeakPolarHBondContact O-CD2 3.42Å
220	S	92.6	Very high	94.1	Very high	41 Å²	41	27 Å²	27	29%	0.287	17%	0.172	S	C	.	.	S	Bend	trans	-160.8	158.5	-177.4	49.9	0	0	0	0	110.7	Y214 V215 C218	Y214-S220 WeakPolarHBondContact CD1-O 3.44Å; Y214-S220 VanDerWaalsContact CE1-O 3.23Å; Y214-S220 WeakPolarHBondContact CE1-O 3.21Å; V215-S220 WeakPolarHBondContact CA-O 3.49Å; V215-S220 WeakPolarHBondContact CG2-O 3.47Å; C218-S220 PolarHBondContact O-N 3.42Å; C218-S220 PolarHBondContact O-OG 3.3Å
221	L	94.1	Very high	93.9	Very high	19 Å²	19	27.3 Å²	27.3	10%	0.099	17%	0.174	C	C	.	.			trans	-73.5	145.2	176.6	-74.6	159	0	0	0	111.7	P187 Y188 V211 V215 F223 L570 F573	P187-L221 HydrophobicContact CB-CD1 3.77Å; P187-L221 HydrophobicContact CB-CD2 3.77Å; P187-L221 HydrophobicContact CB-CG 4.39Å; P187-L221 HydrophobicContact CG-CD1 4.28Å; Y188-L221 HydrophobicContact CE1-CD2 4.39Å; V211-L221 HydrophobicContact CG1-CD2 3.93Å; V215-L221 HydrophobicContact CG2-CD2 3.83Å; V215-L221 HydrophobicContact CG2-CG 4.29Å; L221-F223 VanDerWaalsContact C-N 3.33Å; L221-L570 HydrophobicContact CD1-CD1 4.25Å; L221-F573 HydrophobicContact CD1-CD1 4.4Å; L221-F573 HydrophobicContact CD1-CE1 3.88Å; L221-F573 HydrophobicContact CG-CE1 4.05Å
222	P	95.4	Very high	93.6	Very high	14 Å²	14	32.6 Å²	32.6	9%	0.091	19%	0.193	C	C	.	.	S	Bend	trans	-70.5	-32.2	171.7	27.3	-29.4	0	0	0	111.6	V211 Y214 F240 L258	V211-P222 HydrophobicContact CB-CG 4.35Å; V211-P222 HydrophobicContact CG1-CG 3.99Å; V211-P222 HydrophobicContact CG2-CG 4.16Å; Y214-P222 HydrophobicContact CD1-CB 3.73Å; Y214-P222 VanDerWaalsContact CD1-CD 3.5Å; Y214-P222 HydrophobicContact CD1-CG 4Å; Y214-P222 HydrophobicContact CD2-CB 4.18Å; Y214-P222 HydrophobicContact CE1-CB 3.95Å; Y214-P222 HydrophobicContact CE2-CB 4.37Å; Y214-P222 HydrophobicContact CG-CB 3.85Å; Y214-P222 HydrophobicContact CG-CG 4.17Å; P222-F240 HydrophobicContact CB-CB 3.7Å; P222-F240 HydrophobicContact CB-CD2 4.17Å; P222-F240 HydrophobicContact CB-CG 4.07Å; P222-F240 WeakPolarHBondContact O-CB 3.46Å; P222-L258 HydrophobicContact CB-CD1 4.31Å; P222-L258 HydrophobicContact CG-CD1 4.28Å
223	F	94.6	Very high	93.3	Very high	1 Å²	1	38 Å²	38	0%	0.004	22%	0.219	C	C	.	.	S	Bend	trans	-122.1	109.9	178.3	-46.2	-73.8	0	0	0	110.2	W207 L221 L231 R234 V235 F240 L258	W207-F223 AromaticContact CH2-CE2 3.99Å; W207-F223 HydrophobicContact CH2-CE2 3.99Å; W207-F223 AromaticContact CH2-CZ 3.86Å; W207-F223 HydrophobicContact CH2-CZ 3.86Å; W207-F223 HydrophobicContact CZ2-CD2 4.23Å; W207-F223 AromaticContact CZ2-CE2 3.39Å; W207-F223 HydrophobicContact CZ2-CE2 3.39Å; W207-F223 AromaticContact CZ2-CZ 3.74Å; W207-F223 HydrophobicContact CZ2-CZ 3.74Å; L221-F223 VanDerWaalsContact C-N 3.33Å; F223-L231 HydrophobicContact CB-CD1 3.88Å; F223-R234 HydrophobicContact CD1-CB 4.32Å; F223-V235 HydrophobicContact CB-CG2 3.93Å; F223-V235 HydrophobicContact CD1-CG2 4.38Å; F223-V235 HydrophobicContact CD2-CG2 4.07Å; F223-V235 HydrophobicContact CG-CG2 3.88Å; F223-F240 HydrophobicContact CD1-CB 4.35Å; F223-F240 HydrophobicContact CE1-CB 3.9Å; F223-F240 HydrophobicContact CE1-CD1 4.23Å; F223-F240 HydrophobicContact CZ-CB 4.25Å; F223-F240 AromaticContact CZ-CD1 3.98Å; F223-F240 HydrophobicContact CZ-CD1 3.98Å; F223-F240 HydrophobicContact CZ-CG 4.45Å; F223-L258 HydrophobicContact CE2-CD1 4.09Å; F223-L258 HydrophobicContact CE2-CD2 4.34Å; F223-L258 HydrophobicContact CZ-CD1 4.28Å
224	D	89.4	Confident	93.1	Very high	44 Å²	44	43.3 Å²	43.3	24%	0.235	24%	0.239	C	C	.	.			trans	-136.5	129.6	171.1	-179.3	45.7	0	0	0	110.7	R234 R574 R578	D224-R234 PolarHBondContact O-NH1 3.02Å; D224-R574 IonicContact OD1-CZ 2.62Å; D224-R574 IonicContact OD1-NE 3.56Å; D224-R574 PolarHBondContact OD1-NE 3.31Å; D224-R574 IonicContact OD1-NH2 2.66Å; D224-R574 PolarHBondContact OD1-NH2 3.35Å; D224-R574 IonicContact OD2-NE 3.22Å; D224-R578 IonicContact OD2-NH2 3.15Å; D224-R578 PolarHBondContact OD2-NH2 3.18Å
225	A	88.5	Confident	92.9	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.025	24%	0.236	C	C	.	.			trans	-145	152.1	-178.6	0	0	0	0	0	111.9	S227 A230 L231 R574	A225-S227 VanDerWaalsContact C-N 3.31Å; A225-S227 PolarHBondContact O-N 2.85Å; A225-A230 VanDerWaalsContact CB-C 3.42Å; A225-A230 HydrophobicContact CB-CB 3.9Å; A225-A230 WeakPolarHBondContact CB-O 3.26Å; A225-L231 HydrophobicContact CB-CB 4.02Å; A225-R574 PolarHBondContact O-NH2 3.12Å
226	P	88	Confident	92.7	Very high	117 Å²	117	44.8 Å²	44.8	76%	0.76	25%	0.249	S	C	*	.	S	Bend	trans	-67.4	-27.9	-173.7	27	-35.2	0	0	0	113.9
227	S	91.1	Very high	92.5	Very high	60 Å²	60	48.4 Å²	48.4	42%	0.42	27%	0.266	S	S	.	.	S	Bend	trans	-128.1	156.9	180	66.2	0	0	0	0	111.5	A225 A230 L231	A225-S227 VanDerWaalsContact C-N 3.31Å; A225-S227 PolarHBondContact O-N 2.85Å; S227-A230 PolarHBondContact O-N 3.31Å; S227-A230 WeakPolarHBondContact OG-CB 3.44Å; S227-L231 PolarHBondContact O-N 2.9Å
228	L	88.8	Confident	92.2	Very high	93 Å²	93	48.9 Å²	48.9	49%	0.487	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-40.6	-179.6	-172.5	64.4	0	0	0	113.4	P186 F194 A230 L231 R232	P186-L228 HydrophobicContact CB-CD1 3.91Å; P186-L228 HydrophobicContact CG-CD1 4.27Å; F194-L228 HydrophobicContact CE1-CD1 3.94Å; L228-A230 PolarHBondContact O-N 3.34Å; L228-L231 HydrophobicContact CD1-CD2 4.44Å; L228-L231 WeakPolarHBondContact O-CB 3.44Å; L228-L231 PolarHBondContact O-N 2.78Å; L228-R232 PolarHBondContact O-N 3.48Å
229	P	91.3	Very high	91.7	Very high	98 Å²	98	56.8 Å²	56.8	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-61.6	-40.7	174.1	-24.9	35.9	0	0	0	113	L231 R232 Q233	P229-L231 VanDerWaalsContact C-N 3.28Å; P229-L231 PolarHBondContact O-N 3.31Å; P229-R232 PolarHBondContact O-N 3.45Å; P229-Q233 PolarHBondContact O-N 3.28Å
230	A	91.8	Very high	91.7	Very high	26 Å²	26	57.2 Å²	57.2	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-71.8	-21.5	177.3	0	0	0	0	0	113.1	A225 S227 L228 R234	A225-A230 VanDerWaalsContact CB-C 3.42Å; A225-A230 HydrophobicContact CB-CB 3.9Å; A225-A230 WeakPolarHBondContact CB-O 3.26Å; S227-A230 PolarHBondContact O-N 3.31Å; S227-A230 WeakPolarHBondContact OG-CB 3.44Å; L228-A230 PolarHBondContact O-N 3.34Å; A230-R234 WeakPolarHBondContact O-CG 3.21Å
231	L	92.4	Very high	91.7	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-75.4	-51.6	169.7	-178.7	60.9	0	0	0	110.1	P186 F194 F223 A225 S227 L228 P229 Q233 R234 V235	P186-L231 HydrophobicContact CB-CD2 3.93Å; F194-L231 HydrophobicContact CZ-CD2 4.38Å; F194-L231 HydrophobicContact CZ-CG 4.42Å; F223-L231 HydrophobicContact CB-CD1 3.88Å; A225-L231 HydrophobicContact CB-CB 4.02Å; S227-L231 PolarHBondContact O-N 2.9Å; L228-L231 HydrophobicContact CD1-CD2 4.44Å; L228-L231 WeakPolarHBondContact O-CB 3.44Å; L228-L231 PolarHBondContact O-N 2.78Å; P229-L231 VanDerWaalsContact C-N 3.28Å; P229-L231 PolarHBondContact O-N 3.31Å; L231-Q233 VanDerWaalsContact C-N 3.29Å; L231-Q233 PolarHBondContact O-N 2.94Å; L231-R234 PolarHBondContact O-N 3.36Å; L231-R234 VanDerWaalsContact O-N 3.08Å; L231-V235 HydrophobicContact CD1-CG2 4.3Å; L231-V235 HydrophobicContact CG-CG2 4.46Å; L231-V235 WeakPolarHBondContact O-CG2 3.17Å; L231-V235 PolarHBondContact O-N 3.02Å
232	R	91.6	Very high	91.7	Very high	110 Å²	110	66.8 Å²	66.8	42%	0.415	33%	0.33	S	S	.	.	H	α-helix	trans	-49.6	-49.7	175.4	171.1	169.2	178.6	-177.8	2.6	111.2	F194 L228 P229 R234 V235 T236	F194-R232 HydrophobicContact CB-CG 4.03Å; F194-R232 HydrophobicContact CD1-CB 3.7Å; F194-R232 HydrophobicContact CD1-CG 3.96Å; F194-R232 HydrophobicContact CE1-CB 4.07Å; F194-R232 HydrophobicContact CG-CB 4.32Å; F194-R232 HydrophobicContact CG-CG 4.24Å; F194-R232 PolarHBondContact O-NE 3.48Å; F194-R232 VanDerWaalsContact O-NE 3.1Å; F194-R232 PolarHBondContact O-NH1 3.22Å; F194-R232 PolarHBondContact O-NH2 3.27Å; L228-R232 PolarHBondContact O-N 3.48Å; P229-R232 PolarHBondContact O-N 3.45Å; R232-R234 VanDerWaalsContact C-N 3.35Å; R232-R234 PolarHBondContact O-N 3.03Å; R232-V235 PolarHBondContact O-N 3.49Å; R232-T236 PolarHBondContact O-N 2.81Å; R232-T236 PolarHBondContact O-OG1 3.49Å
233	Q	92.8	Very high	91.6	Very high	115 Å²	115	67.4 Å²	67.4	54%	0.537	33%	0.334	S	S	.	.	H	α-helix	trans	-53.6	-48.7	178.5	-179.2	-179.1	-6.7	0	0	112.2	P229 L231 V235 T236 E237	P229-Q233 PolarHBondContact O-N 3.28Å; L231-Q233 VanDerWaalsContact C-N 3.29Å; L231-Q233 PolarHBondContact O-N 2.94Å; Q233-V235 PolarHBondContact O-N 3.07Å; Q233-T236 PolarHBondContact O-N 3.23Å; Q233-E237 HydrophobicContact CG-CG 4.48Å; Q233-E237 VanDerWaalsContact CG-OE1 3.24Å; Q233-E237 WeakPolarHBondContact CG-OE1 3.48Å; Q233-E237 PolarHBondContact NE2-OE1 2.79Å; Q233-E237 WeakPolarHBondContact O-CB 3.42Å; Q233-E237 WeakPolarHBondContact O-CG 3.19Å; Q233-E237 PolarHBondContact O-N 3.15Å
234	R	93.6	Very high	91.5	Very high	112 Å²	112	77.1 Å²	77.1	42%	0.423	38%	0.376	S	S	.	.	H	α-helix	trans	-70.2	-32.2	-178.1	-65	-175.6	-166.4	176	12	113.5	F223 D224 A230 L231 R232 G238 R239	F223-R234 HydrophobicContact CD1-CB 4.32Å; D224-R234 PolarHBondContact O-NH1 3.02Å; A230-R234 WeakPolarHBondContact O-CG 3.21Å; L231-R234 PolarHBondContact O-N 3.36Å; L231-R234 VanDerWaalsContact O-N 3.08Å; R232-R234 VanDerWaalsContact C-N 3.35Å; R232-R234 PolarHBondContact O-N 3.03Å; R234-G238 PolarHBondContact O-N 2.97Å; R234-G238 VanDerWaalsContact O-N 3.17Å; R234-R239 PolarHBondContact O-N 2.61Å
235	V	94	Very high	91.6	Very high	0 Å²	0	78.4 Å²	78.4	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-68.1	-49.2	175.1	167.7	0	0	0	0	110.2	P191 F194 W207 F223 L231 R232 Q233 E237 G238	P191-V235 HydrophobicContact CB-CG1 3.95Å; F194-V235 HydrophobicContact CD2-CB 4.27Å; F194-V235 HydrophobicContact CD2-CG1 3.66Å; F194-V235 HydrophobicContact CE2-CB 4.23Å; F194-V235 HydrophobicContact CE2-CG1 3.88Å; F194-V235 HydrophobicContact CE2-CG2 4.12Å; W207-V235 HydrophobicContact CH2-CG1 4.48Å; W207-V235 HydrophobicContact CZ2-CG1 3.84Å; F223-V235 HydrophobicContact CB-CG2 3.93Å; F223-V235 HydrophobicContact CD1-CG2 4.38Å; F223-V235 HydrophobicContact CD2-CG2 4.07Å; F223-V235 HydrophobicContact CG-CG2 3.88Å; L231-V235 HydrophobicContact CD1-CG2 4.3Å; L231-V235 HydrophobicContact CG-CG2 4.46Å; L231-V235 WeakPolarHBondContact O-CG2 3.17Å; L231-V235 PolarHBondContact O-N 3.02Å; R232-V235 PolarHBondContact O-N 3.49Å; Q233-V235 PolarHBondContact O-N 3.07Å; V235-E237 PolarHBondContact O-N 2.92Å; V235-G238 PolarHBondContact O-N 3.03Å
236	T	92.9	Very high	92	Very high	45 Å²	45	79.1 Å²	79.1	28%	0.276	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-35.6	174.8	-63.6	0	0	0	0	112.6	E195 R232 Q233 G238	E195-T236 VanDerWaalsContact OE1-CG2 3.26Å; E195-T236 WeakPolarHBondContact OE1-CG2 3.48Å; R232-T236 PolarHBondContact O-N 2.81Å; R232-T236 PolarHBondContact O-OG1 3.49Å; Q233-T236 PolarHBondContact O-N 3.23Å; T236-G238 PolarHBondContact O-N 2.85Å
237	E	93.2	Very high	92.4	Very high	76 Å²	76	75.5 Å²	75.5	36%	0.355	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-17	171.8	-79.1	-176.2	-137.7	0	0	113.3	Q233 V235 R239	Q233-E237 HydrophobicContact CG-CG 4.48Å; Q233-E237 VanDerWaalsContact CG-OE1 3.24Å; Q233-E237 WeakPolarHBondContact CG-OE1 3.48Å; Q233-E237 PolarHBondContact NE2-OE1 2.79Å; Q233-E237 WeakPolarHBondContact O-CB 3.42Å; Q233-E237 WeakPolarHBondContact O-CG 3.19Å; Q233-E237 PolarHBondContact O-N 3.15Å; V235-E237 PolarHBondContact O-N 2.92Å; E237-R239 HydrophobicContact CB-CB 4.31Å; E237-R239 HydrophobicContact CB-CG 4.25Å; E237-R239 PolarHBondContact O-N 2.89Å; E237-R239 VanDerWaalsContact O-N 3.16Å; E237-R239 VanDerWaalsContact OE2-CD 3.3Å; E237-R239 WeakPolarHBondContact OE2-CD 3.45Å; E237-R239 IonicContact OE2-CZ 3.43Å; E237-R239 IonicContact OE2-NE 2.86Å; E237-R239 IonicContact OE2-NH1 2.74Å; E237-R239 PolarHBondContact OE2-NH1 2.77Å
238	G	90.8	Very high	92.8	Very high	17 Å²	17	78.8 Å²	78.8	18%	0.175	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	12.9	-175.4	0	0	0	0	0	114.7	R234 V235 T236 F240	R234-G238 PolarHBondContact O-N 2.97Å; R234-G238 VanDerWaalsContact O-N 3.17Å; V235-G238 PolarHBondContact O-N 3.03Å; T236-G238 PolarHBondContact O-N 2.85Å; G238-F240 WeakPolarHBondContact O-CD1 3.47Å; G238-F240 PolarHBondContact O-N 2.83Å
239	R	85.9	Confident	93.2	Very high	180 Å²	180	76.6 Å²	76.6	68%	0.679	36%	0.358	S	S	*	.			trans	-95.4	100.2	-168.9	-76.8	174.7	-176.4	167.9	-7.9	112.6	R234 E237	R234-R239 PolarHBondContact O-N 2.61Å; E237-R239 HydrophobicContact CB-CB 4.31Å; E237-R239 HydrophobicContact CB-CG 4.25Å; E237-R239 PolarHBondContact O-N 2.89Å; E237-R239 VanDerWaalsContact O-N 3.16Å; E237-R239 VanDerWaalsContact OE2-CD 3.3Å; E237-R239 WeakPolarHBondContact OE2-CD 3.45Å; E237-R239 IonicContact OE2-CZ 3.43Å; E237-R239 IonicContact OE2-NE 2.86Å; E237-R239 IonicContact OE2-NH1 2.74Å; E237-R239 PolarHBondContact OE2-NH1 2.77Å
240	F	93.1	Very high	93.5	Very high	24 Å²	24	71.9 Å²	71.9	11%	0.105	33%	0.327	C	S	.	.			trans	-115.2	165.4	169.1	65	-76.7	0	0	0	111.3	Y214 P222 F223 G238 I242 I254 R255 L258	Y214-F240 HydrophobicContact CD2-CD2 4.08Å; Y214-F240 HydrophobicContact CD2-CE2 4.25Å; Y214-F240 AromaticContact CE2-CD2 3.94Å; Y214-F240 HydrophobicContact CE2-CD2 3.94Å; Y214-F240 HydrophobicContact CE2-CE2 4.43Å; P222-F240 HydrophobicContact CB-CB 3.7Å; P222-F240 HydrophobicContact CB-CD2 4.17Å; P222-F240 HydrophobicContact CB-CG 4.07Å; P222-F240 WeakPolarHBondContact O-CB 3.46Å; F223-F240 HydrophobicContact CD1-CB 4.35Å; F223-F240 HydrophobicContact CE1-CB 3.9Å; F223-F240 HydrophobicContact CE1-CD1 4.23Å; F223-F240 HydrophobicContact CZ-CB 4.25Å; F223-F240 AromaticContact CZ-CD1 3.98Å; F223-F240 HydrophobicContact CZ-CD1 3.98Å; F223-F240 HydrophobicContact CZ-CG 4.45Å; G238-F240 WeakPolarHBondContact O-CD1 3.47Å; G238-F240 PolarHBondContact O-N 2.83Å; F240-I242 HydrophobicContact CD2-CD1 3.99Å; F240-I242 HydrophobicContact CE2-CD1 3.41Å; F240-I242 VanDerWaalsContact CE2-CD1 3.41Å; F240-I242 HydrophobicContact CZ-CD1 4.23Å; F240-I254 HydrophobicContact CE2-CG2 3.65Å; F240-I254 HydrophobicContact CZ-CG2 3.77Å; F240-R255 HydrophobicContact CZ-CG 3.94Å; F240-L258 HydrophobicContact CD1-CD1 3.99Å; F240-L258 HydrophobicContact CD2-CD1 4.42Å; F240-L258 HydrophobicContact CE1-CB 3.84Å; F240-L258 HydrophobicContact CE1-CD1 3.76Å; F240-L258 HydrophobicContact CE1-CG 4.42Å; F240-L258 HydrophobicContact CE2-CD1 4.17Å; F240-L258 HydrophobicContact CG-CD1 4.34Å; F240-L258 HydrophobicContact CZ-CB 4.31Å; F240-L258 HydrophobicContact CZ-CD1 3.86Å
241	R	92.8	Very high	93.8	Very high	215 Å²	215	72.3 Å²	72.3	81%	0.811	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-96.5	144.7	-179.5	-67.3	-179.6	176.1	179	-3	110.5	Y214	Y214-R241 VanDerWaalsContact CE2-O 3.29Å; Y214-R241 WeakPolarHBondContact CE2-O 3.44Å; Y214-R241 PolarHBondContact OH-O 2.76Å
242	I	93.3	Very high	94	Very high	46 Å²	46	75 Å²	75	24%	0.236	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-103.2	124.6	170.7	-58.8	-60.5	0	0	0	108.7	F240 M246 E251	F240-I242 HydrophobicContact CD2-CD1 3.99Å; F240-I242 HydrophobicContact CE2-CD1 3.41Å; F240-I242 VanDerWaalsContact CE2-CD1 3.41Å; F240-I242 HydrophobicContact CZ-CD1 4.23Å; I242-M246 HydrophobicContact CD1-SD 4.01Å; I242-M246 HydrophobicContact CG2-CB 4.25Å; I242-M246 HydrophobicContact CG2-SD 3.93Å; I242-E251 HydrophobicContact CD1-CB 4.42Å; I242-E251 HydrophobicContact CD1-CG 3.86Å; I242-E251 HydrophobicContact CG1-CG 3.92Å; I242-E251 HydrophobicContact CG2-CB 4.31Å; I242-E251 HydrophobicContact CG2-CG 4.21Å
243	P	93.1	Very high	94.4	Very high	27 Å²	27	69.8 Å²	69.8	18%	0.175	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-76.3	144.9	173.6	-15	30.7	0	0	0	112.2	F245 M246	P243-F245 HydrophobicContact CB-CD1 3.67Å; P243-F245 HydrophobicContact CB-CD2 4.37Å; P243-F245 HydrophobicContact CB-CE1 3.18Å; P243-F245 HydrophobicContact CB-CE2 3.95Å; P243-F245 HydrophobicContact CB-CG 4.24Å; P243-F245 HydrophobicContact CB-CZ 3.33Å; P243-F245 HydrophobicContact CG-CE1 3.99Å; P243-F245 HydrophobicContact CG-CE2 4.24Å; P243-F245 HydrophobicContact CG-CZ 3.65Å; P243-F245 PolarHBondContact O-N 3.45Å; P243-M246 WeakPolarHBondContact O-CB 3.33Å; P243-M246 PolarHBondContact O-N 2.96Å
244	F	92.4	Very high	94.6	Very high	205 Å²	205	64.3 Å²	64.3	90%	0.899	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-12.9	-179	69.8	-93.8	0	0	0	116
245	F	93	Very high	94.8	Very high	71 Å²	71	64.5 Å²	64.5	31%	0.311	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.6	-179.1	59.9	-103.3	0	0	0	113.4	R119 P243	R119-F245 VanDerWaalsContact CZ-CE2 3.46Å; P243-F245 HydrophobicContact CB-CD1 3.67Å; P243-F245 HydrophobicContact CB-CD2 4.37Å; P243-F245 HydrophobicContact CB-CE1 3.18Å; P243-F245 HydrophobicContact CB-CE2 3.95Å; P243-F245 HydrophobicContact CB-CG 4.24Å; P243-F245 HydrophobicContact CB-CZ 3.33Å; P243-F245 HydrophobicContact CG-CE1 3.99Å; P243-F245 HydrophobicContact CG-CE2 4.24Å; P243-F245 HydrophobicContact CG-CZ 3.65Å; P243-F245 PolarHBondContact O-N 3.45Å
246	M	96.4	Very high	95	Very high	18 Å²	18	68.3 Å²	68.3	9%	0.089	31%	0.311	C	S	.	.	S	Bend	trans	-81.5	136.6	177.1	-177.8	178.7	-76	0	0	109.7	Y214 V217 C218 I242 P243 C250 E251 I254	Y214-M246 HydrophobicContact CD2-CE 4.1Å; Y214-M246 HydrophobicContact CE2-CE 4.26Å; V217-M246 HydrophobicContact CG2-CE 3.69Å; C218-M246 VanDerWaalsContact SG-CE 3.5Å; I242-M246 HydrophobicContact CD1-SD 4.01Å; I242-M246 HydrophobicContact CG2-CB 4.25Å; I242-M246 HydrophobicContact CG2-SD 3.93Å; P243-M246 WeakPolarHBondContact O-CB 3.33Å; P243-M246 PolarHBondContact O-N 2.96Å; M246-C250 HydrophobicContact CG-CB 3.8Å; M246-E251 HydrophobicContact CG-CB 4.45Å; M246-E251 HydrophobicContact SD-CB 3.97Å; M246-I254 HydrophobicContact CE-CD1 3.64Å; M246-I254 HydrophobicContact SD-CD1 4.01Å
247	S	97.3	Very high	95.3	Very high	41 Å²	41	66.2 Å²	66.2	29%	0.287	30%	0.298	S	S	.	.			trans	-68.9	149.8	175.5	76	0	0	0	0	111.5	E122 D249 C250 E251	E122-S247 PolarHBondContact OE1-N 2.83Å; E122-S247 PolarHBondContact OE1-OG 3.17Å; E122-S247 WeakPolarHBondContact OE2-CB 3.48Å; E122-S247 PolarHBondContact OE2-OG 3.09Å; S247-D249 PolarHBondContact O-N 2.88Å; S247-C250 WeakPolarHBondContact O-CB 3.44Å; S247-C250 PolarHBondContact O-N 2.69Å; S247-C250 VanDerWaalsContact OG-CB 3.31Å; S247-C250 WeakPolarHBondContact OG-CB 3.49Å; S247-C250 PolarHBondContact OG-N 2.79Å; S247-C250 VanDerWaalsContact OG-N 3.14Å; S247-E251 PolarHBondContact O-N 3.13Å
248	Q	97.4	Very high	95.5	Very high	129 Å²	129	62.9 Å²	62.9	60%	0.603	28%	0.283	S	S	*	.	H	α-helix	trans	-59.8	-33.5	179	-173.5	61.9	93.6	0	0	112.1	E251 N252	Q248-E251 PolarHBondContact NE2-OE2 3.27Å; Q248-N252 VanDerWaalsContact O-CB 3.24Å; Q248-N252 WeakPolarHBondContact O-CB 3.39Å; Q248-N252 PolarHBondContact O-N 2.89Å
249	D	97.8	Very high	95.8	Very high	46 Å²	46	63.8 Å²	63.8	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-69.7	-36.4	176.3	-76.8	-42.9	0	0	0	112.3	S247 L253 H274 R275 W276	S247-D249 PolarHBondContact O-N 2.88Å; D249-L253 PolarHBondContact O-N 2.89Å; D249-L253 VanDerWaalsContact O-N 3.15Å; D249-H274 PolarHBondContact O-CE1 2.73Å; D249-R275 VanDerWaalsContact CG-NE 3.33Å; D249-R275 WeakPolarHBondContact OD1-CD 3.42Å; D249-R275 WeakPolarHBondContact OD1-CG 3.21Å; D249-R275 IonicContact OD1-NE 3.41Å; D249-R275 PolarHBondContact OD1-NE 3.2Å; D249-R275 VanDerWaalsContact OD1-NE 3.15Å; D249-R275 IonicContact OD2-CZ 2.79Å; D249-R275 IonicContact OD2-NE 2.73Å; D249-R275 PolarHBondContact OD2-NE 2.87Å; D249-R275 IonicContact OD2-NH2 2.6Å; D249-W276 HydrophobicContact CB-CB 4.02Å
250	C	97.9	Very high	96.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.4	-47.1	174.7	-165.7	0	0	0	0	111.4	E122 M246 S247 N252 L253 I254 W276	E122-C250 WeakPolarHBondContact OE2-CB 3.1Å; M246-C250 HydrophobicContact CG-CB 3.8Å; S247-C250 WeakPolarHBondContact O-CB 3.44Å; S247-C250 PolarHBondContact O-N 2.69Å; S247-C250 VanDerWaalsContact OG-CB 3.31Å; S247-C250 WeakPolarHBondContact OG-CB 3.49Å; S247-C250 PolarHBondContact OG-N 2.79Å; S247-C250 VanDerWaalsContact OG-N 3.14Å; C250-N252 VanDerWaalsContact C-N 3.3Å; C250-N252 PolarHBondContact O-N 3.15Å; C250-L253 PolarHBondContact O-N 2.91Å; C250-I254 WeakPolarHBondContact O-CG1 3.48Å; C250-I254 PolarHBondContact O-N 3.5Å; C250-W276 HydrophobicContact CB-CG 4.31Å
251	E	97.6	Very high	96.3	Very high	35 Å²	35	59.1 Å²	59.1	16%	0.164	28%	0.277	C	S	.	.	H	α-helix	trans	-54.9	-47.7	173.3	172.7	-179.4	-166.6	0	0	110.9	I242 M246 S247 Q248 L253 I254 R255	I242-E251 HydrophobicContact CD1-CB 4.42Å; I242-E251 HydrophobicContact CD1-CG 3.86Å; I242-E251 HydrophobicContact CG1-CG 3.92Å; I242-E251 HydrophobicContact CG2-CB 4.31Å; I242-E251 HydrophobicContact CG2-CG 4.21Å; M246-E251 HydrophobicContact CG-CB 4.45Å; M246-E251 HydrophobicContact SD-CB 3.97Å; S247-E251 PolarHBondContact O-N 3.13Å; Q248-E251 PolarHBondContact NE2-OE2 3.27Å; E251-L253 VanDerWaalsContact C-N 3.29Å; E251-L253 PolarHBondContact O-N 3.08Å; E251-I254 PolarHBondContact O-N 3.39Å; E251-R255 HydrophobicContact CG-CG 4.21Å; E251-R255 WeakPolarHBondContact O-CB 3.48Å; E251-R255 WeakPolarHBondContact O-CG 3.31Å; E251-R255 PolarHBondContact O-N 2.81Å; E251-R255 IonicContact OE1-CZ 2.62Å; E251-R255 IonicContact OE1-NE 3.66Å; E251-R255 PolarHBondContact OE1-NE 2.86Å; E251-R255 IonicContact OE1-NH2 3.08Å; E251-R255 PolarHBondContact OE1-NH2 3.23Å
252	N	98.1	Very high	96.4	Very high	64 Å²	64	51.2 Å²	51.2	34%	0.342	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-37.6	-177.3	-165.2	-97.6	0	0	0	111.8	Q248 C250 K256 H274	Q248-N252 VanDerWaalsContact O-CB 3.24Å; Q248-N252 WeakPolarHBondContact O-CB 3.39Å; Q248-N252 PolarHBondContact O-N 2.89Å; C250-N252 VanDerWaalsContact C-N 3.3Å; C250-N252 PolarHBondContact O-N 3.15Å; N252-K256 WeakPolarHBondContact O-CB 3.24Å; N252-K256 WeakPolarHBondContact O-CD 3.09Å; N252-K256 VanDerWaalsContact O-CG 3.24Å; N252-K256 WeakPolarHBondContact O-CG 3.48Å; N252-K256 PolarHBondContact O-N 2.62Å; N252-K256 WeakPolarHBondContact OD1-CE 3.34Å; N252-K256 PolarHBondContact OD1-NZ 2.98Å; N252-H274 PolarHBondContact OD1-NE2 3.34Å
253	L	98.4	Very high	96.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.2	-48.8	174.1	-179.2	53.6	0	0	0	112.3	L213 D249 C250 E251 R255 K256 M257 I266 I271 H274 W276 M277	L213-L253 HydrophobicContact CD2-CD2 3.83Å; L213-L253 HydrophobicContact CD2-CG 4.16Å; D249-L253 PolarHBondContact O-N 2.89Å; D249-L253 VanDerWaalsContact O-N 3.15Å; C250-L253 PolarHBondContact O-N 2.91Å; E251-L253 VanDerWaalsContact C-N 3.29Å; E251-L253 PolarHBondContact O-N 3.08Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 3.11Å; L253-K256 PolarHBondContact O-N 3.43Å; L253-K256 VanDerWaalsContact O-N 3.14Å; L253-M257 HydrophobicContact CD1-CE 4.37Å; L253-M257 HydrophobicContact CD1-CG 4.43Å; L253-M257 HydrophobicContact CG-CE 3.99Å; L253-M257 PolarHBondContact O-N 3.32Å; L253-M257 VanDerWaalsContact O-N 3.07Å; L253-I266 HydrophobicContact CD1-CD1 4.2Å; L253-I271 HydrophobicContact CD1-CG1 4.3Å; L253-I271 HydrophobicContact CD1-CG2 4.13Å; L253-H274 HydrophobicContact CD1-CB 4.12Å; L253-W276 HydrophobicContact CD2-CB 4.3Å; L253-W276 HydrophobicContact CD2-CD2 4.29Å; L253-W276 HydrophobicContact CD2-CE3 3.6Å; L253-W276 HydrophobicContact CD2-CZ3 4.32Å; L253-M277 HydrophobicContact CD2-CG 4.11Å; L253-M277 HydrophobicContact CD2-SD 4.42Å
254	I	98.3	Very high	96.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-41.9	-178.5	-65	168.1	0	0	0	110.4	L213 Y214 V217 F240 M246 C250 E251 K256 M257 L258	L213-I254 HydrophobicContact CB-CG1 4.47Å; L213-I254 HydrophobicContact CD2-CD1 4.39Å; L213-I254 HydrophobicContact CD2-CG1 3.75Å; L213-I254 HydrophobicContact CG-CD1 4.17Å; L213-I254 HydrophobicContact CG-CG1 3.96Å; Y214-I254 HydrophobicContact CD2-CD1 4.35Å; Y214-I254 HydrophobicContact CD2-CG2 4.36Å; V217-I254 HydrophobicContact CG2-CD1 4.27Å; F240-I254 HydrophobicContact CE2-CG2 3.65Å; F240-I254 HydrophobicContact CZ-CG2 3.77Å; M246-I254 HydrophobicContact CE-CD1 3.64Å; M246-I254 HydrophobicContact SD-CD1 4.01Å; C250-I254 WeakPolarHBondContact O-CG1 3.48Å; C250-I254 PolarHBondContact O-N 3.5Å; E251-I254 PolarHBondContact O-N 3.39Å; I254-K256 VanDerWaalsContact C-N 3.29Å; I254-K256 PolarHBondContact O-N 3.16Å; I254-M257 PolarHBondContact O-N 2.95Å; I254-L258 HydrophobicContact CG2-CD1 3.74Å; I254-L258 HydrophobicContact CG2-CG 4.21Å; I254-L258 WeakPolarHBondContact O-CB 3.42Å; I254-L258 PolarHBondContact O-N 3.38Å
255	R	97.7	Very high	96.7	Very high	115 Å²	115	50.3 Å²	50.3	43%	0.434	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-33.2	175.1	-73.4	-172.8	-174.9	-73.8	4.3	113.4	F240 E251 L253 V259	F240-R255 HydrophobicContact CZ-CG 3.94Å; E251-R255 HydrophobicContact CG-CG 4.21Å; E251-R255 WeakPolarHBondContact O-CB 3.48Å; E251-R255 WeakPolarHBondContact O-CG 3.31Å; E251-R255 PolarHBondContact O-N 2.81Å; E251-R255 IonicContact OE1-CZ 2.62Å; E251-R255 IonicContact OE1-NE 3.66Å; E251-R255 PolarHBondContact OE1-NE 2.86Å; E251-R255 IonicContact OE1-NH2 3.08Å; E251-R255 PolarHBondContact OE1-NH2 3.23Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 3.11Å; R255-V259 VanDerWaalsContact O-CG2 3.28Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å
256	K	98	Very high	97	Very high	81 Å²	81	47.6 Å²	47.6	35%	0.352	25%	0.249	S	C	.	.	H	α-helix	trans	-74.9	-26.8	176.6	-79.8	173.3	179.8	166.3	0	113.4	N252 L253 I254 V259 I266 H274	N252-K256 WeakPolarHBondContact O-CB 3.24Å; N252-K256 WeakPolarHBondContact O-CD 3.09Å; N252-K256 VanDerWaalsContact O-CG 3.24Å; N252-K256 WeakPolarHBondContact O-CG 3.48Å; N252-K256 PolarHBondContact O-N 2.62Å; N252-K256 WeakPolarHBondContact OD1-CE 3.34Å; N252-K256 PolarHBondContact OD1-NZ 2.98Å; L253-K256 PolarHBondContact O-N 3.43Å; L253-K256 VanDerWaalsContact O-N 3.14Å; I254-K256 VanDerWaalsContact C-N 3.29Å; I254-K256 PolarHBondContact O-N 3.16Å; K256-V259 WeakPolarHBondContact O-CG2 3.43Å; K256-I266 VanDerWaalsContact C-CG2 3.47Å; K256-I266 HydrophobicContact CB-CB 3.98Å; K256-I266 HydrophobicContact CB-CD1 4.13Å; K256-I266 HydrophobicContact CB-CG2 3.97Å; K256-I266 HydrophobicContact CD-CD1 4.09Å; K256-I266 WeakPolarHBondContact O-CG2 3.24Å; K256-I266 PolarHBondContact O-N 2.97Å; K256-I266 VanDerWaalsContact O-N 3.12Å; K256-H274 PolarHBondContact NZ-NE2 2.99Å
257	M	98.3	Very high	97	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-82.9	-39.5	171.8	-68.5	-165.3	-76.4	0	0	112.6	F129 I206 L209 L213 L253 I254 V259 R265 I266 I271	F129-M257 HydrophobicContact CE1-CE 4.09Å; F129-M257 HydrophobicContact CE1-SD 4.41Å; F129-M257 HydrophobicContact CE2-CE 4.42Å; F129-M257 HydrophobicContact CZ-CE 3.59Å; F129-M257 HydrophobicContact CZ-SD 3.8Å; I206-M257 HydrophobicContact CG2-CB 4.39Å; I206-M257 HydrophobicContact CG2-CG 4.19Å; L209-M257 HydrophobicContact CB-SD 4.09Å; L213-M257 HydrophobicContact CB-CE 4Å; L213-M257 HydrophobicContact CD2-CE 3.52Å; L213-M257 HydrophobicContact CG-CE 4.39Å; L253-M257 HydrophobicContact CD1-CE 4.37Å; L253-M257 HydrophobicContact CD1-CG 4.43Å; L253-M257 HydrophobicContact CG-CE 3.99Å; L253-M257 PolarHBondContact O-N 3.32Å; L253-M257 VanDerWaalsContact O-N 3.07Å; I254-M257 PolarHBondContact O-N 2.95Å; M257-V259 PolarHBondContact O-N 3.32Å; M257-V259 VanDerWaalsContact O-N 3.13Å; M257-R265 VanDerWaalsContact O-CD 3.29Å; M257-R265 WeakPolarHBondContact O-CD 3.43Å; M257-R265 VanDerWaalsContact O-CG 3.23Å; M257-R265 WeakPolarHBondContact O-CG 3.34Å; M257-I266 HydrophobicContact CB-CG2 4.36Å; M257-I266 HydrophobicContact CG-CG2 3.59Å; M257-I271 HydrophobicContact CG-CD1 4.05Å; M257-I271 HydrophobicContact CG-CG1 4.45Å; M257-I271 HydrophobicContact SD-CD1 3.78Å; M257-I271 HydrophobicContact SD-CG1 4.46Å
258	L	97.8	Very high	96.9	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	25%	0.252	C	S	.	.	S	Bend	trans	-87.1	42.6	179	-60.3	-176.7	0	0	0	112.7	W207 V211 P222 F223 F240 I254	W207-L258 HydrophobicContact CD2-CD2 3.78Å; W207-L258 HydrophobicContact CE3-CB 4.42Å; W207-L258 HydrophobicContact CE3-CD2 4.05Å; W207-L258 HydrophobicContact CG-CD2 4.19Å; W207-L258 HydrophobicContact CH2-CB 4.48Å; W207-L258 HydrophobicContact CH2-CD2 4.49Å; W207-L258 HydrophobicContact CZ2-CD2 4.24Å; W207-L258 VanDerWaalsContact CZ3-C 3.46Å; W207-L258 HydrophobicContact CZ3-CB 4.18Å; W207-L258 HydrophobicContact CZ3-CD2 4.4Å; W207-L258 WeakPolarHBondContact O-CD2 3.32Å; V211-L258 HydrophobicContact CG2-CD2 3.84Å; P222-L258 HydrophobicContact CB-CD1 4.31Å; P222-L258 HydrophobicContact CG-CD1 4.28Å; F223-L258 HydrophobicContact CE2-CD1 4.09Å; F223-L258 HydrophobicContact CE2-CD2 4.34Å; F223-L258 HydrophobicContact CZ-CD1 4.28Å; F240-L258 HydrophobicContact CD1-CD1 3.99Å; F240-L258 HydrophobicContact CD2-CD1 4.42Å; F240-L258 HydrophobicContact CE1-CB 3.84Å; F240-L258 HydrophobicContact CE1-CD1 3.76Å; F240-L258 HydrophobicContact CE1-CG 4.42Å; F240-L258 HydrophobicContact CE2-CD1 4.17Å; F240-L258 HydrophobicContact CG-CD1 4.34Å; F240-L258 HydrophobicContact CZ-CB 4.31Å; F240-L258 HydrophobicContact CZ-CD1 3.86Å; I254-L258 HydrophobicContact CG2-CD1 3.74Å; I254-L258 HydrophobicContact CG2-CG 4.21Å; I254-L258 WeakPolarHBondContact O-CB 3.42Å; I254-L258 PolarHBondContact O-N 3.38Å
259	V	97.2	Very high	96.7	Very high	36 Å²	36	44.6 Å²	44.6	22%	0.218	25%	0.248	C	C	.	.			trans	-84.6	125.3	171.8	-177.6	0	0	0	0	108.9	R255 K256 M257 D261 K264 R265	R255-V259 VanDerWaalsContact O-CG2 3.28Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; K256-V259 WeakPolarHBondContact O-CG2 3.43Å; M257-V259 PolarHBondContact O-N 3.32Å; M257-V259 VanDerWaalsContact O-N 3.13Å; V259-D261 HydrophobicContact CG1-CB 4.32Å; V259-D261 WeakPolarHBondContact CG1-O 3.31Å; V259-D261 PolarHBondContact O-N 3.04Å; V259-K264 HydrophobicContact CG1-CB 3.85Å; V259-R265 HydrophobicContact CB-CB 4.43Å; V259-R265 HydrophobicContact CB-CG 4.4Å; V259-R265 PolarHBondContact O-NE 3.49Å; V259-R265 PolarHBondContact O-NH2 3.33Å; V259-R265 VanDerWaalsContact O-NH2 3.07Å
260	V	95.7	Very high	96.7	Very high	50 Å²	50	47.5 Å²	47.5	30%	0.303	26%	0.26	S	S	.	.	S	Bend	trans	-61.4	-45.6	-177.3	176	0	0	0	0	111.3	P191 W207 P262 R265	P191-V260 HydrophobicContact CB-CG1 4.1Å; P191-V260 HydrophobicContact CG-CB 4.28Å; P191-V260 HydrophobicContact CG-CG1 3.86Å; W207-V260 HydrophobicContact CZ3-CG2 4.45Å; V260-P262 WeakPolarHBondContact O-CD 3.44Å; V260-R265 PolarHBondContact O-NH2 3.03Å; V260-R265 VanDerWaalsContact O-NH2 3.09Å
261	D	94.7	Very high	96.7	Very high	56 Å²	56	47.5 Å²	47.5	30%	0.299	26%	0.26	S	S	.	.	S	Bend	trans	-70.1	113.8	173.3	-179.3	-21.6	0	0	0	110.8	V259 A263 K264 R265	V259-D261 HydrophobicContact CG1-CB 4.32Å; V259-D261 WeakPolarHBondContact CG1-O 3.31Å; V259-D261 PolarHBondContact O-N 3.04Å; D261-A263 VanDerWaalsContact C-N 3.28Å; D261-A263 PolarHBondContact O-N 3.23Å; D261-A263 WeakPolarHBondContact OD1-CB 3.38Å; D261-A263 PolarHBondContact OD1-N 3.48Å; D261-K264 HydrophobicContact CB-CB 4.19Å; D261-K264 HydrophobicContact CB-CD 4.23Å; D261-K264 HydrophobicContact CB-CG 4.34Å; D261-K264 PolarHBondContact O-N 2.92Å; D261-K264 PolarHBondContact OD1-N 3.36Å; D261-K264 WeakPolarHBondContact OD2-CD 3.39Å; D261-K264 WeakPolarHBondContact OD2-CE 3.45Å; D261-K264 IonicContact OD2-NZ 2.81Å; D261-K264 PolarHBondContact OD2-NZ 3.48Å; D261-R265 PolarHBondContact O-N 3.38Å
262	P	93.9	Very high	96.5	Very high	48 Å²	48	47.5 Å²	47.5	31%	0.312	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-67.1	-26.6	-176.7	27.7	-34.5	0	0	0	113.1	Q203 V260 K264 R265	Q203-P262 HydrophobicContact CB-CB 4.02Å; Q203-P262 HydrophobicContact CG-CB 4.36Å; V260-P262 WeakPolarHBondContact O-CD 3.44Å; P262-K264 VanDerWaalsContact C-N 3.29Å; P262-K264 PolarHBondContact O-N 2.97Å; P262-R265 VanDerWaalsContact O-CB 3.31Å; P262-R265 WeakPolarHBondContact O-CB 3.48Å; P262-R265 PolarHBondContact O-N 3.31Å
263	A	93	Very high	96.4	Very high	93 Å²	93	51.5 Å²	51.5	77%	0.769	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-76.4	-18.1	178.3	0	0	0	0	0	112.8	D261	D261-A263 VanDerWaalsContact C-N 3.28Å; D261-A263 PolarHBondContact O-N 3.23Å; D261-A263 WeakPolarHBondContact OD1-CB 3.38Å; D261-A263 PolarHBondContact OD1-N 3.48Å
264	K	95.8	Very high	96.3	Very high	151 Å²	151	52.2 Å²	52.2	66%	0.657	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-97.6	1	172.9	-66.9	179	-179.1	61.5	0	113.3	V259 D261 P262	V259-K264 HydrophobicContact CG1-CB 3.85Å; D261-K264 HydrophobicContact CB-CB 4.19Å; D261-K264 HydrophobicContact CB-CD 4.23Å; D261-K264 HydrophobicContact CB-CG 4.34Å; D261-K264 PolarHBondContact O-N 2.92Å; D261-K264 PolarHBondContact OD1-N 3.36Å; D261-K264 WeakPolarHBondContact OD2-CD 3.39Å; D261-K264 WeakPolarHBondContact OD2-CE 3.45Å; D261-K264 IonicContact OD2-NZ 2.81Å; D261-K264 PolarHBondContact OD2-NZ 3.48Å; P262-K264 VanDerWaalsContact C-N 3.29Å; P262-K264 PolarHBondContact O-N 2.97Å
265	R	97.3	Very high	96.2	Very high	16 Å²	16	60.8 Å²	60.8	6%	0.06	31%	0.312	C	S	.	.	S	Bend	trans	-77.4	136.9	-177.4	-155	173.5	-67	154.7	3.3	110.3	E192 Q203 I206 M257 V259 V260 D261 P262	E192-R265 IonicContact OE1-CZ 2.69Å; E192-R265 IonicContact OE1-NH1 2.79Å; E192-R265 PolarHBondContact OE1-NH1 3.01Å; E192-R265 IonicContact OE1-NH2 3.64Å; E192-R265 PolarHBondContact OE1-NH2 2.66Å; E192-R265 IonicContact OE2-CZ 2.73Å; E192-R265 IonicContact OE2-NH1 3.62Å; E192-R265 IonicContact OE2-NH2 3.52Å; E192-R265 PolarHBondContact OE2-NH2 2.76Å; Q203-R265 VanDerWaalsContact C-NH1 3.33Å; Q203-R265 WeakPolarHBondContact O-CD 3.02Å; Q203-R265 PolarHBondContact O-NH1 2.89Å; I206-R265 HydrophobicContact CG2-CG 3.98Å; M257-R265 VanDerWaalsContact O-CD 3.29Å; M257-R265 WeakPolarHBondContact O-CD 3.43Å; M257-R265 VanDerWaalsContact O-CG 3.23Å; M257-R265 WeakPolarHBondContact O-CG 3.34Å; V259-R265 HydrophobicContact CB-CB 4.43Å; V259-R265 HydrophobicContact CB-CG 4.4Å; V259-R265 PolarHBondContact O-NE 3.49Å; V259-R265 PolarHBondContact O-NH2 3.33Å; V259-R265 VanDerWaalsContact O-NH2 3.07Å; V260-R265 PolarHBondContact O-NH2 3.03Å; V260-R265 VanDerWaalsContact O-NH2 3.09Å; D261-R265 PolarHBondContact O-N 3.38Å; P262-R265 VanDerWaalsContact O-CB 3.31Å; P262-R265 WeakPolarHBondContact O-CB 3.48Å; P262-R265 PolarHBondContact O-N 3.31Å
266	I	97.8	Very high	96.2	Very high	13 Å²	13	55.5 Å²	55.5	7%	0.067	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-60.2	135.5	-176.1	-169.8	179.2	0	0	0	112.3	I206 L253 K256 M257 Q270 I271	I206-I266 HydrophobicContact CG2-CG2 4.41Å; I206-I266 WeakPolarHBondContact CG2-O 3.38Å; L253-I266 HydrophobicContact CD1-CD1 4.2Å; K256-I266 VanDerWaalsContact C-CG2 3.47Å; K256-I266 HydrophobicContact CB-CB 3.98Å; K256-I266 HydrophobicContact CB-CD1 4.13Å; K256-I266 HydrophobicContact CB-CG2 3.97Å; K256-I266 HydrophobicContact CD-CD1 4.09Å; K256-I266 WeakPolarHBondContact O-CG2 3.24Å; K256-I266 PolarHBondContact O-N 2.97Å; K256-I266 VanDerWaalsContact O-N 3.12Å; M257-I266 HydrophobicContact CB-CG2 4.36Å; M257-I266 HydrophobicContact CG-CG2 3.59Å; I266-Q270 HydrophobicContact CD1-CB 3.95Å; I266-Q270 HydrophobicContact CG1-CB 3.44Å; I266-Q270 VanDerWaalsContact CG1-CB 3.44Å; I266-I271 HydrophobicContact CB-CG1 4.49Å; I266-I271 HydrophobicContact CD1-CG1 3.89Å; I266-I271 HydrophobicContact CG1-CG1 4.05Å; I266-I271 HydrophobicContact CG2-CD1 4.05Å; I266-I271 HydrophobicContact CG2-CG1 3.7Å
267	S	96.6	Very high	96.1	Very high	48 Å²	48	51.6 Å²	51.6	34%	0.336	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-78.7	157.1	178.7	78.8	0	0	0	0	112.8	A269 Q270 I271	S267-A269 PolarHBondContact O-N 3.35Å; S267-Q270 CarbonylContact O-C 3.46Å; S267-Q270 WeakPolarHBondContact O-CA 3.49Å; S267-Q270 WeakPolarHBondContact O-CB 3.47Å; S267-Q270 PolarHBondContact O-N 3.32Å; S267-Q270 WeakPolarHBondContact OG-CG 3.45Å; S267-Q270 PolarHBondContact OG-N 2.88Å; S267-I271 WeakPolarHBondContact O-CG1 3.43Å; S267-I271 PolarHBondContact O-N 3.38Å
268	V	95.5	Very high	95.8	Very high	14 Å²	14	56 Å²	56	9%	0.085	30%	0.298	C	S	.	.	H	α-helix	trans	-52.5	-39.3	176.1	170.3	0	0	0	0	112.5	L133 D137 I206 I271 K272	L133-V268 HydrophobicContact CD1-CG1 4.08Å; L133-V268 HydrophobicContact CD1-CG2 4.42Å; L133-V268 HydrophobicContact CG-CG1 4.49Å; D137-V268 HydrophobicContact CB-CG1 3.63Å; I206-V268 HydrophobicContact CD1-CG2 4.03Å; I206-V268 HydrophobicContact CG1-CG2 4.09Å; V268-I271 PolarHBondContact O-N 2.98Å; V268-K272 WeakPolarHBondContact O-CG 3.36Å; V268-K272 PolarHBondContact O-N 3.19Å; V268-K272 VanDerWaalsContact O-N 3.11Å
269	A	94.4	Very high	95.4	Very high	63 Å²	63	58.8 Å²	58.8	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-42.5	176	0	0	0	0	0	112.4	S267 K272 Q273	S267-A269 PolarHBondContact O-N 3.35Å; A269-K272 PolarHBondContact O-N 2.81Å; A269-Q273 PolarHBondContact O-N 3.42Å
270	Q	97.1	Very high	94.8	Very high	107 Å²	107	58.2 Å²	58.2	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-34.2	176.2	-69.3	167.9	-17.5	0	0	112.3	I266 S267 Q273 H274	I266-Q270 HydrophobicContact CD1-CB 3.95Å; I266-Q270 HydrophobicContact CG1-CB 3.44Å; I266-Q270 VanDerWaalsContact CG1-CB 3.44Å; S267-Q270 CarbonylContact O-C 3.46Å; S267-Q270 WeakPolarHBondContact O-CA 3.49Å; S267-Q270 WeakPolarHBondContact O-CB 3.47Å; S267-Q270 PolarHBondContact O-N 3.32Å; S267-Q270 WeakPolarHBondContact OG-CG 3.45Å; S267-Q270 PolarHBondContact OG-N 2.88Å; Q270-Q273 PolarHBondContact O-N 2.92Å; Q270-H274 PolarHBondContact O-N 3.4Å; Q270-H274 VanDerWaalsContact O-N 3.16Å
271	I	97.6	Very high	93.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-47.2	172.6	-63.6	168.3	0	0	0	110	F129 L133 I206 L253 M257 I266 S267 V268 Q273 H274 M277	F129-I271 HydrophobicContact CE1-CG2 4.03Å; L133-I271 HydrophobicContact CD1-CB 4.41Å; L133-I271 HydrophobicContact CD1-CD1 4.19Å; L133-I271 HydrophobicContact CD1-CG2 4.08Å; L133-I271 HydrophobicContact CD2-CB 4.07Å; L133-I271 HydrophobicContact CD2-CG2 3.4Å; L133-I271 VanDerWaalsContact CD2-CG2 3.4Å; L133-I271 HydrophobicContact CG-CG2 4.4Å; I206-I271 HydrophobicContact CG2-CD1 4.2Å; L253-I271 HydrophobicContact CD1-CG1 4.3Å; L253-I271 HydrophobicContact CD1-CG2 4.13Å; M257-I271 HydrophobicContact CG-CD1 4.05Å; M257-I271 HydrophobicContact CG-CG1 4.45Å; M257-I271 HydrophobicContact SD-CD1 3.78Å; M257-I271 HydrophobicContact SD-CG1 4.46Å; I266-I271 HydrophobicContact CB-CG1 4.49Å; I266-I271 HydrophobicContact CD1-CG1 3.89Å; I266-I271 HydrophobicContact CG1-CG1 4.05Å; I266-I271 HydrophobicContact CG2-CD1 4.05Å; I266-I271 HydrophobicContact CG2-CG1 3.7Å; S267-I271 WeakPolarHBondContact O-CG1 3.43Å; S267-I271 PolarHBondContact O-N 3.38Å; V268-I271 PolarHBondContact O-N 2.98Å; I271-Q273 PolarHBondContact O-N 3.39Å; I271-H274 WeakPolarHBondContact O-CB 3.1Å; I271-H274 PolarHBondContact O-N 2.95Å; I271-M277 HydrophobicContact CG2-CG 4.33Å; I271-M277 VanDerWaalsContact O-CG 3.28Å; I271-M277 WeakPolarHBondContact O-CG 3.28Å
272	K	94.4	Very high	92.8	Very high	36 Å²	36	59.2 Å²	59.2	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-29.1	179.7	-72.8	-175.2	172.5	-170.8	0	113.6	W130 L133 D137 V268 A269	W130-K272 HydrophobicContact CH2-CB 4.02Å; W130-K272 HydrophobicContact CH2-CG 4.13Å; W130-K272 HydrophobicContact CZ3-CB 4.24Å; W130-K272 HydrophobicContact CZ3-CD 4.18Å; W130-K272 HydrophobicContact CZ3-CG 3.84Å; L133-K272 HydrophobicContact CD2-CG 3.61Å; L133-K272 HydrophobicContact CG-CG 4.36Å; D137-K272 WeakPolarHBondContact OD2-CE 3.49Å; D137-K272 IonicContact OD2-NZ 2.79Å; D137-K272 PolarHBondContact OD2-NZ 3Å; V268-K272 WeakPolarHBondContact O-CG 3.36Å; V268-K272 PolarHBondContact O-N 3.19Å; V268-K272 VanDerWaalsContact O-N 3.11Å; A269-K272 PolarHBondContact O-N 2.81Å
273	Q	95.1	Very high	91.7	Very high	147 Å²	147	57 Å²	57	69%	0.687	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	0.1	175.7	-65.4	178.4	-10.7	0	0	113.4	A269 Q270 I271 L278	A269-Q273 PolarHBondContact O-N 3.42Å; Q270-Q273 PolarHBondContact O-N 2.92Å; I271-Q273 PolarHBondContact O-N 3.39Å; Q273-L278 WeakPolarHBondContact O-CD1 3.44Å
274	H	97.3	Very high	90.6	Very high	15 Å²	15	53 Å²	53	7%	0.069	28%	0.282	C	S	.	.			trans	-68.9	140.1	-175.9	-159.3	-96.9	0	0	0	111.6	D249 N252 L253 K256 Q270 I271 W276 M277 L278	D249-H274 PolarHBondContact O-CE1 2.73Å; N252-H274 PolarHBondContact OD1-NE2 3.34Å; L253-H274 HydrophobicContact CD1-CB 4.12Å; K256-H274 PolarHBondContact NZ-NE2 2.99Å; Q270-H274 PolarHBondContact O-N 3.4Å; Q270-H274 VanDerWaalsContact O-N 3.16Å; I271-H274 WeakPolarHBondContact O-CB 3.1Å; I271-H274 PolarHBondContact O-N 2.95Å; H274-W276 PolarHBondContact ND1-N 2.85Å; H274-W276 PolarHBondContact O-N 3.24Å; H274-W276 VanDerWaalsContact O-N 3.13Å; H274-M277 HydrophobicContact CB-CG 4.43Å; H274-M277 WeakPolarHBondContact O-CA 3.49Å; H274-M277 WeakPolarHBondContact O-CB 3.43Å; H274-M277 PolarHBondContact O-N 3.27Å; H274-L278 PolarHBondContact O-N 3.02Å; H274-L278 VanDerWaalsContact O-N 3.09Å
275	R	96.3	Very high	89.3	Confident	181 Å²	181	52.4 Å²	52.4	68%	0.683	28%	0.281	S	S	*	.	H	α-helix	trans	-50.2	-42.3	-178.9	179.8	170.3	155.2	138.4	2.6	113.2	D249 M277 L278 A279	D249-R275 VanDerWaalsContact CG-NE 3.33Å; D249-R275 WeakPolarHBondContact OD1-CD 3.42Å; D249-R275 WeakPolarHBondContact OD1-CG 3.21Å; D249-R275 IonicContact OD1-NE 3.41Å; D249-R275 PolarHBondContact OD1-NE 3.2Å; D249-R275 VanDerWaalsContact OD1-NE 3.15Å; D249-R275 IonicContact OD2-CZ 2.79Å; D249-R275 IonicContact OD2-NE 2.73Å; D249-R275 PolarHBondContact OD2-NE 2.87Å; D249-R275 IonicContact OD2-NH2 2.6Å; R275-M277 VanDerWaalsContact C-N 3.33Å; R275-M277 PolarHBondContact O-N 3.41Å; R275-L278 PolarHBondContact O-N 3.25Å; R275-A279 PolarHBondContact O-N 3.49Å; R275-A279 VanDerWaalsContact O-N 3.11Å
276	W	97.1	Very high	87.9	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.011	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-34.8	174.6	-169.4	79.4	0	0	0	114.3	E122 A125 R126 F129 L213 D249 C250 L253 H274	E122-W276 HydrophobicContact CB-CZ2 4.03Å; E122-W276 HydrophobicContact CG-CZ2 4.41Å; E122-W276 WeakPolarHBondContact O-CZ2 3.35Å; E122-W276 PolarHBondContact OE2-NE1 3.37Å; A125-W276 HydrophobicContact CB-CH2 4.4Å; R126-W276 VanDerWaalsContact CA-CH2 3.43Å; R126-W276 HydrophobicContact CB-CH2 3.61Å; R126-W276 HydrophobicContact CB-CZ2 4Å; R126-W276 HydrophobicContact CB-CZ3 3.92Å; R126-W276 WeakPolarHBondContact CD-O 3.44Å; R126-W276 HydrophobicContact CG-CE3 4.21Å; R126-W276 HydrophobicContact CG-CH2 4.15Å; R126-W276 HydrophobicContact CG-CZ3 3.93Å; R126-W276 PolarHBondContact NE-O 2.7Å; F129-W276 HydrophobicContact CB-CZ3 4.41Å; F129-W276 HydrophobicContact CD1-CZ3 4.26Å; L213-W276 HydrophobicContact CD1-CH2 3.48Å; L213-W276 VanDerWaalsContact CD1-CH2 3.48Å; L213-W276 HydrophobicContact CD1-CZ2 4.24Å; L213-W276 HydrophobicContact CD1-CZ3 3.82Å; L213-W276 HydrophobicContact CD2-CE3 4.49Å; L213-W276 HydrophobicContact CD2-CH2 4.48Å; L213-W276 HydrophobicContact CD2-CZ3 4.13Å; D249-W276 HydrophobicContact CB-CB 4.02Å; C250-W276 HydrophobicContact CB-CG 4.31Å; L253-W276 HydrophobicContact CD2-CB 4.3Å; L253-W276 HydrophobicContact CD2-CD2 4.29Å; L253-W276 HydrophobicContact CD2-CE3 3.6Å; L253-W276 HydrophobicContact CD2-CZ3 4.32Å; H274-W276 PolarHBondContact ND1-N 2.85Å; H274-W276 PolarHBondContact O-N 3.24Å; H274-W276 VanDerWaalsContact O-N 3.13Å
277	M	94.9	Very high	86.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-77.2	-33.8	178.8	-69.5	-61.4	-80.6	0	0	112.3	R126 F129 W130 L133 L253 I271 H274 R275 A279	R126-M277 HydrophobicContact CG-SD 4.27Å; F129-M277 HydrophobicContact CD1-CE 3.82Å; F129-M277 HydrophobicContact CD1-SD 3.68Å; F129-M277 HydrophobicContact CE1-CE 4.49Å; F129-M277 HydrophobicContact CE1-SD 4.35Å; W130-M277 HydrophobicContact CB-CE 4.37Å; W130-M277 HydrophobicContact CD2-CE 3.53Å; W130-M277 HydrophobicContact CE3-CE 4.1Å; W130-M277 HydrophobicContact CG-CE 3.64Å; W130-M277 HydrophobicContact CZ2-CB 3.91Å; W130-M277 HydrophobicContact CZ2-CE 4.18Å; W130-M277 PolarHBondContact NE1-O 3.12Å; L133-M277 HydrophobicContact CD2-CE 3.84Å; L253-M277 HydrophobicContact CD2-CG 4.11Å; L253-M277 HydrophobicContact CD2-SD 4.42Å; I271-M277 HydrophobicContact CG2-CG 4.33Å; I271-M277 VanDerWaalsContact O-CG 3.28Å; I271-M277 WeakPolarHBondContact O-CG 3.28Å; H274-M277 HydrophobicContact CB-CG 4.43Å; H274-M277 WeakPolarHBondContact O-CA 3.49Å; H274-M277 WeakPolarHBondContact O-CB 3.43Å; H274-M277 PolarHBondContact O-N 3.27Å; R275-M277 VanDerWaalsContact C-N 3.33Å; R275-M277 PolarHBondContact O-N 3.41Å; M277-A279 VanDerWaalsContact C-N 3.35Å
278	L	92.9	Very high	85.2	Confident	92 Å²	92	57.9 Å²	57.9	48%	0.482	31%	0.305	S	S	.	.	H	α-helix	trans	-81.7	-10.7	179.5	-60.3	179.4	0	0	0	113.7	Q273 H274 R275 D280 P281	Q273-L278 WeakPolarHBondContact O-CD1 3.44Å; H274-L278 PolarHBondContact O-N 3.02Å; H274-L278 VanDerWaalsContact O-N 3.09Å; R275-L278 PolarHBondContact O-N 3.25Å; L278-D280 PolarHBondContact O-N 2.9Å; L278-P281 WeakPolarHBondContact O-CD 3.42Å
279	A	89.9	Confident	83.5	Confident	65 Å²	65	60.3 Å²	60.3	54%	0.537	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.7	-179	0	0	0	0	0	114.7	R275 M277	R275-A279 PolarHBondContact O-N 3.49Å; R275-A279 VanDerWaalsContact O-N 3.11Å; M277-A279 VanDerWaalsContact C-N 3.35Å
280	D	82.8	Confident	81.8	Confident	25 Å²	25	62.7 Å²	62.7	13%	0.134	32%	0.322	C	S	.	.			trans	-126.4	95.5	164.6	-179.7	-7.5	0	0	0	109.4	K127 L278 S282 A283	K127-D280 WeakPolarHBondContact CE-OD2 3.48Å; K127-D280 IonicContact NZ-OD2 2.71Å; K127-D280 PolarHBondContact NZ-OD2 2.91Å; L278-D280 PolarHBondContact O-N 2.9Å; D280-S282 PolarHBondContact O-N 3.09Å; D280-S282 WeakPolarHBondContact OD1-CA 3.46Å; D280-S282 VanDerWaalsContact OD1-CB 3.25Å; D280-S282 WeakPolarHBondContact OD1-CB 3.44Å; D280-S282 PolarHBondContact OD1-N 2.9Å; D280-S282 PolarHBondContact OD1-OG 3.01Å; D280-S282 PolarHBondContact OD2-OG 2.78Å; D280-A283 HydrophobicContact CB-CB 4.36Å; D280-A283 PolarHBondContact O-N 3.39Å; D280-A283 PolarHBondContact OD1-N 3.38Å
281	P	72.9	Confident	79.9	Confident	77 Å²	77	58.1 Å²	58.1	50%	0.5	30%	0.302	S	S	.	.	H	α-helix	trans	-60.8	-25.2	176.8	-25.5	35.6	0	0	0	113.7	L278 A284 H285	L278-P281 WeakPolarHBondContact O-CD 3.42Å; P281-A284 PolarHBondContact O-N 2.89Å; P281-H285 PolarHBondContact O-N 3.42Å; P281-H285 PolarHBondContact O-ND1 2.93Å
282	S	75.9	Confident	77.6	Confident	50 Å²	50	64.2 Å²	64.2	35%	0.35	33%	0.334	S	S	.	.	H	α-helix	trans	-68	-36.8	-178.9	79.1	0	0	0	0	111.7	D280 A284 H285 Q286	D280-S282 PolarHBondContact O-N 3.09Å; D280-S282 WeakPolarHBondContact OD1-CA 3.46Å; D280-S282 VanDerWaalsContact OD1-CB 3.25Å; D280-S282 WeakPolarHBondContact OD1-CB 3.44Å; D280-S282 PolarHBondContact OD1-N 2.9Å; D280-S282 PolarHBondContact OD1-OG 3.01Å; D280-S282 PolarHBondContact OD2-OG 2.78Å; S282-A284 PolarHBondContact O-N 2.84Å; S282-H285 PolarHBondContact O-N 3.17Å; S282-Q286 WeakPolarHBondContact O-CB 3.48Å; S282-Q286 WeakPolarHBondContact O-CG 3.31Å; S282-Q286 PolarHBondContact O-N 3.25Å; S282-Q286 PolarHBondContact O-NE2 2.96Å
283	A	70.8	Confident	75.5	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-41.9	175.3	0	0	0	0	0	112.1	K127 D280 T287	K127-A283 HydrophobicContact CG-CB 3.6Å; D280-A283 HydrophobicContact CB-CB 4.36Å; D280-A283 PolarHBondContact O-N 3.39Å; D280-A283 PolarHBondContact OD1-N 3.38Å; A283-T287 WeakPolarHBondContact O-CB 3.16Å; A283-T287 PolarHBondContact O-N 3.14Å; A283-T287 PolarHBondContact O-OG1 3.14Å
284	A	71.3	Confident	73.5	Confident	10 Å²	10	63 Å²	63	8%	0.083	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-50.8	176.4	0	0	0	0	0	111.3	W130 P281 S282 Q286 T287 L288	W130-A284 HydrophobicContact CD2-CB 4.31Å; W130-A284 HydrophobicContact CH2-CB 4.11Å; W130-A284 HydrophobicContact CZ2-CB 3.62Å; P281-A284 PolarHBondContact O-N 2.89Å; S282-A284 PolarHBondContact O-N 2.84Å; A284-Q286 PolarHBondContact O-N 2.93Å; A284-T287 PolarHBondContact O-N 3.06Å; A284-L288 WeakPolarHBondContact O-CB 3.31Å; A284-L288 WeakPolarHBondContact O-CG 3.18Å; A284-L288 PolarHBondContact O-N 3.35Å
285	H	66.8	Low	71	Confident	138 Å²	138	65.4 Å²	65.4	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-60.8	-46.7	-178.8	-75.3	83.5	0	0	0	112.4	P281 S282 T287 L288 S289	P281-H285 PolarHBondContact O-N 3.42Å; P281-H285 PolarHBondContact O-ND1 2.93Å; S282-H285 PolarHBondContact O-N 3.17Å; H285-T287 PolarHBondContact O-N 3.22Å; H285-L288 PolarHBondContact O-N 3.44Å; H285-S289 WeakPolarHBondContact O-CB 3.42Å; H285-S289 PolarHBondContact O-N 3.43Å; H285-S289 PolarHBondContact O-OG 3.15Å; H285-S289 VanDerWaalsContact O-OG 3.09Å
286	Q	69.4	Low	68.5	Low	109 Å²	109	62.9 Å²	62.9	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-45.9	178.6	-71.6	164.5	28.1	0	0	111.9	S282 A284 S289 H290	S282-Q286 WeakPolarHBondContact O-CB 3.48Å; S282-Q286 WeakPolarHBondContact O-CG 3.31Å; S282-Q286 PolarHBondContact O-N 3.25Å; S282-Q286 PolarHBondContact O-NE2 2.96Å; A284-Q286 PolarHBondContact O-N 2.93Å; Q286-S289 PolarHBondContact O-OG 3.04Å; Q286-S289 VanDerWaalsContact O-OG 3.09Å; Q286-H290 PolarHBondContact O-CD2 2.83Å; Q286-H290 VanDerWaalsContact O-CD2 3.23Å; Q286-H290 PolarHBondContact O-N 3.2Å
287	T	69.8	Low	66.2	Low	7 Å²	7	65.4 Å²	65.4	4%	0.043	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-40.2	-178.7	-47.6	0	0	0	0	111.4	Q131 T134 A283 A284 H285 S291	Q131-T287 HydrophobicContact CG-CG2 4.26Å; T134-T287 HydrophobicContact CG2-CG2 3.8Å; T134-T287 WeakPolarHBondContact OG1-CG2 3.49Å; A283-T287 WeakPolarHBondContact O-CB 3.16Å; A283-T287 PolarHBondContact O-N 3.14Å; A283-T287 PolarHBondContact O-OG1 3.14Å; A284-T287 PolarHBondContact O-N 3.06Å; H285-T287 PolarHBondContact O-N 3.22Å; T287-S291 WeakPolarHBondContact O-CB 3.41Å; T287-S291 PolarHBondContact O-N 3.24Å; T287-S291 VanDerWaalsContact O-N 3.13Å
288	L	67.1	Low	64	Low	76 Å²	76	70.9 Å²	70.9	40%	0.398	39%	0.393	S	S	.	.	H	α-helix	trans	-73.6	-33.7	-178.8	-67.5	170.2	0	0	0	113.1	A284 H285 S291 L292	A284-L288 WeakPolarHBondContact O-CB 3.31Å; A284-L288 WeakPolarHBondContact O-CG 3.18Å; A284-L288 PolarHBondContact O-N 3.35Å; H285-L288 PolarHBondContact O-N 3.44Å; L288-S291 WeakPolarHBondContact O-CB 3.46Å; L288-S291 PolarHBondContact O-N 3.27Å; L288-L292 PolarHBondContact O-N 3.45Å
289	S	59.7	Low	61.6	Low	64 Å²	64	74 Å²	74	45%	0.448	41%	0.409	S	S	.	.	H	α-helix	trans	-68.8	-37.4	176.2	59.2	0	0	0	0	112.6	H285 Q286 T293	H285-S289 WeakPolarHBondContact O-CB 3.42Å; H285-S289 PolarHBondContact O-N 3.43Å; H285-S289 PolarHBondContact O-OG 3.15Å; H285-S289 VanDerWaalsContact O-OG 3.09Å; Q286-S289 PolarHBondContact O-OG 3.04Å; Q286-S289 VanDerWaalsContact O-OG 3.09Å; S289-T293 WeakPolarHBondContact O-CB 3.44Å; S289-T293 PolarHBondContact O-N 2.86Å; S289-T293 PolarHBondContact O-OG1 3.36Å
290	H	58.2	Low	59.9	Low	114 Å²	114	73.7 Å²	73.7	53%	0.528	41%	0.412	S	S	.	.	H	α-helix	trans	-68.1	-40.6	173	-80.4	-65.2	0	0	0	112	P83 Q286	P83-H290 HydrophobicContact CG-CB 4.49Å; Q286-H290 PolarHBondContact O-CD2 2.83Å; Q286-H290 VanDerWaalsContact O-CD2 3.23Å; Q286-H290 PolarHBondContact O-N 3.2Å
291	S	57	Low	59.1	Low	10 Å²	10	79.9 Å²	79.9	7%	0.07	45%	0.445	C	S	.	.	H	α-helix	trans	-55.8	-59.2	172.4	173.2	0	0	0	0	111.9	T287 L288 T293 E294 Y295	T287-S291 WeakPolarHBondContact O-CB 3.41Å; T287-S291 PolarHBondContact O-N 3.24Å; T287-S291 VanDerWaalsContact O-N 3.13Å; L288-S291 WeakPolarHBondContact O-CB 3.46Å; L288-S291 PolarHBondContact O-N 3.27Å; S291-T293 PolarHBondContact O-N 2.83Å; S291-T293 VanDerWaalsContact O-N 3.15Å; S291-E294 PolarHBondContact O-N 3.15Å; S291-Y295 WeakPolarHBondContact O-CD2 3.46Å; S291-Y295 WeakPolarHBondContact O-CE2 3.47Å; S291-Y295 PolarHBondContact O-N 3.03Å; S291-Y295 WeakPolarHBondContact OG-CE2 3.33Å; S291-Y295 PolarHBondContact OG-OH 2.97Å; S291-Y295 VanDerWaalsContact OG-OH 3.07Å
292	L	50.2	Low	59.6	Low	128 Å²	128	79.5 Å²	79.5	67%	0.67	43%	0.434	S	S	*	.	H	α-helix	trans	-62	-30.7	-172.1	-130.5	76.8	0	0	0	114.1	L288	L288-L292 PolarHBondContact O-N 3.45Å
293	T	51	Low	60.1	Low	110 Å²	110	78.4 Å²	78.4	68%	0.675	43%	0.427	S	S	*	.	H	α-helix	trans	-77.9	-28.2	-173.7	-53	0	0	0	0	112.8	S289 S291	S289-T293 WeakPolarHBondContact O-CB 3.44Å; S289-T293 PolarHBondContact O-N 2.86Å; S289-T293 PolarHBondContact O-OG1 3.36Å; S291-T293 PolarHBondContact O-N 2.83Å; S291-T293 VanDerWaalsContact O-N 3.15Å
294	E	51.5	Low	61	Low	49 Å²	49	83.4 Å²	83.4	23%	0.229	45%	0.45	C	S	.	.	H	α-helix	trans	-96.5	-30.4	-176.8	-62.8	-160.3	130.5	0	0	113.5	S291 N296 S297 R344	S291-E294 PolarHBondContact O-N 3.15Å; E294-N296 VanDerWaalsContact C-N 3.29Å; E294-N296 PolarHBondContact O-N 2.95Å; E294-S297 PolarHBondContact O-N 3.36Å; E294-S297 VanDerWaalsContact O-N 3.17Å; E294-S297 PolarHBondContact O-OG 3.23Å; E294-R344 IonicContact OE1-CZ 3.27Å; E294-R344 IonicContact OE1-NH1 2.7Å; E294-R344 PolarHBondContact OE1-NH1 3.1Å
295	Y	46.6	Very low	61.8	Low	64 Å²	64	85.6 Å²	85.6	25%	0.251	46%	0.463	S	S	.	.	H	α-helix	trans	-58.9	-38.1	-176.3	-78.9	-147.1	0	0	0	112.9	H82 Y138 S291 S297	H82-Y295 AromaticContact CD2-CE2 3.55Å; H82-Y295 AromaticContact CD2-CZ 3.77Å; H82-Y295 PolarHBondContact CD2-OH 2.88Å; H82-Y295 VanDerWaalsContact CD2-OH 3.24Å; H82-Y295 PolarHBondContact NE2-OH 2.8Å; Y138-Y295 HydrophobicContact CD2-CD1 4.34Å; Y138-Y295 AromaticContact CD2-CE1 3.55Å; Y138-Y295 HydrophobicContact CD2-CE1 3.55Å; Y138-Y295 HydrophobicContact CD2-CE2 4.11Å; Y138-Y295 AromaticContact CD2-CZ 3.43Å; Y138-Y295 VanDerWaalsContact CD2-CZ 3.43Å; Y138-Y295 WeakPolarHBondContact CD2-OH 3.48Å; Y138-Y295 HydrophobicContact CE2-CD1 4.28Å; Y138-Y295 AromaticContact CE2-CE1 3.93Å; Y138-Y295 HydrophobicContact CE2-CE1 3.93Å; Y138-Y295 HydrophobicContact CE2-CE2 4.32Å; Y138-Y295 AromaticContact CE2-CZ 3.98Å; S291-Y295 WeakPolarHBondContact O-CD2 3.46Å; S291-Y295 WeakPolarHBondContact O-CE2 3.47Å; S291-Y295 PolarHBondContact O-N 3.03Å; S291-Y295 WeakPolarHBondContact OG-CE2 3.33Å; S291-Y295 PolarHBondContact OG-OH 2.97Å; S291-Y295 VanDerWaalsContact OG-OH 3.07Å; Y295-S297 VanDerWaalsContact C-N 3.25Å; Y295-S297 PolarHBondContact O-N 3.48Å
296	N	42.6	Very low	63	Low	129 Å²	129	79 Å²	79	69%	0.69	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-78.3	-6.1	-175.4	-65.4	-22.8	0	0	0	113.5	E294 N298	E294-N296 VanDerWaalsContact C-N 3.29Å; E294-N296 PolarHBondContact O-N 2.95Å; N296-N298 PolarHBondContact O-N 3.38Å; N296-N298 VanDerWaalsContact O-N 3.14Å
297	S	49.9	Very low	64.1	Low	56 Å²	56	73.9 Å²	73.9	39%	0.392	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-79.1	12.2	-175.9	65.1	0	0	0	0	115.4	E294 Y295	E294-S297 PolarHBondContact O-N 3.36Å; E294-S297 VanDerWaalsContact O-N 3.17Å; E294-S297 PolarHBondContact O-OG 3.23Å; Y295-S297 VanDerWaalsContact C-N 3.25Å; Y295-S297 PolarHBondContact O-N 3.48Å
298	N	47.2	Very low	65.1	Low	114 Å²	114	74.9 Å²	74.9	61%	0.61	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-93.5	-3.8	176.4	-74.7	-0.2	0	0	0	113.8	N81 N296	N81-N298 PolarHBondContact ND2-OD1 3.39Å; N296-N298 PolarHBondContact O-N 3.38Å; N296-N298 VanDerWaalsContact O-N 3.14Å
299	L	43	Very low	66.3	Low	157 Å²	157	72.2 Å²	72.2	82%	0.822	41%	0.407	S	S	*	.	S	Bend	trans	-107.5	98.6	-175.4	-135.3	75	0	0	0	111.9	D301	L299-D301 VanDerWaalsContact C-N 3.28Å; L299-D301 PolarHBondContact O-N 3.34Å
300	G	54.1	Low	67.9	Low	59 Å²	59	69.1 Å²	69.1	61%	0.608	39%	0.386	S	S	*	.	S	Bend	trans	75.7	-51.5	166.6	0	0	0	0	0	117.4	Y302	G300-Y302 PolarHBondContact O-N 2.82Å
301	D	66.4	Low	69.5	Low	156 Å²	156	68.4 Å²	68.4	83%	0.834	39%	0.385	S	S	*	.			trans	-80.5	84	-165.2	-77.7	-11.8	0	0	0	113.7	L299	L299-D301 VanDerWaalsContact C-N 3.28Å; L299-D301 PolarHBondContact O-N 3.34Å
302	Y	83.3	Confident	71.2	Confident	68 Å²	68	72.1 Å²	72.1	27%	0.267	41%	0.408	S	S	.	.			trans	-64.4	144.5	165.6	-59.1	-61.2	0	0	0	111.4	G300 E304 I321 L324 Q325	G300-Y302 PolarHBondContact O-N 2.82Å; Y302-E304 PolarHBondContact O-N 3.41Å; Y302-I321 HydrophobicContact CD2-CG1 4.36Å; Y302-I321 HydrophobicContact CD2-CG2 4.26Å; Y302-I321 HydrophobicContact CE2-CG2 3.93Å; Y302-L324 HydrophobicContact CD1-CB 4.38Å; Y302-L324 HydrophobicContact CD1-CD1 3.79Å; Y302-L324 HydrophobicContact CE1-CB 3.67Å; Y302-L324 HydrophobicContact CE1-CD1 3.95Å; Y302-L324 HydrophobicContact CE1-CG 4.4Å; Y302-Q325 HydrophobicContact CE2-CG 4.27Å; Y302-Q325 WeakPolarHBondContact OH-CG 3.42Å
303	S	87.2	Confident	73.1	Confident	28 Å²	28	67.7 Å²	67.7	20%	0.196	39%	0.385	C	S	.	.			trans	-75.6	98.4	-173.3	-164.2	0	0	0	0	111.1	P305 V306 L307 Y336	S303-P305 VanDerWaalsContact C-CD 3.47Å; S303-P305 VanDerWaalsContact C-N 3.33Å; S303-V306 WeakPolarHBondContact O-CA 3.22Å; S303-V306 WeakPolarHBondContact O-CB 3.31Å; S303-V306 PolarHBondContact O-N 3.43Å; S303-L307 PolarHBondContact O-N 2.87Å; S303-Y336 PolarHBondContact N-OH 3.41Å
304	E	88.6	Confident	75	Confident	105 Å²	105	64.1 Å²	64.1	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-44.7	-46.2	177.9	-76.1	-58.8	141.7	0	0	114.5	Y302 V306 L307 G308 R317	Y302-E304 PolarHBondContact O-N 3.41Å; E304-V306 VanDerWaalsContact C-N 3.26Å; E304-V306 PolarHBondContact O-N 3.4Å; E304-L307 PolarHBondContact O-N 3.46Å; E304-G308 PolarHBondContact O-N 2.89Å; E304-R317 IonicContact OE1-CZ 3.86Å; E304-R317 IonicContact OE1-NH1 3.94Å; E304-R317 IonicContact OE1-NH2 2.67Å; E304-R317 PolarHBondContact OE1-NH2 3.33Å; E304-R317 IonicContact OE2-CZ 3.58Å; E304-R317 IonicContact OE2-NH1 3.59Å; E304-R317 PolarHBondContact OE2-NH1 3.4Å; E304-R317 IonicContact OE2-NH2 2.68Å; E304-R317 PolarHBondContact OE2-NH2 2.94Å
305	P	88.8	Confident	76.9	Confident	56 Å²	56	62.1 Å²	62.1	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-62	-30.7	175.9	-24	35.6	0	0	0	113.8	S303 I309	S303-P305 VanDerWaalsContact C-CD 3.47Å; S303-P305 VanDerWaalsContact C-N 3.33Å; P305-I309 VanDerWaalsContact O-CD1 3.3Å; P305-I309 WeakPolarHBondContact O-CD1 3.39Å; P305-I309 WeakPolarHBondContact O-CG1 3.42Å; P305-I309 PolarHBondContact O-N 3.07Å
306	V	91.8	Very high	79.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-76.8	-40.4	176.7	-176.7	0	0	0	0	110.5	S303 E304 G308 I309 M310 Y336 L339 L340 V343	S303-V306 WeakPolarHBondContact O-CA 3.22Å; S303-V306 WeakPolarHBondContact O-CB 3.31Å; S303-V306 PolarHBondContact O-N 3.43Å; E304-V306 VanDerWaalsContact C-N 3.26Å; E304-V306 PolarHBondContact O-N 3.4Å; V306-G308 VanDerWaalsContact C-N 3.32Å; V306-G308 PolarHBondContact O-N 2.62Å; V306-I309 PolarHBondContact O-N 3.24Å; V306-M310 VanDerWaalsContact O-CG 3.31Å; V306-M310 WeakPolarHBondContact O-CG 3.23Å; V306-M310 PolarHBondContact O-N 3.17Å; V306-Y336 HydrophobicContact CB-CD2 4.18Å; V306-Y336 HydrophobicContact CB-CE2 3.9Å; V306-Y336 HydrophobicContact CG1-CD2 3.49Å; V306-Y336 VanDerWaalsContact CG1-CD2 3.49Å; V306-Y336 HydrophobicContact CG1-CE2 3.72Å; V306-Y336 HydrophobicContact CG1-CG 4.24Å; V306-L339 HydrophobicContact CG1-CB 3.71Å; V306-L339 HydrophobicContact CG1-CD1 4.37Å; V306-L340 HydrophobicContact CG2-CB 4.18Å; V306-L340 HydrophobicContact CG2-CD1 3.99Å; V306-V343 HydrophobicContact CG2-CG2 4.46Å
307	L	91.8	Very high	81.5	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-36.2	174.1	-64.9	-180	0	0	0	112.2	S303 E304 M310 N311 R317 T320 I321 Y336	S303-L307 PolarHBondContact O-N 2.87Å; E304-L307 PolarHBondContact O-N 3.46Å; L307-M310 PolarHBondContact O-N 2.74Å; L307-N311 WeakPolarHBondContact O-CB 3.46Å; L307-N311 PolarHBondContact O-N 2.88Å; L307-R317 HydrophobicContact CB-CG 4.43Å; L307-T320 HydrophobicContact CD2-CG2 3.84Å; L307-I321 HydrophobicContact CD1-CD1 4.2Å; L307-I321 HydrophobicContact CD1-CG1 4.23Å; L307-I321 HydrophobicContact CD2-CG1 4.41Å; L307-Y336 HydrophobicContact CD2-CD2 3.99Å; L307-Y336 HydrophobicContact CD2-CE2 3.94Å; L307-Y336 HydrophobicContact CG-CE2 4.29Å
308	G	91	Very high	83.5	Confident	29 Å²	29	62.1 Å²	62.1	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-42.9	170.2	0	0	0	0	0	112.7	E304 V306 N311 T312	E304-G308 PolarHBondContact O-N 2.89Å; V306-G308 VanDerWaalsContact C-N 3.32Å; V306-G308 PolarHBondContact O-N 2.62Å; G308-N311 PolarHBondContact O-N 3.45Å; G308-T312 WeakPolarHBondContact O-CB 3.44Å; G308-T312 PolarHBondContact O-N 2.89Å; G308-T312 PolarHBondContact O-OG1 2.83Å
309	I	91.8	Very high	85.6	Confident	19 Å²	19	63.5 Å²	63.5	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-66	-42.3	175.1	-64.6	159.3	0	0	0	111.1	P305 V306 N311 T312 L313 L339 V343 L419	P305-I309 VanDerWaalsContact O-CD1 3.3Å; P305-I309 WeakPolarHBondContact O-CD1 3.39Å; P305-I309 WeakPolarHBondContact O-CG1 3.42Å; P305-I309 PolarHBondContact O-N 3.07Å; V306-I309 PolarHBondContact O-N 3.24Å; I309-N311 PolarHBondContact O-N 2.7Å; I309-T312 PolarHBondContact O-N 2.8Å; I309-L313 HydrophobicContact CG2-CD1 3.84Å; I309-L313 HydrophobicContact CG2-CG 4.36Å; I309-L313 VanDerWaalsContact O-CG 3.28Å; I309-L313 WeakPolarHBondContact O-CG 3.46Å; I309-L313 PolarHBondContact O-N 3.16Å; I309-L339 HydrophobicContact CB-CD1 4.38Å; I309-L339 HydrophobicContact CG2-CD1 3.77Å; I309-L339 HydrophobicContact CG2-CD2 4.05Å; I309-V343 HydrophobicContact CD1-CG2 4.15Å; I309-L419 HydrophobicContact CD1-CD1 3.77Å
310	M	93.6	Very high	88	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-55.7	-51.1	175	-69.6	-72.8	-78.8	0	0	110.9	V306 L307 T312 L313 G314 I315 T320 F332 I335 L339	V306-M310 VanDerWaalsContact O-CG 3.31Å; V306-M310 WeakPolarHBondContact O-CG 3.23Å; V306-M310 PolarHBondContact O-N 3.17Å; L307-M310 PolarHBondContact O-N 2.74Å; M310-T312 VanDerWaalsContact C-N 3.33Å; M310-T312 PolarHBondContact O-N 3.42Å; M310-L313 WeakPolarHBondContact O-CB 3.47Å; M310-L313 PolarHBondContact O-N 2.84Å; M310-L313 VanDerWaalsContact O-N 3.08Å; M310-G314 PolarHBondContact O-N 3.08Å; M310-I315 CarbonylContact C-O 3.34Å; M310-I315 HydrophobicContact CB-CB 4.41Å; M310-I315 HydrophobicContact CE-CB 4.18Å; M310-I315 HydrophobicContact CE-CD1 4.11Å; M310-I315 HydrophobicContact CE-CG2 3.58Å; M310-I315 WeakPolarHBondContact O-CB 3.48Å; M310-I315 PolarHBondContact O-N 3.5Å; M310-I315 HydrophobicContact SD-CD1 3.86Å; M310-T320 HydrophobicContact CE-CG2 3.65Å; M310-T320 VanDerWaalsContact CE-OG1 3.27Å; M310-T320 WeakPolarHBondContact CE-OG1 3.25Å; M310-T320 HydrophobicContact CG-CG2 4.45Å; M310-F332 WeakPolarHBondContact CE-O 3.37Å; M310-I335 HydrophobicContact CE-CB 4.13Å; M310-I335 HydrophobicContact CE-CG2 4.31Å; M310-I335 HydrophobicContact SD-CB 4Å; M310-I335 HydrophobicContact SD-CG2 3.58Å; M310-I335 VanDerWaalsContact SD-CG2 3.58Å; M310-L339 HydrophobicContact CG-CD1 4.1Å; M310-L339 HydrophobicContact SD-CD1 3.67Å
311	N	92.5	Very high	89.8	Confident	98 Å²	98	54.3 Å²	54.3	52%	0.524	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-39.5	177.3	-167.6	82.9	0	0	0	112.4	L307 G308 I309 L313 G314 I315	L307-N311 WeakPolarHBondContact O-CB 3.46Å; L307-N311 PolarHBondContact O-N 2.88Å; G308-N311 PolarHBondContact O-N 3.45Å; I309-N311 PolarHBondContact O-N 2.7Å; N311-L313 VanDerWaalsContact C-N 3.25Å; N311-L313 PolarHBondContact O-N 3.33Å; N311-G314 PolarHBondContact O-N 3.44Å; N311-I315 WeakPolarHBondContact CA-O 3.15Å; N311-I315 PolarHBondContact N-O 2.86Å
312	T	92.7	Very high	91	Very high	89 Å²	89	51 Å²	51	55%	0.546	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-27.7	175.6	-55.2	0	0	0	0	112.7	G308 I309 M310 G314	G308-T312 WeakPolarHBondContact O-CB 3.44Å; G308-T312 PolarHBondContact O-N 2.89Å; G308-T312 PolarHBondContact O-OG1 2.83Å; I309-T312 PolarHBondContact O-N 2.8Å; M310-T312 VanDerWaalsContact C-N 3.33Å; M310-T312 PolarHBondContact O-N 3.42Å; T312-G314 PolarHBondContact O-N 2.91Å
313	L	90.2	Very high	91.5	Very high	34 Å²	34	48 Å²	48	18%	0.178	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	5.3	173.8	-66.7	165	0	0	0	113.2	V47 I309 M310 N311 I315 L339 L423	V47-L313 HydrophobicContact CG1-CD1 3.85Å; V47-L313 HydrophobicContact CG1-CD2 3.97Å; V47-L313 HydrophobicContact CG1-CG 4.42Å; I309-L313 HydrophobicContact CG2-CD1 3.84Å; I309-L313 HydrophobicContact CG2-CG 4.36Å; I309-L313 VanDerWaalsContact O-CG 3.28Å; I309-L313 WeakPolarHBondContact O-CG 3.46Å; I309-L313 PolarHBondContact O-N 3.16Å; M310-L313 WeakPolarHBondContact O-CB 3.47Å; M310-L313 PolarHBondContact O-N 2.84Å; M310-L313 VanDerWaalsContact O-N 3.08Å; N311-L313 VanDerWaalsContact C-N 3.25Å; N311-L313 PolarHBondContact O-N 3.33Å; L313-I315 VanDerWaalsContact C-N 3.27Å; L313-I315 HydrophobicContact CB-CD1 3.93Å; L313-I315 HydrophobicContact CB-CG1 4.1Å; L313-I315 HydrophobicContact CD1-CD1 4.33Å; L313-I315 PolarHBondContact O-N 3.26Å; L313-L339 HydrophobicContact CD1-CD1 3.98Å; L313-L423 HydrophobicContact CD2-CD1 4.4Å; L313-L423 HydrophobicContact CD2-CD2 4.27Å
314	G	89.9	Confident	91.6	Very high	36 Å²	36	47 Å²	47	37%	0.371	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	12.9	-175.5	0	0	0	0	0	114.1	M310 N311 T312	M310-G314 PolarHBondContact O-N 3.08Å; N311-G314 PolarHBondContact O-N 3.44Å; T312-G314 PolarHBondContact O-N 2.91Å
315	I	91.9	Very high	91.7	Very high	7 Å²	7	48 Å²	48	4%	0.036	25%	0.251	C	S	.	.			trans	-94.6	119.8	-179.5	-51	164.8	0	0	0	108.3	M310 N311 L313 R317 F332 I335	M310-I315 CarbonylContact C-O 3.34Å; M310-I315 HydrophobicContact CB-CB 4.41Å; M310-I315 HydrophobicContact CE-CB 4.18Å; M310-I315 HydrophobicContact CE-CD1 4.11Å; M310-I315 HydrophobicContact CE-CG2 3.58Å; M310-I315 WeakPolarHBondContact O-CB 3.48Å; M310-I315 PolarHBondContact O-N 3.5Å; M310-I315 HydrophobicContact SD-CD1 3.86Å; N311-I315 WeakPolarHBondContact CA-O 3.15Å; N311-I315 PolarHBondContact N-O 2.86Å; L313-I315 VanDerWaalsContact C-N 3.27Å; L313-I315 HydrophobicContact CB-CD1 3.93Å; L313-I315 HydrophobicContact CB-CG1 4.1Å; L313-I315 HydrophobicContact CD1-CD1 4.33Å; L313-I315 PolarHBondContact O-N 3.26Å; I315-R317 PolarHBondContact O-N 2.94Å; I315-F332 HydrophobicContact CG2-CD1 3.5Å; I315-F332 HydrophobicContact CG2-CE1 3.79Å; I315-I335 HydrophobicContact CD1-CB 4.44Å; I315-I335 HydrophobicContact CD1-CD1 3.86Å; I315-I335 HydrophobicContact CD1-CG2 3.78Å
316	D	93	Very high	91.7	Very high	67 Å²	67	49 Å²	49	36%	0.358	26%	0.259	S	S	.	.			trans	-58.3	130.1	-175.5	175	52.1	0	0	0	112.8	Q318 R319 T320	D316-Q318 PolarHBondContact OD1-N 3.1Å; D316-Q318 PolarHBondContact OD2-N 3.01Å; D316-R319 HydrophobicContact CB-CB 4.35Å; D316-R319 HydrophobicContact CB-CG 4.48Å; D316-R319 WeakPolarHBondContact OD2-CB 3.3Å; D316-R319 VanDerWaalsContact OD2-CG 3.25Å; D316-R319 WeakPolarHBondContact OD2-CG 3.44Å; D316-R319 PolarHBondContact OD2-N 3.02Å; D316-T320 WeakPolarHBondContact O-CB 3.14Å; D316-T320 PolarHBondContact O-N 3.29Å; D316-T320 PolarHBondContact O-OG1 2.87Å
317	R	92.3	Very high	91.5	Very high	83 Å²	83	52 Å²	52	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-68.4	-39	-178.1	176.1	179.3	166.6	115.7	6.7	111.7	E304 L307 I315 T320 I321	E304-R317 IonicContact OE1-CZ 3.86Å; E304-R317 IonicContact OE1-NH1 3.94Å; E304-R317 IonicContact OE1-NH2 2.67Å; E304-R317 PolarHBondContact OE1-NH2 3.33Å; E304-R317 IonicContact OE2-CZ 3.58Å; E304-R317 IonicContact OE2-NH1 3.59Å; E304-R317 PolarHBondContact OE2-NH1 3.4Å; E304-R317 IonicContact OE2-NH2 2.68Å; E304-R317 PolarHBondContact OE2-NH2 2.94Å; L307-R317 HydrophobicContact CB-CG 4.43Å; I315-R317 PolarHBondContact O-N 2.94Å; R317-T320 WeakPolarHBondContact O-CB 3.45Å; R317-T320 PolarHBondContact O-N 3.42Å; R317-I321 HydrophobicContact CG-CD1 4.08Å; R317-I321 WeakPolarHBondContact O-CG1 3.39Å; R317-I321 PolarHBondContact O-N 3.46Å
318	Q	91.6	Very high	91.4	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-71	-49.3	-174.4	179.6	55.2	29.5	0	0	111.1	D316 T320 I321 E322	D316-Q318 PolarHBondContact OD1-N 3.1Å; D316-Q318 PolarHBondContact OD2-N 3.01Å; Q318-T320 PolarHBondContact O-N 2.92Å; Q318-I321 PolarHBondContact O-N 2.74Å; Q318-E322 WeakPolarHBondContact CG-OE1 3.48Å; Q318-E322 PolarHBondContact NE2-OE1 3.18Å; Q318-E322 WeakPolarHBondContact O-CG 3.37Å; Q318-E322 PolarHBondContact O-N 3.48Å
319	R	92.8	Very high	91.6	Very high	142 Å²	142	53.3 Å²	53.3	54%	0.536	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-32.6	170.5	-71.7	174.3	-176.6	-170	1	113.1	D316 S323 F332	D316-R319 HydrophobicContact CB-CB 4.35Å; D316-R319 HydrophobicContact CB-CG 4.48Å; D316-R319 WeakPolarHBondContact OD2-CB 3.3Å; D316-R319 VanDerWaalsContact OD2-CG 3.25Å; D316-R319 WeakPolarHBondContact OD2-CG 3.44Å; D316-R319 PolarHBondContact OD2-N 3.02Å; R319-S323 WeakPolarHBondContact O-CB 3.44Å; R319-S323 PolarHBondContact O-N 3.16Å; R319-F332 HydrophobicContact CB-CD1 4.31Å; R319-F332 HydrophobicContact CB-CE1 4.08Å; R319-F332 HydrophobicContact CB-CE2 4.44Å; R319-F332 HydrophobicContact CB-CZ 4.16Å
320	T	92.8	Very high	91.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-46.1	173.8	-61.2	0	0	0	0	111.3	L307 M310 D316 R317 Q318 S323 L324 Y336	L307-T320 HydrophobicContact CD2-CG2 3.84Å; M310-T320 HydrophobicContact CE-CG2 3.65Å; M310-T320 VanDerWaalsContact CE-OG1 3.27Å; M310-T320 WeakPolarHBondContact CE-OG1 3.25Å; M310-T320 HydrophobicContact CG-CG2 4.45Å; D316-T320 WeakPolarHBondContact O-CB 3.14Å; D316-T320 PolarHBondContact O-N 3.29Å; D316-T320 PolarHBondContact O-OG1 2.87Å; R317-T320 WeakPolarHBondContact O-CB 3.45Å; R317-T320 PolarHBondContact O-N 3.42Å; Q318-T320 PolarHBondContact O-N 2.92Å; T320-S323 PolarHBondContact O-N 2.95Å; T320-L324 HydrophobicContact CG2-CD1 4.08Å; T320-L324 WeakPolarHBondContact O-CD1 3.24Å; T320-L324 VanDerWaalsContact O-CG 3.24Å; T320-L324 WeakPolarHBondContact O-CG 3.44Å; T320-L324 PolarHBondContact O-N 3.27Å; T320-L324 VanDerWaalsContact O-N 3.12Å; T320-Y336 HydrophobicContact CG2-CD2 4.25Å; T320-Y336 HydrophobicContact CG2-CG 4.43Å
321	I	91.3	Very high	91.8	Very high	23 Å²	23	57.3 Å²	57.3	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-48.1	176.9	-68.1	166.3	0	0	0	110.4	Y302 L307 R317 Q318 S323 L324 Q325	Y302-I321 HydrophobicContact CD2-CG1 4.36Å; Y302-I321 HydrophobicContact CD2-CG2 4.26Å; Y302-I321 HydrophobicContact CE2-CG2 3.93Å; L307-I321 HydrophobicContact CD1-CD1 4.2Å; L307-I321 HydrophobicContact CD1-CG1 4.23Å; L307-I321 HydrophobicContact CD2-CG1 4.41Å; R317-I321 HydrophobicContact CG-CD1 4.08Å; R317-I321 WeakPolarHBondContact O-CG1 3.39Å; R317-I321 PolarHBondContact O-N 3.46Å; Q318-I321 PolarHBondContact O-N 2.74Å; I321-S323 VanDerWaalsContact C-N 3.32Å; I321-S323 PolarHBondContact O-N 3.03Å; I321-L324 PolarHBondContact O-N 2.85Å; I321-L324 VanDerWaalsContact O-N 3.11Å; I321-Q325 HydrophobicContact CG2-CG 4.26Å; I321-Q325 WeakPolarHBondContact O-CG 3.36Å; I321-Q325 PolarHBondContact O-N 3.5Å
322	E	92.1	Very high	91.9	Very high	88 Å²	88	53.7 Å²	53.7	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-58.3	-41.6	176.4	-70	163.8	-176.5	0	0	112.3	Q318 L324 S326	Q318-E322 WeakPolarHBondContact CG-OE1 3.48Å; Q318-E322 PolarHBondContact NE2-OE1 3.18Å; Q318-E322 WeakPolarHBondContact O-CG 3.37Å; Q318-E322 PolarHBondContact O-N 3.48Å; E322-L324 VanDerWaalsContact C-N 3.31Å; E322-L324 PolarHBondContact O-N 3.01Å; E322-S326 VanDerWaalsContact O-CB 3.27Å; E322-S326 WeakPolarHBondContact O-CB 3.42Å; E322-S326 PolarHBondContact O-N 3.29Å; E322-S326 PolarHBondContact O-OG 2.87Å
323	S	93.3	Very high	91.9	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.028	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-36.5	176.1	174.1	0	0	0	0	112.9	R319 T320 I321 S326 S328 N330 S333	R319-S323 WeakPolarHBondContact O-CB 3.44Å; R319-S323 PolarHBondContact O-N 3.16Å; T320-S323 PolarHBondContact O-N 2.95Å; I321-S323 VanDerWaalsContact C-N 3.32Å; I321-S323 PolarHBondContact O-N 3.03Å; S323-S326 WeakPolarHBondContact CA-OG 3.25Å; S323-S326 PolarHBondContact O-OG 2.88Å; S323-S328 WeakPolarHBondContact CA-OG 3.45Å; S323-S328 PolarHBondContact O-N 3.02Å; S323-S328 PolarHBondContact O-OG 3.12Å; S323-S328 PolarHBondContact OG-OG 3.35Å; S323-N330 PolarHBondContact OG-ND2 3.42Å; S323-N330 PolarHBondContact OG-OD1 2.76Å; S323-S333 VanDerWaalsContact OG-CB 3.26Å; S323-S333 WeakPolarHBondContact OG-CB 3.36Å; S323-S333 PolarHBondContact OG-N 2.65Å; S323-S333 PolarHBondContact OG-OG 2.97Å; S323-S333 VanDerWaalsContact OG-OG 3.11Å
324	L	90.3	Very high	92.2	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-77	-46.1	178.5	-66.4	165.2	0	0	0	111.3	Y302 T320 I321 E322 S326 S327 Y336 Y337	Y302-L324 HydrophobicContact CD1-CB 4.38Å; Y302-L324 HydrophobicContact CD1-CD1 3.79Å; Y302-L324 HydrophobicContact CE1-CB 3.67Å; Y302-L324 HydrophobicContact CE1-CD1 3.95Å; Y302-L324 HydrophobicContact CE1-CG 4.4Å; T320-L324 HydrophobicContact CG2-CD1 4.08Å; T320-L324 WeakPolarHBondContact O-CD1 3.24Å; T320-L324 VanDerWaalsContact O-CG 3.24Å; T320-L324 WeakPolarHBondContact O-CG 3.44Å; T320-L324 PolarHBondContact O-N 3.27Å; T320-L324 VanDerWaalsContact O-N 3.12Å; I321-L324 PolarHBondContact O-N 2.85Å; I321-L324 VanDerWaalsContact O-N 3.11Å; E322-L324 VanDerWaalsContact C-N 3.31Å; E322-L324 PolarHBondContact O-N 3.01Å; L324-S326 VanDerWaalsContact C-N 3.33Å; L324-S326 PolarHBondContact O-N 2.94Å; L324-S327 PolarHBondContact O-N 3.27Å; L324-S327 VanDerWaalsContact O-N 3.1Å; L324-Y336 HydrophobicContact CD1-CD1 3.62Å; L324-Y336 HydrophobicContact CD1-CD2 3.98Å; L324-Y336 HydrophobicContact CD1-CE1 3.75Å; L324-Y336 HydrophobicContact CD1-CE2 4.11Å; L324-Y336 HydrophobicContact CD1-CG 3.74Å; L324-Y336 HydrophobicContact CD2-CD1 3.56Å; L324-Y336 HydrophobicContact CD2-CE1 4.03Å; L324-Y336 HydrophobicContact CD2-CG 4.21Å; L324-Y336 HydrophobicContact CG-CD1 4.23Å; L324-Y337 HydrophobicContact CD2-CE1 4.05Å; L324-Y337 HydrophobicContact CD2-CE2 3.89Å
325	Q	89.4	Confident	92.5	Very high	125 Å²	125	46.3 Å²	46.3	58%	0.584	23%	0.23	S	C	*	.	H	α-helix	trans	-57.2	-45	175.5	-72.5	176.3	-21.3	0	0	111.8	Y302 I321 S327	Y302-Q325 HydrophobicContact CE2-CG 4.27Å; Y302-Q325 WeakPolarHBondContact OH-CG 3.42Å; I321-Q325 HydrophobicContact CG2-CG 4.26Å; I321-Q325 WeakPolarHBondContact O-CG 3.36Å; I321-Q325 PolarHBondContact O-N 3.5Å; Q325-S327 PolarHBondContact O-N 2.93Å
326	S	89	Confident	92.6	Very high	77 Å²	77	46.4 Å²	46.4	54%	0.538	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-4	178.1	57.6	0	0	0	0	114.9	E322 S323 L324 S328	E322-S326 VanDerWaalsContact O-CB 3.27Å; E322-S326 WeakPolarHBondContact O-CB 3.42Å; E322-S326 PolarHBondContact O-N 3.29Å; E322-S326 PolarHBondContact O-OG 2.87Å; S323-S326 WeakPolarHBondContact CA-OG 3.25Å; S323-S326 PolarHBondContact O-OG 2.88Å; L324-S326 VanDerWaalsContact C-N 3.33Å; L324-S326 PolarHBondContact O-N 2.94Å; S326-S328 PolarHBondContact O-N 3.38Å; S326-S328 VanDerWaalsContact O-N 3.14Å
327	S	88.1	Confident	92.6	Very high	64 Å²	64	45.4 Å²	45.4	45%	0.448	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	42.3	-173.2	-66	0	0	0	0	112.6	K78 L324 Q325 Y329	K78-S327 PolarHBondContact NZ-O 3.43Å; K78-S327 VanDerWaalsContact NZ-O 3.11Å; L324-S327 PolarHBondContact O-N 3.27Å; L324-S327 VanDerWaalsContact O-N 3.1Å; Q325-S327 PolarHBondContact O-N 2.93Å; S327-Y329 VanDerWaalsContact O-CD2 3.23Å; S327-Y329 WeakPolarHBondContact O-CD2 3.39Å
328	S	89.6	Confident	92.8	Very high	34 Å²	34	41.4 Å²	41.4	24%	0.238	21%	0.207	C	C	.	.			trans	-70	-36.5	-170.8	53.3	0	0	0	0	113.1	K78 S323 S326 N330	K78-S328 PolarHBondContact NZ-O 2.82Å; S323-S328 WeakPolarHBondContact CA-OG 3.45Å; S323-S328 PolarHBondContact O-N 3.02Å; S323-S328 PolarHBondContact O-OG 3.12Å; S323-S328 PolarHBondContact OG-OG 3.35Å; S326-S328 PolarHBondContact O-N 3.38Å; S326-S328 VanDerWaalsContact O-N 3.14Å; S328-N330 VanDerWaalsContact C-N 3.29Å; S328-N330 PolarHBondContact OG-ND2 3.04Å; S328-N330 VanDerWaalsContact OG-ND2 3.16Å
329	Y	94.6	Very high	92.9	Very high	22 Å²	22	37.4 Å²	37.4	9%	0.086	19%	0.188	C	C	.	.			trans	56.3	41.8	-171	-65.4	-93.8	0	0	0	112.4	K78 L88 Q90 V91 S327 S333 Y337	K78-Y329 HydrophobicContact CB-CD2 4.29Å; K78-Y329 HydrophobicContact CB-CE2 3.72Å; K78-Y329 HydrophobicContact CD-CD2 3.61Å; K78-Y329 HydrophobicContact CD-CE2 3.88Å; K78-Y329 VanDerWaalsContact CE-CD2 3.45Å; K78-Y329 HydrophobicContact CG-CD2 3.56Å; K78-Y329 HydrophobicContact CG-CE2 3.5Å; K78-Y329 HydrophobicContact CG-CG 4.34Å; K78-Y329 PolarHBondContact O-OH 3.26Å; L88-Y329 HydrophobicContact CB-CD1 4.31Å; L88-Y329 HydrophobicContact CB-CE1 4.03Å; L88-Y329 HydrophobicContact CD2-CD1 3.73Å; L88-Y329 HydrophobicContact CD2-CD2 4.42Å; L88-Y329 HydrophobicContact CD2-CE1 3.88Å; L88-Y329 HydrophobicContact CD2-CG 4.01Å; L88-Y329 HydrophobicContact CG-CD1 3.72Å; L88-Y329 HydrophobicContact CG-CE1 3.93Å; L88-Y329 HydrophobicContact CG-CG 4.4Å; L88-Y329 WeakPolarHBondContact O-CE1 3.44Å; Q90-Y329 WeakPolarHBondContact CA-O 3.37Å; Q90-Y329 VanDerWaalsContact CG-O 3.25Å; Q90-Y329 WeakPolarHBondContact CG-O 3.38Å; V91-Y329 PolarHBondContact N-O 2.85Å; S327-Y329 VanDerWaalsContact O-CD2 3.23Å; S327-Y329 WeakPolarHBondContact O-CD2 3.39Å; Y329-S333 VanDerWaalsContact CA-OG 3.3Å; Y329-S333 WeakPolarHBondContact CA-OG 3.23Å; Y329-S333 PolarHBondContact N-OG 3.24Å; Y329-Y337 HydrophobicContact CE1-CE2 4.44Å
330	N	95.1	Very high	92.8	Very high	51 Å²	51	31.7 Å²	31.7	27%	0.273	17%	0.168	S	C	.	.	S	Bend	trans	-91.7	-173.6	170.5	75.4	35.1	0	0	0	111	S323 S328 F332 S333 A334	S323-N330 PolarHBondContact OG-ND2 3.42Å; S323-N330 PolarHBondContact OG-OD1 2.76Å; S328-N330 VanDerWaalsContact C-N 3.29Å; S328-N330 PolarHBondContact OG-ND2 3.04Å; S328-N330 VanDerWaalsContact OG-ND2 3.16Å; N330-F332 PolarHBondContact O-N 2.92Å; N330-F332 WeakPolarHBondContact OD1-CB 3.37Å; N330-F332 WeakPolarHBondContact OD1-CD2 3.29Å; N330-F332 PolarHBondContact OD1-N 2.87Å; N330-S333 PolarHBondContact N-OG 2.8Å; N330-S333 PolarHBondContact O-N 2.67Å; N330-S333 PolarHBondContact O-OG 2.95Å; N330-A334 WeakPolarHBondContact O-CB 3.34Å; N330-A334 PolarHBondContact O-N 3.24Å
331	H	94.8	Very high	92.5	Very high	52 Å²	52	34.4 Å²	34.4	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-36	-177.5	65.1	-100.5	0	0	0	114.4	F25 A334 I335	F25-H331 HydrophobicContact CD2-CB 3.8Å; F25-H331 HydrophobicContact CE2-CB 3.78Å; F25-H331 AromaticContact CE2-CG 3.82Å; H331-A334 PolarHBondContact O-N 2.88Å; H331-I335 VanDerWaalsContact O-CD1 3.28Å; H331-I335 WeakPolarHBondContact O-CD1 3.49Å; H331-I335 WeakPolarHBondContact O-CG1 3.37Å; H331-I335 PolarHBondContact O-N 3.22Å
332	F	94.9	Very high	92.4	Very high	22 Å²	22	38.2 Å²	38.2	10%	0.096	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-53.5	177.1	-63	-81.3	0	0	0	111.2	M310 I315 R319 N330 A334 I335 Y336	M310-F332 WeakPolarHBondContact CE-O 3.37Å; I315-F332 HydrophobicContact CG2-CD1 3.5Å; I315-F332 HydrophobicContact CG2-CE1 3.79Å; R319-F332 HydrophobicContact CB-CD1 4.31Å; R319-F332 HydrophobicContact CB-CE1 4.08Å; R319-F332 HydrophobicContact CB-CE2 4.44Å; R319-F332 HydrophobicContact CB-CZ 4.16Å; N330-F332 PolarHBondContact O-N 2.92Å; N330-F332 WeakPolarHBondContact OD1-CB 3.37Å; N330-F332 WeakPolarHBondContact OD1-CD2 3.29Å; N330-F332 PolarHBondContact OD1-N 2.87Å; F332-A334 VanDerWaalsContact C-N 3.33Å; F332-A334 PolarHBondContact O-N 3.39Å; F332-I335 PolarHBondContact O-N 3.37Å; F332-Y336 PolarHBondContact O-N 3.07Å
333	S	93.9	Very high	92.1	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-38.3	175.5	43.9	0	0	0	0	112.9	S323 Y329 N330 Y336 Y337	S323-S333 VanDerWaalsContact OG-CB 3.26Å; S323-S333 WeakPolarHBondContact OG-CB 3.36Å; S323-S333 PolarHBondContact OG-N 2.65Å; S323-S333 PolarHBondContact OG-OG 2.97Å; S323-S333 VanDerWaalsContact OG-OG 3.11Å; Y329-S333 VanDerWaalsContact CA-OG 3.3Å; Y329-S333 WeakPolarHBondContact CA-OG 3.23Å; Y329-S333 PolarHBondContact N-OG 3.24Å; N330-S333 PolarHBondContact N-OG 2.8Å; N330-S333 PolarHBondContact O-N 2.67Å; N330-S333 PolarHBondContact O-OG 2.95Å; S333-Y336 PolarHBondContact O-N 3.14Å; S333-Y337 WeakPolarHBondContact O-CD2 3.31Å; S333-Y337 PolarHBondContact O-N 3.02Å
334	A	95.8	Very high	91.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-47.4	178.1	0	0	0	0	0	112.1	Y89 Q90 N330 H331 F332 Y336 Y337 L338	Y89-A334 WeakPolarHBondContact O-CA 3.43Å; Y89-A334 WeakPolarHBondContact O-CB 3.03Å; Q90-A334 HydrophobicContact CB-CB 3.76Å; Q90-A334 HydrophobicContact CG-CB 3.96Å; N330-A334 WeakPolarHBondContact O-CB 3.34Å; N330-A334 PolarHBondContact O-N 3.24Å; H331-A334 PolarHBondContact O-N 2.88Å; F332-A334 VanDerWaalsContact C-N 3.33Å; F332-A334 PolarHBondContact O-N 3.39Å; A334-Y336 VanDerWaalsContact C-N 3.34Å; A334-Y336 PolarHBondContact O-N 3.28Å; A334-Y337 PolarHBondContact O-N 3.43Å; A334-L338 WeakPolarHBondContact O-CB 3.3Å; A334-L338 WeakPolarHBondContact O-CD1 3.48Å; A334-L338 WeakPolarHBondContact O-CG 3.44Å; A334-L338 PolarHBondContact O-N 2.99Å
335	I	95.6	Very high	91.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-43	178.3	-57.1	156.5	0	0	0	110	T48 M310 I315 H331 F332 L338 L339	T48-I335 HydrophobicContact CG2-CG2 4.14Å; M310-I335 HydrophobicContact CE-CB 4.13Å; M310-I335 HydrophobicContact CE-CG2 4.31Å; M310-I335 HydrophobicContact SD-CB 4Å; M310-I335 HydrophobicContact SD-CG2 3.58Å; M310-I335 VanDerWaalsContact SD-CG2 3.58Å; I315-I335 HydrophobicContact CD1-CB 4.44Å; I315-I335 HydrophobicContact CD1-CD1 3.86Å; I315-I335 HydrophobicContact CD1-CG2 3.78Å; H331-I335 VanDerWaalsContact O-CD1 3.28Å; H331-I335 WeakPolarHBondContact O-CD1 3.49Å; H331-I335 WeakPolarHBondContact O-CG1 3.37Å; H331-I335 PolarHBondContact O-N 3.22Å; F332-I335 PolarHBondContact O-N 3.37Å; I335-L338 PolarHBondContact O-N 2.86Å; I335-L339 HydrophobicContact CG2-CD1 4.06Å; I335-L339 HydrophobicContact CG2-CG 4.37Å; I335-L339 WeakPolarHBondContact O-CB 3.29Å; I335-L339 WeakPolarHBondContact O-CG 3.3Å; I335-L339 PolarHBondContact O-N 3.05Å
336	Y	94.8	Very high	91.1	Very high	10 Å²	10	38.7 Å²	38.7	4%	0.039	19%	0.192	C	C	.	.	H	α-helix	trans	-57.8	-50.2	175.4	173.1	-92.1	0	0	0	112.3	S303 V306 L307 T320 L324 F332 S333 A334 L338 L339 L340	S303-Y336 PolarHBondContact N-OH 3.41Å; V306-Y336 HydrophobicContact CB-CD2 4.18Å; V306-Y336 HydrophobicContact CB-CE2 3.9Å; V306-Y336 HydrophobicContact CG1-CD2 3.49Å; V306-Y336 VanDerWaalsContact CG1-CD2 3.49Å; V306-Y336 HydrophobicContact CG1-CE2 3.72Å; V306-Y336 HydrophobicContact CG1-CG 4.24Å; L307-Y336 HydrophobicContact CD2-CD2 3.99Å; L307-Y336 HydrophobicContact CD2-CE2 3.94Å; L307-Y336 HydrophobicContact CG-CE2 4.29Å; T320-Y336 HydrophobicContact CG2-CD2 4.25Å; T320-Y336 HydrophobicContact CG2-CG 4.43Å; L324-Y336 HydrophobicContact CD1-CD1 3.62Å; L324-Y336 HydrophobicContact CD1-CD2 3.98Å; L324-Y336 HydrophobicContact CD1-CE1 3.75Å; L324-Y336 HydrophobicContact CD1-CE2 4.11Å; L324-Y336 HydrophobicContact CD1-CG 3.74Å; L324-Y336 HydrophobicContact CD2-CD1 3.56Å; L324-Y336 HydrophobicContact CD2-CE1 4.03Å; L324-Y336 HydrophobicContact CD2-CG 4.21Å; L324-Y336 HydrophobicContact CG-CD1 4.23Å; F332-Y336 PolarHBondContact O-N 3.07Å; S333-Y336 PolarHBondContact O-N 3.14Å; A334-Y336 VanDerWaalsContact C-N 3.34Å; A334-Y336 PolarHBondContact O-N 3.28Å; Y336-L338 PolarHBondContact O-N 3.22Å; Y336-L339 PolarHBondContact O-N 3.08Å; Y336-L340 HydrophobicContact CE1-CD2 3.99Å; Y336-L340 VanDerWaalsContact O-CB 3.32Å; Y336-L340 WeakPolarHBondContact O-CB 3.29Å; Y336-L340 PolarHBondContact O-N 3.21Å
337	Y	93.6	Very high	90.7	Very high	45 Å²	45	40.9 Å²	40.9	18%	0.176	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-41.4	-179.7	-70.6	-49.9	0	0	0	112.4	L324 Y329 S333 A334 L339 L340 E341	L324-Y337 HydrophobicContact CD2-CE1 4.05Å; L324-Y337 HydrophobicContact CD2-CE2 3.89Å; Y329-Y337 HydrophobicContact CE1-CE2 4.44Å; S333-Y337 WeakPolarHBondContact O-CD2 3.31Å; S333-Y337 PolarHBondContact O-N 3.02Å; A334-Y337 PolarHBondContact O-N 3.43Å; Y337-L339 VanDerWaalsContact C-N 3.31Å; Y337-L339 PolarHBondContact O-N 3.49Å; Y337-L340 HydrophobicContact CD1-CD2 4.46Å; Y337-L340 PolarHBondContact O-N 2.84Å; Y337-E341 WeakPolarHBondContact O-CB 3.44Å; Y337-E341 PolarHBondContact O-N 3.22Å
338	L	94.8	Very high	90.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-30	177.1	-68.8	169.8	0	0	0	113	Y26 H45 T48 T50 V52 Y89 A334 I335 Y336 R342	Y26-L338 HydrophobicContact CE1-CD1 4.48Å; H45-L338 HydrophobicContact CB-CD1 3.98Å; T48-L338 HydrophobicContact CG2-CB 3.93Å; T50-L338 HydrophobicContact CG2-CD2 3.86Å; V52-L338 HydrophobicContact CG1-CD1 4.47Å; V52-L338 HydrophobicContact CG1-CD2 3.81Å; Y89-L338 HydrophobicContact CD1-CD2 3.95Å; Y89-L338 HydrophobicContact CD1-CG 4.19Å; Y89-L338 HydrophobicContact CD2-CD2 3.77Å; Y89-L338 HydrophobicContact CD2-CG 4.47Å; Y89-L338 HydrophobicContact CE1-CD2 3.8Å; Y89-L338 HydrophobicContact CE1-CG 4.43Å; Y89-L338 HydrophobicContact CE2-CD2 3.59Å; Y89-L338 HydrophobicContact CG-CD2 3.93Å; Y89-L338 HydrophobicContact CG-CG 4.21Å; A334-L338 WeakPolarHBondContact O-CB 3.3Å; A334-L338 WeakPolarHBondContact O-CD1 3.48Å; A334-L338 WeakPolarHBondContact O-CG 3.44Å; A334-L338 PolarHBondContact O-N 2.99Å; I335-L338 PolarHBondContact O-N 2.86Å; Y336-L338 PolarHBondContact O-N 3.22Å; L338-R342 WeakPolarHBondContact O-CB 3.15Å; L338-R342 PolarHBondContact O-N 3.13Å
339	L	93.4	Very high	89.7	Confident	15 Å²	15	44.4 Å²	44.4	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-76.1	-43.9	171.2	-75	174.8	0	0	0	112.2	T48 V306 I309 M310 L313 I335 Y336 Y337 E341 R342 V343	T48-L339 HydrophobicContact CG2-CD2 3.63Å; T48-L339 HydrophobicContact CG2-CG 3.64Å; V306-L339 HydrophobicContact CG1-CB 3.71Å; V306-L339 HydrophobicContact CG1-CD1 4.37Å; I309-L339 HydrophobicContact CB-CD1 4.38Å; I309-L339 HydrophobicContact CG2-CD1 3.77Å; I309-L339 HydrophobicContact CG2-CD2 4.05Å; M310-L339 HydrophobicContact CG-CD1 4.1Å; M310-L339 HydrophobicContact SD-CD1 3.67Å; L313-L339 HydrophobicContact CD1-CD1 3.98Å; I335-L339 HydrophobicContact CG2-CD1 4.06Å; I335-L339 HydrophobicContact CG2-CG 4.37Å; I335-L339 WeakPolarHBondContact O-CB 3.29Å; I335-L339 WeakPolarHBondContact O-CG 3.3Å; I335-L339 PolarHBondContact O-N 3.05Å; Y336-L339 PolarHBondContact O-N 3.08Å; Y337-L339 VanDerWaalsContact C-N 3.31Å; Y337-L339 PolarHBondContact O-N 3.49Å; L339-E341 VanDerWaalsContact C-N 3.32Å; L339-E341 PolarHBondContact O-N 2.87Å; L339-R342 PolarHBondContact O-N 3.2Å; L339-V343 WeakPolarHBondContact O-CG2 3.18Å; L339-V343 PolarHBondContact O-N 3.06Å
340	L	90.9	Very high	88.9	Confident	22 Å²	22	46.7 Å²	46.7	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-46	179.1	176	62.6	0	0	0	111.3	V306 Y336 Y337 V343 R344	V306-L340 HydrophobicContact CG2-CB 4.18Å; V306-L340 HydrophobicContact CG2-CD1 3.99Å; Y336-L340 HydrophobicContact CE1-CD2 3.99Å; Y336-L340 VanDerWaalsContact O-CB 3.32Å; Y336-L340 WeakPolarHBondContact O-CB 3.29Å; Y336-L340 PolarHBondContact O-N 3.21Å; Y337-L340 HydrophobicContact CD1-CD2 4.46Å; Y337-L340 PolarHBondContact O-N 2.84Å; L340-V343 PolarHBondContact O-N 3.37Å; L340-R344 WeakPolarHBondContact O-CG 3.35Å; L340-R344 PolarHBondContact O-N 3.36Å
341	E	87.9	Confident	87.9	Confident	56 Å²	56	49.8 Å²	49.8	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-47.4	175.7	-173.4	163.3	-156.1	0	0	111.7	Y89 Y337 L339 V343 R344 E345	Y89-E341 WeakPolarHBondContact CE1-OE2 3.41Å; Y89-E341 PolarHBondContact OH-OE2 3.12Å; Y337-E341 WeakPolarHBondContact O-CB 3.44Å; Y337-E341 PolarHBondContact O-N 3.22Å; L339-E341 VanDerWaalsContact C-N 3.32Å; L339-E341 PolarHBondContact O-N 2.87Å; E341-V343 VanDerWaalsContact C-N 3.27Å; E341-V343 PolarHBondContact O-N 3.37Å; E341-R344 CarbonylContact O-C 3.54Å; E341-R344 WeakPolarHBondContact O-CA 3.07Å; E341-R344 WeakPolarHBondContact O-CB 3.32Å; E341-R344 PolarHBondContact O-N 3.33Å; E341-E345 PolarHBondContact O-N 3.43Å
342	R	87.6	Confident	86.8	Confident	103 Å²	103	51.3 Å²	51.3	39%	0.389	25%	0.249	S	C	.	.	H	α-helix	trans	-59.3	-33.9	175.6	-176.5	171.2	-176.6	72.1	-0.7	113.4	L338 L339 H346	L338-R342 WeakPolarHBondContact O-CB 3.15Å; L338-R342 PolarHBondContact O-N 3.13Å; L339-R342 PolarHBondContact O-N 3.2Å; R342-H346 WeakPolarHBondContact O-CB 3.36Å; R342-H346 PolarHBondContact O-N 3.42Å; R342-H346 VanDerWaalsContact O-N 3.1Å
343	V	86.8	Confident	85.6	Confident	12 Å²	12	58.6 Å²	58.6	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-73.2	-37.6	173.8	170.7	0	0	0	0	111.3	V306 I309 L339 L340 E341 R347 L419	V306-V343 HydrophobicContact CG2-CG2 4.46Å; I309-V343 HydrophobicContact CD1-CG2 4.15Å; L339-V343 WeakPolarHBondContact O-CG2 3.18Å; L339-V343 PolarHBondContact O-N 3.06Å; L340-V343 PolarHBondContact O-N 3.37Å; E341-V343 VanDerWaalsContact C-N 3.27Å; E341-V343 PolarHBondContact O-N 3.37Å; V343-R347 VanDerWaalsContact O-CG 3.31Å; V343-R347 WeakPolarHBondContact O-CG 3.37Å; V343-R347 PolarHBondContact O-N 2.95Å; V343-L419 HydrophobicContact CG2-CD1 4.32Å
344	R	85	Confident	83.8	Confident	95 Å²	95	64.5 Å²	64.5	36%	0.358	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-49.5	171.8	-71	176.3	-175.8	-171	2.5	111.1	E294 L340 E341 H346 R347 A348	E294-R344 IonicContact OE1-CZ 3.27Å; E294-R344 IonicContact OE1-NH1 2.7Å; E294-R344 PolarHBondContact OE1-NH1 3.1Å; L340-R344 WeakPolarHBondContact O-CG 3.35Å; L340-R344 PolarHBondContact O-N 3.36Å; E341-R344 CarbonylContact O-C 3.54Å; E341-R344 WeakPolarHBondContact O-CA 3.07Å; E341-R344 WeakPolarHBondContact O-CB 3.32Å; E341-R344 PolarHBondContact O-N 3.33Å; R344-H346 PolarHBondContact O-N 2.86Å; R344-R347 PolarHBondContact O-N 3.21Å; R344-A348 PolarHBondContact O-N 3.32Å
345	E	82.8	Confident	81.5	Confident	76 Å²	76	69.2 Å²	69.2	36%	0.355	34%	0.335	S	S	.	.	H	α-helix	trans	-51.8	-52.4	174.5	-74.2	-173.4	132.4	0	0	111.3	E341 R347 A348 Q349	E341-E345 PolarHBondContact O-N 3.43Å; E345-R347 PolarHBondContact O-N 2.98Å; E345-A348 PolarHBondContact O-N 3.36Å; E345-Q349 VanDerWaalsContact O-CG 3.29Å; E345-Q349 WeakPolarHBondContact O-CG 3.37Å; E345-Q349 PolarHBondContact O-N 3.24Å
346	H	83.6	Confident	79.2	Confident	53 Å²	53	71.5 Å²	71.5	25%	0.245	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-40.9	-178	-177.3	-109.8	0	0	0	112.2	R342 R344 Q349 Q350	R342-H346 WeakPolarHBondContact O-CB 3.36Å; R342-H346 PolarHBondContact O-N 3.42Å; R342-H346 VanDerWaalsContact O-N 3.1Å; R344-H346 PolarHBondContact O-N 2.86Å; H346-Q349 PolarHBondContact O-N 2.9Å; H346-Q350 PolarHBondContact NE2-NE2 2.79Å; H346-Q350 WeakPolarHBondContact O-CG 3.18Å; H346-Q350 PolarHBondContact O-N 3.21Å
347	R	81	Confident	76.4	Confident	122 Å²	122	76 Å²	76	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-45.3	175.3	-74.7	175.1	-178.8	-171.6	1.1	111.7	V343 R344 E345 Q349 Q350 L351	V343-R347 VanDerWaalsContact O-CG 3.31Å; V343-R347 WeakPolarHBondContact O-CG 3.37Å; V343-R347 PolarHBondContact O-N 2.95Å; R344-R347 PolarHBondContact O-N 3.21Å; E345-R347 PolarHBondContact O-N 2.98Å; R347-Q349 VanDerWaalsContact C-N 3.35Å; R347-Q349 PolarHBondContact O-N 3.37Å; R347-Q350 PolarHBondContact O-N 3.33Å; R347-L351 WeakPolarHBondContact O-CG 3.29Å; R347-L351 PolarHBondContact O-N 3.14Å
348	A	78.5	Confident	73.8	Confident	61 Å²	61	85.4 Å²	85.4	50%	0.504	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-41.2	177.2	0	0	0	0	0	112.3	R344 E345 L351 S352	R344-A348 PolarHBondContact O-N 3.32Å; E345-A348 PolarHBondContact O-N 3.36Å; A348-L351 PolarHBondContact O-N 3.19Å; A348-S352 WeakPolarHBondContact O-CB 3.34Å; A348-S352 PolarHBondContact O-N 3.37Å
349	Q	78.4	Confident	71.3	Confident	111 Å²	111	90.1 Å²	90.1	52%	0.519	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-41.2	175.7	-70.6	168.1	22	0	0	112.4	E345 H346 R347 S352 R353	E345-Q349 VanDerWaalsContact O-CG 3.29Å; E345-Q349 WeakPolarHBondContact O-CG 3.37Å; E345-Q349 PolarHBondContact O-N 3.24Å; H346-Q349 PolarHBondContact O-N 2.9Å; R347-Q349 VanDerWaalsContact C-N 3.35Å; R347-Q349 PolarHBondContact O-N 3.37Å; Q349-S352 PolarHBondContact O-N 2.88Å; Q349-R353 WeakPolarHBondContact O-CG 3.32Å; Q349-R353 PolarHBondContact O-N 2.74Å; Q349-R353 VanDerWaalsContact O-N 3.11Å
350	Q	78	Confident	68.6	Low	70 Å²	70	97 Å²	97	33%	0.327	49%	0.488	S	S	.	.	H	α-helix	trans	-67.8	-41.4	178.1	-64.9	-65.8	-6	0	0	112.2	H346 R347 S352 R353 Q354	H346-Q350 PolarHBondContact NE2-NE2 2.79Å; H346-Q350 WeakPolarHBondContact O-CG 3.18Å; H346-Q350 PolarHBondContact O-N 3.21Å; R347-Q350 PolarHBondContact O-N 3.33Å; Q350-S352 PolarHBondContact O-N 3.38Å; Q350-R353 PolarHBondContact O-N 3Å; Q350-Q354 WeakPolarHBondContact O-CG 3.33Å; Q350-Q354 PolarHBondContact O-N 3.29Å
351	L	73.3	Confident	65.5	Low	117 Å²	117	107.3 Å²	107.3	61%	0.613	53%	0.525	S	S	*	.	H	α-helix	trans	-60.4	-43.4	175	-71.9	167.9	0	0	0	112	R347 A348 R353 Q354 C355	R347-L351 WeakPolarHBondContact O-CG 3.29Å; R347-L351 PolarHBondContact O-N 3.14Å; A348-L351 PolarHBondContact O-N 3.19Å; L351-R353 PolarHBondContact O-N 3.11Å; L351-Q354 PolarHBondContact O-N 3.43Å; L351-C355 PolarHBondContact O-N 3.4Å
352	S	72.9	Confident	63.1	Low	84 Å²	84	109.6 Å²	109.6	59%	0.587	55%	0.545	S	S	*	.	H	α-helix	trans	-58.6	-45.3	174.7	179.9	0	0	0	0	112.1	A348 Q349 Q350 C355 G356	A348-S352 WeakPolarHBondContact O-CB 3.34Å; A348-S352 PolarHBondContact O-N 3.37Å; Q349-S352 PolarHBondContact O-N 2.88Å; Q350-S352 PolarHBondContact O-N 3.38Å; S352-C355 PolarHBondContact O-N 2.7Å; S352-G356 PolarHBondContact O-N 3.47Å; S352-G356 VanDerWaalsContact O-N 3.09Å
353	R	68.3	Low	60.5	Low	175 Å²	175	115.9 Å²	115.9	66%	0.66	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-37.6	178.5	-68.1	177.3	81.7	-172.3	6.5	113	Q349 Q350 L351 G356 T357	Q349-R353 WeakPolarHBondContact O-CG 3.32Å; Q349-R353 PolarHBondContact O-N 2.74Å; Q349-R353 VanDerWaalsContact O-N 3.11Å; Q350-R353 PolarHBondContact O-N 3Å; L351-R353 PolarHBondContact O-N 3.11Å; R353-G356 PolarHBondContact O-N 2.92Å; R353-T357 PolarHBondContact O-N 3.4Å; R353-T357 PolarHBondContact O-OG1 3.15Å
354	Q	57.6	Low	58	Low	125 Å²	125	121 Å²	121	58%	0.584	61%	0.605	S	S	*	*	H	α-helix	trans	-66.2	-43.3	175.9	-73.8	179.3	-8.7	0	0	111.9	Q350 L351 G356 T357	Q350-Q354 WeakPolarHBondContact O-CG 3.33Å; Q350-Q354 PolarHBondContact O-N 3.29Å; L351-Q354 PolarHBondContact O-N 3.43Å; Q354-G356 VanDerWaalsContact C-N 3.33Å; Q354-G356 PolarHBondContact O-N 3.41Å; Q354-T357 WeakPolarHBondContact O-CB 3.5Å; Q354-T357 PolarHBondContact O-N 2.79Å; Q354-T357 VanDerWaalsContact O-N 3.15Å; Q354-T357 PolarHBondContact O-OG1 3Å
355	C	47.1	Very low	55.4	Low	99 Å²	99	122.6 Å²	122.6	67%	0.669	63%	0.625	S	S	*	*	H	α-helix	trans	-60.3	-42.3	175.4	-169.1	0	0	0	0	112	L351 S352 T357 W358	L351-C355 PolarHBondContact O-N 3.4Å; S352-C355 PolarHBondContact O-N 2.7Å; C355-T357 PolarHBondContact O-N 3.16Å; C355-T357 VanDerWaalsContact O-N 3.09Å; C355-W358 PolarHBondContact O-N 3.3Å
356	G	46	Very low	53.2	Low	51 Å²	51	124 Å²	124	53%	0.526	64%	0.643	S	S	.	*	H	α-helix	trans	-61	-18.2	176.7	0	0	0	0	0	115.4	S352 R353 Q354	S352-G356 PolarHBondContact O-N 3.47Å; S352-G356 VanDerWaalsContact O-N 3.09Å; R353-G356 PolarHBondContact O-N 2.92Å; Q354-G356 VanDerWaalsContact C-N 3.33Å; Q354-G356 PolarHBondContact O-N 3.41Å
357	T	37.2	Very low	50.7	Low	104 Å²	104	128.1 Å²	128.1	64%	0.638	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-78.9	-20.8	-177.4	-37.9	0	0	0	0	112.8	R353 Q354 C355	R353-T357 PolarHBondContact O-N 3.4Å; R353-T357 PolarHBondContact O-OG1 3.15Å; Q354-T357 WeakPolarHBondContact O-CB 3.5Å; Q354-T357 PolarHBondContact O-N 2.79Å; Q354-T357 VanDerWaalsContact O-N 3.15Å; Q354-T357 PolarHBondContact O-OG1 3Å; C355-T357 PolarHBondContact O-N 3.16Å; C355-T357 VanDerWaalsContact O-N 3.09Å
358	W	39.3	Very low	48.5	Very low	242 Å²	242	128 Å²	128	92%	0.917	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-87.1	-7	-175.3	-76.7	73.2	0	0	0	114.6	C355	C355-W358 PolarHBondContact O-N 3.3Å
359	S	40.7	Very low	46.2	Very low	100 Å²	100	132 Å²	132	70%	0.699	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-108.4	10.6	-173.6	-147.5	0	0	0	0	114.5
360	Q	37.1	Very low	43.9	Very low	159 Å²	159	129.8 Å²	129.8	74%	0.743	71%	0.711	S	S	*	*			trans	-138.5	86.5	176.7	-73.3	-61.8	-15.7	0	0	112.3
361	R	27.4	Very low	42.1	Very low	238 Å²	238	132 Å²	132	90%	0.898	73%	0.731	S	S	*	*			trans	-123.7	102.4	159.5	-162.8	178.3	-162.6	-178.8	6	108.2	R363	R361-R363 PolarHBondContact O-N 3.48Å
362	P	36.6	Very low	39.9	Very low	104 Å²	104	135.2 Å²	135.2	68%	0.675	74%	0.743	S	S	*	*			trans	-59.2	133	178.5	-23	33.4	0	0	0	110.7	S364	P362-S364 PolarHBondContact O-N 3.49Å
363	R	32.9	Very low	37.7	Very low	236 Å²	236	137.5 Å²	137.5	89%	0.891	75%	0.753	S	S	*	*			trans	-81.2	98.9	162.7	-70.4	-169	-175	-151	3.2	107.8	R361 T365	R361-R363 PolarHBondContact O-N 3.48Å; R363-T365 PolarHBondContact O-N 3.46Å
364	S	34	Very low	35.8	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	76%	0.76	S	S	*	*			trans	-71.2	109.2	166	-57.6	0	0	0	0	108.9	P362	P362-S364 PolarHBondContact O-N 3.49Å
365	T	31.7	Very low	34.3	Very low	130 Å²	130	137.7 Å²	137.7	80%	0.798	77%	0.766	S	S	*	*			trans	-133	105	169	51.6	0	0	0	0	108.2	R363	R363-T365 PolarHBondContact O-N 3.46Å
366	S	34.6	Very low	33.3	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	77%	0.772	S	S	*	*			trans	-91.6	142.2	178.1	47.8	0	0	0	0	111.7
367	D	32.4	Very low	32.2	Very low	141 Å²	141	142.8 Å²	142.8	75%	0.754	78%	0.777	S	S	*	*			trans	53.7	92.9	148.4	-51.8	-32.5	0	0	0	120
368	S	35	Very low	31.7	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	78%	0.779	S	S	*	*				30.8	100.1	109.9	-53.3	0	0	0	0	118.7
369	T	30.6	Very low	31	Very low	144 Å²	144	139.6 Å²	139.6	88%	0.883	78%	0.776	S	S	*	*			trans	-146.8	140	142.3	22.6	0	0	0	0	109.8
370	G	29.6	Very low	30.3	Very low	66 Å²	66	139 Å²	139	68%	0.68	77%	0.771	S	S	*	*			trans	-86.9	178.8	154.8	0	0	0	0	0	110.1
371	P	39.9	Very low	29.8	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	78%	0.775	S	S	*	*			cis	-141.8	-176.7	37.6	42	-24.1	0	0	0	116.8
372	E	26.2	Very low	29.7	Very low	186 Å²	186	139.3 Å²	139.3	87%	0.869	77%	0.771	S	S	*	*			trans	72.9	178	148.3	-86.2	-177	140.9	0	0	121.9
373	V	28.4	Very low	29.1	Very low	131 Å²	131	138 Å²	138	79%	0.794	77%	0.769	S	S	*	*			trans	-123.6	-178	-153	178.4	0	0	0	0	109
374	I	28	Very low	28.7	Very low	157 Å²	157	132.9 Å²	132.9	81%	0.805	76%	0.764	S	S	*	*			trans	89.9	106.5	-178	-53.4	158.5	0	0	0	110
375	M	25.4	Very low	29.5	Very low	147 Å²	147	131.9 Å²	131.9	72%	0.724	76%	0.755	S	S	*	*			cis	80.8	122.4	41.8	-169	179.9	126.1	0	0	113.3
376	E	25.8	Very low	29.3	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	76%	0.757	S	S	*	*			trans	63.7	152.8	175.6	-72.4	-177.2	137.3	0	0	116.7
377	S	24.6	Very low	28.9	Very low	92 Å²	92	135 Å²	135	64%	0.643	76%	0.759	S	S	*	*			cis	-161.1	169.8	-23.1	54.1	0	0	0	0	110.8
378	S	25.3	Very low	28.8	Very low	98 Å²	98	135.4 Å²	135.4	69%	0.685	76%	0.76	S	S	*	*			trans	60.1	131.8	147	-61.1	0	0	0	0	122.6
379	E	24.7	Very low	28.9	Very low	181 Å²	181	135.5 Å²	135.5	85%	0.846	76%	0.757	S	S	*	*			trans	68.1	168.1	144.2	-69.8	-179.2	-171.4	0	0	119.7
380	S	27.2	Very low	28.8	Very low	86 Å²	86	133.6 Å²	133.6	60%	0.601	75%	0.75	S	S	*	*			cis	-172.2	153.4	-46.2	-93.6	0	0	0	0	108.6
381	F	25.5	Very low	28.7	Very low	185 Å²	185	139.3 Å²	139.3	81%	0.811	76%	0.756	S	S	*	*			trans	63.4	165.1	167.9	-63.7	-60.2	0	0	0	116.5
382	R	25.5	Very low	27.9	Very low	220 Å²	220	140.7 Å²	140.7	83%	0.83	76%	0.757	S	S	*	*			cis	-167.5	160.1	-35.1	-166.2	-179.3	-162.9	177.1	4	108.3
383	A	23.5	Very low	27.9	Very low	76 Å²	76	138 Å²	138	63%	0.628	75%	0.753	S	S	*	*			trans	65.8	108.5	155.5	0	0	0	0	0	121.5
384	T	25.8	Very low	28.9	Very low	129 Å²	129	137 Å²	137	79%	0.791	75%	0.75	S	S	*	*				28.1	162.7	105.3	63.1	0	0	0	0	121.4
385	P	49.9	Very low	29.8	Very low	96 Å²	96	135 Å²	135	62%	0.623	75%	0.747	S	S	*	*			cis	-141.1	-159.1	-14.3	24.6	3.4	0	0	0	114.6
386	F	28.2	Very low	29.8	Very low	191 Å²	191	134.1 Å²	134.1	84%	0.838	75%	0.75	S	S	*	*			trans	77.7	154.8	162.3	-67.3	-64.9	0	0	0	118.3
387	S	24.6	Very low	29.8	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	75%	0.753	S	S	*	*			cis	-151.3	175.8	4.3	-137.5	0	0	0	0	114.7
388	L	30.9	Very low	29.9	Very low	149 Å²	149	136 Å²	136	78%	0.78	75%	0.75	S	S	*	*			trans	-108.4	162.3	177.8	-149	89	0	0	0	112.5
389	P	37.6	Very low	29.7	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	76%	0.757	S	S	*	*				-146.9	164	110.1	37.3	-22.2	0	0	0	113.9
390	S	27.5	Very low	29.9	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	75%	0.751	S	S	*	*			cis	116.9	140.5	5.8	-168.5	0	0	0	0	114.9
391	K	27.7	Very low	29.7	Very low	186 Å²	186	141.6 Å²	141.6	81%	0.809	76%	0.764	S	S	*	*			trans	118.3	138.7	-177.5	-72.5	179.6	176.5	178.5	0	112.4
392	N	24.6	Very low	29.8	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	77%	0.765	S	S	*	*			cis	-151.7	173.1	-2.2	-112.5	2.5	0	0	0	111.7
393	T	25.1	Very low	29.8	Very low	128 Å²	128	135.9 Å²	135.9	79%	0.785	77%	0.767	S	S	*	*			trans	-133.1	-160.3	-169.3	60	0	0	0	0	111
394	P	50.6	Low	30.1	Very low	110 Å²	110	141.5 Å²	141.5	71%	0.714	78%	0.78	S	S	*	*			cis	-115.8	-136.5	-22.8	39.9	-20.9	0	0	0	108.6
395	P	46.8	Very low	30.2	Very low	115 Å²	115	139 Å²	139	75%	0.747	78%	0.779	S	S	*	*			cis	-106.9	-145	-29.8	18.7	7.2	0	0	0	111
396	V	25.1	Very low	29.2	Very low	130 Å²	130	138 Å²	138	79%	0.788	79%	0.787	S	S	*	*			cis	-148.2	172.1	14.3	-173.1	0	0	0	0	110.7
397	Y	25.3	Very low	29.2	Very low	212 Å²	212	137.2 Å²	137.2	83%	0.831	79%	0.79	S	S	*	*			trans	-66.2	169.1	173.3	-94	-133.6	0	0	0	116.4
398	S	25.6	Very low	29.3	Very low	84 Å²	84	142 Å²	142	59%	0.587	80%	0.797	S	S	*	*			cis	178.7	172.1	-23.8	-89.8	0	0	0	0	111.1
399	E	22.8	Very low	29.1	Very low	178 Å²	178	142.6 Å²	142.6	83%	0.832	80%	0.796	S	S	*	*			trans	91.7	150	155.9	-53.8	-153.6	129.6	0	0	122.5
400	V	27.6	Very low	28.8	Very low	119 Å²	119	146.8 Å²	146.8	72%	0.721	80%	0.797	S	S	*	*			trans	58.6	107.5	159.4	-70.2	0	0	0	0	124.4
401	E	24.1	Very low	28.8	Very low	186 Å²	186	149 Å²	149	87%	0.869	81%	0.805	S	S	*	*				82.7	159.5	113.6	-153.4	157	-168.5	0	0	122.1
402	C	28.2	Very low	29	Very low	123 Å²	123	144.6 Å²	144.6	83%	0.831	79%	0.794	S	S	*	*			trans	-71.9	147.3	-164.7	-71	0	0	0	0	116.2
403	D	23.7	Very low	29.3	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	78%	0.782	S	S	*	*				-151.6	154.4	105.1	-158.9	1.1	0	0	0	110.8
404	Q	31.4	Very low	29.8	Very low	194 Å²	194	142.3 Å²	142.3	91%	0.907	78%	0.777	S	S	*	*			trans	-111.5	79.9	-175.3	-171	159	16.6	0	0	112.8
405	G	26.4	Very low	29.3	Very low	75 Å²	75	139.9 Å²	139.9	77%	0.773	76%	0.76	S	S	*	*			trans	-128	128.5	177.9	0	0	0	0	0	114.9
406	G	28.8	Very low	29	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	75%	0.745	S	S	*	*			trans	87.8	81.8	149.4	0	0	0	0	0	119.5
407	L	28.2	Very low	29.7	Very low	174 Å²	174	135.5 Å²	135.5	91%	0.911	73%	0.732	S	S	*	*			trans	-134.1	72.8	154.1	-86	-178.7	0	0	0	112.5
408	F	28.3	Very low	30.6	Very low	210 Å²	210	128.2 Å²	128.2	92%	0.921	71%	0.712	S	S	*	*			trans	-127.9	65.3	167.7	-104.4	-73.4	0	0	0	111
409	Q	26.6	Very low	31.5	Very low	163 Å²	163	125.6 Å²	125.6	76%	0.762	69%	0.691	S	S	*	*			trans	-114.9	74.6	-178.1	-159.7	72.6	2.2	0	0	113.3
410	R	30.7	Very low	32.4	Very low	207 Å²	207	119.5 Å²	119.5	78%	0.781	66%	0.664	S	S	*	*			trans	54.1	72.8	131.2	-161.1	-178	-165.5	142.9	1.3	118.1	V412	R410-V412 PolarHBondContact O-N 2.99Å
411	V	27.3	Very low	33.3	Very low	151 Å²	151	124.2 Å²	124.2	92%	0.915	67%	0.669	S	S	*	*			trans	-86	89.8	159.4	-177.3	0	0	0	0	109.7
412	V	31.1	Very low	34.3	Very low	94 Å²	94	121.3 Å²	121.3	57%	0.57	66%	0.659	S	S	*	*			trans	-135.5	135.2	171.9	-175.8	0	0	0	0	109.9	R410	R410-V412 PolarHBondContact O-N 2.99Å
413	F	30.8	Very low	35.1	Very low	120 Å²	120	119 Å²	119	53%	0.526	64%	0.638	S	S	.	*			trans	103.6	130.4	174.8	-58.1	-58.2	0	0	0	117	E416	F413-E416 HydrophobicContact CD1-CB 4.11Å; F413-E416 HydrophobicContact CD1-CG 3.94Å; F413-E416 HydrophobicContact CE1-CB 4.15Å; F413-E416 HydrophobicContact CE1-CG 3.47Å; F413-E416 VanDerWaalsContact CE1-CG 3.47Å; F413-E416 WeakPolarHBondContact CE1-OE1 3.48Å; F413-E416 HydrophobicContact CZ-CG 3.97Å; F413-E416 WeakPolarHBondContact CZ-OE1 3.28Å; F413-E416 WeakPolarHBondContact CZ-OE2 3.43Å
414	P	35.9	Very low	35.7	Very low	104 Å²	104	120.7 Å²	120.7	68%	0.675	63%	0.632	S	S	*	*	S	Bend		-130.2	17.6	93.4	39.8	-32.8	0	0	0	115.3
415	V	41	Very low	35.8	Very low	60 Å²	60	118.5 Å²	118.5	36%	0.364	63%	0.627	S	S	.	*	H	α-helix	trans	-66.7	-43.2	-172.7	-179.9	0	0	0	0	113.4	A417 S418 L419	V415-A417 PolarHBondContact O-N 2.99Å; V415-S418 PolarHBondContact O-N 2.87Å; V415-L419 HydrophobicContact CG1-CD1 4.33Å; V415-L419 PolarHBondContact O-N 2.85Å
416	E	40.4	Very low	36.3	Very low	91 Å²	91	125.1 Å²	125.1	43%	0.425	63%	0.628	S	S	.	*	H	α-helix	trans	-61.3	-45.7	-178.5	-83	177.2	179.8	0	0	112.9	F413 S418 L419 N420	F413-E416 HydrophobicContact CD1-CB 4.11Å; F413-E416 HydrophobicContact CD1-CG 3.94Å; F413-E416 HydrophobicContact CE1-CB 4.15Å; F413-E416 HydrophobicContact CE1-CG 3.47Å; F413-E416 VanDerWaalsContact CE1-CG 3.47Å; F413-E416 WeakPolarHBondContact CE1-OE1 3.48Å; F413-E416 HydrophobicContact CZ-CG 3.97Å; F413-E416 WeakPolarHBondContact CZ-OE1 3.28Å; F413-E416 WeakPolarHBondContact CZ-OE2 3.43Å; E416-S418 PolarHBondContact O-N 2.99Å; E416-S418 VanDerWaalsContact O-N 3.13Å; E416-L419 PolarHBondContact O-N 3.28Å; E416-L419 VanDerWaalsContact O-N 3.14Å; E416-N420 WeakPolarHBondContact O-CB 3.47Å; E416-N420 VanDerWaalsContact O-CG 3.3Å; E416-N420 PolarHBondContact O-N 3.18Å
417	A	39.9	Very low	36.2	Very low	62 Å²	62	127.2 Å²	127.2	51%	0.512	63%	0.631	S	S	.	*	H	α-helix	trans	-57.7	-32.8	-177.5	0	0	0	0	0	113.1	V415 R421	V415-A417 PolarHBondContact O-N 2.99Å; A417-R421 WeakPolarHBondContact O-CB 3.19Å; A417-R421 WeakPolarHBondContact O-CG 3.28Å; A417-R421 PolarHBondContact O-N 2.7Å; A417-R421 VanDerWaalsContact O-N 3.12Å
418	S	44.1	Very low	36.7	Very low	59 Å²	59	124.3 Å²	124.3	41%	0.413	62%	0.615	S	S	.	*	H	α-helix	trans	-75.8	-39.2	179.5	-59.5	0	0	0	0	112.6	V415 E416 L422	V415-S418 PolarHBondContact O-N 2.87Å; E416-S418 PolarHBondContact O-N 2.99Å; E416-S418 VanDerWaalsContact O-N 3.13Å; S418-L422 PolarHBondContact O-N 3.49Å
419	L	44	Very low	36.9	Very low	29 Å²	29	118 Å²	118	15%	0.152	60%	0.597	C	S	.	*	H	α-helix	trans	-73.6	-40.4	175.8	-71.5	170	0	0	0	111.2	I309 V343 V415 E416 R421 L422 L423	I309-L419 HydrophobicContact CD1-CD1 3.77Å; V343-L419 HydrophobicContact CG2-CD1 4.32Å; V415-L419 HydrophobicContact CG1-CD1 4.33Å; V415-L419 PolarHBondContact O-N 2.85Å; E416-L419 PolarHBondContact O-N 3.28Å; E416-L419 VanDerWaalsContact O-N 3.14Å; L419-R421 PolarHBondContact O-N 3.32Å; L419-L422 PolarHBondContact O-N 2.71Å; L419-L422 VanDerWaalsContact O-N 3.08Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.73Å; L419-L423 VanDerWaalsContact O-N 3.15Å
420	N	42.8	Very low	37.4	Very low	49 Å²	49	113.6 Å²	113.6	26%	0.262	58%	0.582	S	S	.	*	H	α-helix	trans	-60.8	-45	176	-71	-14.9	0	0	0	111.4	E416 L422 L423 W424	E416-N420 WeakPolarHBondContact O-CB 3.47Å; E416-N420 VanDerWaalsContact O-CG 3.3Å; E416-N420 PolarHBondContact O-N 3.18Å; N420-L422 PolarHBondContact O-N 3.15Å; N420-L423 PolarHBondContact O-N 3.26Å; N420-W424 VanDerWaalsContact O-CD1 3.29Å; N420-W424 PolarHBondContact O-N 3.23Å
421	R	44.8	Very low	37.5	Very low	218 Å²	218	110.1 Å²	110.1	82%	0.823	58%	0.579	S	S	*	*	H	α-helix	trans	-60.4	-25.4	174.6	-82.7	-171.4	178.8	-123.1	3.6	114.3	A417 L419	A417-R421 WeakPolarHBondContact O-CB 3.19Å; A417-R421 WeakPolarHBondContact O-CG 3.28Å; A417-R421 PolarHBondContact O-N 2.7Å; A417-R421 VanDerWaalsContact O-N 3.12Å; L419-R421 PolarHBondContact O-N 3.32Å
422	L	46.3	Very low	38.3	Very low	126 Å²	126	106.9 Å²	106.9	66%	0.66	56%	0.563	S	S	*	*	H	α-helix	trans	-82.7	-21.7	175	-73.1	168.6	0	0	0	113.3	S418 L419 N420	S418-L422 PolarHBondContact O-N 3.49Å; L419-L422 PolarHBondContact O-N 2.71Å; L419-L422 VanDerWaalsContact O-N 3.08Å; N420-L422 PolarHBondContact O-N 3.15Å
423	L	44.3	Very low	39.2	Very low	74 Å²	74	105.1 Å²	105.1	39%	0.387	55%	0.551	S	S	.	*	H	α-helix	trans	-93.4	-29.1	-179.5	-67.7	171.7	0	0	0	113.1	L313 L419 N420 N425	L313-L423 HydrophobicContact CD2-CD1 4.4Å; L313-L423 HydrophobicContact CD2-CD2 4.27Å; L419-L423 WeakPolarHBondContact O-CG 3.38Å; L419-L423 PolarHBondContact O-N 2.73Å; L419-L423 VanDerWaalsContact O-N 3.15Å; N420-L423 PolarHBondContact O-N 3.26Å; L423-N425 PolarHBondContact O-N 2.9Å
424	W	36.5	Very low	40.2	Very low	199 Å²	199	102.7 Å²	102.7	75%	0.754	54%	0.543	S	S	*	.			trans	-69.8	-0.6	-173	-95.1	88.1	0	0	0	116.5	N420 R426	N420-W424 VanDerWaalsContact O-CD1 3.29Å; N420-W424 PolarHBondContact O-N 3.23Å; W424-R426 PolarHBondContact O-N 3.33Å; W424-R426 VanDerWaalsContact O-N 3.1Å
425	N	34.1	Very low	40.3	Very low	148 Å²	148	106 Å²	106	79%	0.791	55%	0.549	S	S	*	.	S	Bend	trans	-83.8	37	178.1	-84.9	-0.1	0	0	0	114.8	L423	L423-N425 PolarHBondContact O-N 2.9Å
426	R	36	Very low	40.3	Very low	214 Å²	214	105.9 Å²	105.9	81%	0.808	55%	0.549	S	S	*	.	S	Bend	trans	176.7	127.4	148.6	-101.6	164.4	-169.3	-102.1	1.8	110.2	W424 I428	W424-R426 PolarHBondContact O-N 3.33Å; W424-R426 VanDerWaalsContact O-N 3.1Å; R426-I428 HydrophobicContact CB-CG1 4.4Å; R426-I428 PolarHBondContact O-N 2.85Å
427	S	27.5	Very low	40.2	Very low	119 Å²	119	106.6 Å²	106.6	83%	0.832	56%	0.564	S	S	*	*			trans	-69.3	119.7	166.8	51.9	0	0	0	0	110.5
428	I	37.7	Very low	40.2	Very low	113 Å²	113	107.6 Å²	107.6	58%	0.579	56%	0.56	S	S	*	*			trans	-131.7	135.3	175.1	-58.9	179.6	0	0	0	107.7	R426	R426-I428 HydrophobicContact CB-CG1 4.4Å; R426-I428 PolarHBondContact O-N 2.85Å
429	S	32.1	Very low	39.9	Very low	77 Å²	77	108.7 Å²	108.7	54%	0.538	57%	0.567	S	S	.	*			trans	-70.8	135.3	-175.7	-176.4	0	0	0	0	111.8	N431 S432	S429-N431 PolarHBondContact O-N 3.24Å; S429-S432 PolarHBondContact O-N 3.02Å
430	P	37.6	Very low	39.7	Very low	71 Å²	71	116.3 Å²	116.3	46%	0.461	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-53.5	-45.4	-173.8	-29.1	35.6	0	0	0	114.6	S432 L433	P430-S432 VanDerWaalsContact C-N 3.28Å; P430-S432 PolarHBondContact O-N 3.16Å; P430-L433 PolarHBondContact O-N 3.09Å
431	N	33	Very low	39.6	Very low	134 Å²	134	119.6 Å²	119.6	72%	0.717	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-69.2	-25.8	-174.2	-65.7	-4.2	0	0	0	112.9	S429 L433	S429-N431 PolarHBondContact O-N 3.24Å; N431-L433 PolarHBondContact O-N 3.14Å
432	S	44.9	Very low	39.5	Very low	83 Å²	83	110.8 Å²	110.8	58%	0.58	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-75.3	-5.3	-177.3	-173.4	0	0	0	0	114	S429 P430	S429-S432 PolarHBondContact O-N 3.02Å; P430-S432 VanDerWaalsContact C-N 3.28Å; P430-S432 PolarHBondContact O-N 3.16Å
433	L	50	Low	39.1	Very low	58 Å²	58	111 Å²	111	30%	0.304	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-87.6	-30.5	177.6	-87	167.6	0	0	0	113.4	F25 P430 N431	F25-L433 WeakPolarHBondContact CE1-O 3.48Å; F25-L433 WeakPolarHBondContact CZ-O 3.36Å; P430-L433 PolarHBondContact O-N 3.09Å; N431-L433 PolarHBondContact O-N 3.14Å
434	L	50.5	Low	39	Very low	69 Å²	69	110.8 Å²	110.8	36%	0.361	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-20.2	-172.4	-59.2	-178.5	0	0	0	113.4	F25 T436	F25-L434 HydrophobicContact CZ-CD2 4.04Å; L434-T436 VanDerWaalsContact C-N 3.32Å; L434-T436 PolarHBondContact O-N 2.86Å; L434-T436 VanDerWaalsContact O-N 3.09Å
435	E	39.4	Very low	39	Very low	172 Å²	172	110.7 Å²	110.7	80%	0.804	58%	0.581	S	S	*	*			trans	-82.9	72.2	170	-70.2	-167.1	123.2	0	0	112.2
436	T	39.8	Very low	39.3	Very low	58 Å²	58	108.2 Å²	108.2	36%	0.356	57%	0.567	S	S	.	*			trans	-126.6	98.8	152.5	62	0	0	0	0	109.5	L434	L434-T436 VanDerWaalsContact C-N 3.32Å; L434-T436 PolarHBondContact O-N 2.86Å; L434-T436 VanDerWaalsContact O-N 3.09Å
437	S	38.1	Very low	40	Very low	106 Å²	106	100.9 Å²	100.9	74%	0.741	54%	0.544	S	S	*	.			trans	-52.2	150.1	155	42.7	0	0	0	0	109.4	S439	S437-S439 PolarHBondContact O-N 3.49Å
438	I	41.1	Very low	40.7	Very low	84 Å²	84	102.3 Å²	102.3	43%	0.431	54%	0.537	S	S	.	.			trans	-57.7	113.4	176	-59.8	172.4	0	0	0	106.7	T94	T94-I438 HydrophobicContact CG2-CD1 3.63Å
439	S	37.2	Very low	40.9	Very low	81 Å²	81	103.7 Å²	103.7	57%	0.566	54%	0.542	S	S	*	.			trans	-58.6	147	179.4	-58.2	0	0	0	0	109.7	S437	S437-S439 PolarHBondContact O-N 3.49Å
440	E	39.3	Very low	41.5	Very low	189 Å²	189	106.2 Å²	106.2	88%	0.883	55%	0.545	S	S	*	.	S	Bend	trans	-44	142.1	-162.7	-84.7	173.4	105.4	0	0	114.9	V442	E440-V442 PolarHBondContact O-N 2.82Å; E440-V442 VanDerWaalsContact O-N 3.16Å
441	E	42.3	Very low	41.6	Very low	119 Å²	119	111.5 Å²	111.5	56%	0.556	56%	0.563	S	S	*	*			trans	-34.1	111.4	-170.4	-58.9	165.1	102.6	0	0	113.7	R443	E441-R443 VanDerWaalsContact C-N 3.3Å; E441-R443 HydrophobicContact CB-CG 4.43Å; E441-R443 PolarHBondContact O-N 3.36Å; E441-R443 IonicContact OE1-NH2 3.48Å; E441-R443 IonicContact OE2-CZ 3.19Å; E441-R443 IonicContact OE2-NH1 2.68Å; E441-R443 PolarHBondContact OE2-NH1 3.22Å; E441-R443 IonicContact OE2-NH2 3.68Å; E441-R443 PolarHBondContact OE2-NH2 3.07Å
442	V	41	Very low	41.7	Very low	33 Å²	33	108.8 Å²	108.8	20%	0.2	56%	0.559	C	S	.	*			trans	-64.1	92.8	165.5	-176.1	0	0	0	0	107.7	L21 E440 L447	L21-V442 HydrophobicContact CD1-CG1 4.05Å; L21-V442 HydrophobicContact CD1-CG2 3.68Å; E440-V442 PolarHBondContact O-N 2.82Å; E440-V442 VanDerWaalsContact O-N 3.16Å; V442-L447 HydrophobicContact CG1-CD1 4.33Å; V442-L447 HydrophobicContact CG1-CD2 3.89Å; V442-L447 HydrophobicContact CG1-CG 4.12Å
443	R	39.2	Very low	41.1	Very low	129 Å²	129	109.9 Å²	109.9	49%	0.487	56%	0.563	S	S	.	*			trans	-73.6	146.6	179.8	-72.5	178.5	159.3	70	10.4	108.2	E441 R445 D446	E441-R443 VanDerWaalsContact C-N 3.3Å; E441-R443 HydrophobicContact CB-CG 4.43Å; E441-R443 PolarHBondContact O-N 3.36Å; E441-R443 IonicContact OE1-NH2 3.48Å; E441-R443 IonicContact OE2-CZ 3.19Å; E441-R443 IonicContact OE2-NH1 2.68Å; E441-R443 PolarHBondContact OE2-NH1 3.22Å; E441-R443 IonicContact OE2-NH2 3.68Å; E441-R443 PolarHBondContact OE2-NH2 3.07Å; R443-R445 PolarHBondContact O-N 3.3Å; R443-D446 WeakPolarHBondContact CB-OD2 3.34Å; R443-D446 PolarHBondContact N-OD2 3.09Å; R443-D446 PolarHBondContact O-N 2.76Å
444	P	42.1	Very low	40.6	Very low	70 Å²	70	114.4 Å²	114.4	46%	0.455	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-56.1	-21.4	179.5	-29.8	36.6	0	0	0	115.2	M97 L447	M97-P444 HydrophobicContact CE-CG 4.36Å; P444-L447 PolarHBondContact O-N 3.12Å
445	R	37	Very low	39.7	Very low	198 Å²	198	115.7 Å²	115.7	75%	0.747	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-71	-37.6	177	-64.8	-174.3	179.3	-177.6	-0.6	113.2	R443 L447 E448	R443-R445 PolarHBondContact O-N 3.3Å; R445-L447 PolarHBondContact O-N 3.48Å; R445-E448 PolarHBondContact O-N 3.21Å
446	D	39.9	Very low	39.2	Very low	95 Å²	95	116.2 Å²	116.2	51%	0.508	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-67.3	-8.9	179.4	-43.3	-43.3	0	0	0	112.1	R443	R443-D446 WeakPolarHBondContact CB-OD2 3.34Å; R443-D446 PolarHBondContact N-OD2 3.09Å; R443-D446 PolarHBondContact O-N 2.76Å
447	L	49.7	Very low	38.6	Very low	61 Å²	61	116.8 Å²	116.8	32%	0.319	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-95.2	0.7	176	-59.3	178.4	0	0	0	113.9	L21 V442 P444 R445	L21-L447 HydrophobicContact CD2-CD2 3.99Å; V442-L447 HydrophobicContact CG1-CD1 4.33Å; V442-L447 HydrophobicContact CG1-CD2 3.89Å; V442-L447 HydrophobicContact CG1-CG 4.12Å; P444-L447 PolarHBondContact O-N 3.12Å; R445-L447 PolarHBondContact O-N 3.48Å
448	E	42.9	Very low	38.5	Very low	148 Å²	148	117.7 Å²	117.7	69%	0.692	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-25.6	-177.3	-59.3	-165.5	137.3	0	0	113.7	R445	R445-E448 PolarHBondContact O-N 3.21Å
449	E	42.8	Very low	37.9	Very low	143 Å²	143	121.1 Å²	121.1	67%	0.668	64%	0.643	S	S	*	*	S	Bend	trans	-84	-27.2	-175.1	-65.2	-171	151.9	0	0	115.3	E451 A452	E449-E451 VanDerWaalsContact C-N 3.32Å; E449-E451 PolarHBondContact O-N 2.69Å; E449-A452 PolarHBondContact O-N 2.73Å
450	E	43.3	Very low	37.8	Very low	129 Å²	129	124.5 Å²	124.5	60%	0.603	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-72.1	-20.6	-172.6	-145.2	-155.5	151.4	0	0	114.4	A452 T453 Q454	E450-A452 PolarHBondContact O-N 3.41Å; E450-T453 PolarHBondContact O-OG1 3.35Å; E450-Q454 PolarHBondContact OE1-NE2 2.93Å; E450-Q454 VanDerWaalsContact OE1-NE2 3.08Å
451	E	39.9	Very low	37.9	Very low	182 Å²	182	120.5 Å²	120.5	85%	0.85	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-72.1	-13.7	178.4	-161.7	164.7	-175.1	0	0	112.2	E449	E449-E451 VanDerWaalsContact C-N 3.32Å; E449-E451 PolarHBondContact O-N 2.69Å
452	A	34.7	Very low	37.4	Very low	77 Å²	77	120.6 Å²	120.6	64%	0.636	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-84.7	-21.5	-177.8	0	0	0	0	0	114.7	E449 E450	E449-A452 PolarHBondContact O-N 2.73Å; E450-A452 PolarHBondContact O-N 3.41Å
453	T	33.5	Very low	36.9	Very low	107 Å²	107	125.1 Å²	125.1	66%	0.656	68%	0.684	S	S	*	*	S	Bend	trans	-100.3	-11.7	-162.8	54.8	0	0	0	0	115.4	E450 S455	E450-T453 PolarHBondContact O-OG1 3.35Å; T453-S455 PolarHBondContact O-N 2.81Å
454	Q	38.4	Very low	36.4	Very low	152 Å²	152	125.5 Å²	125.5	71%	0.71	70%	0.7	S	S	*	*	S	Bend	trans	-95.3	24.9	-170.3	-56.9	-168.4	10.2	0	0	115.3	E450	E450-Q454 PolarHBondContact OE1-NE2 2.93Å; E450-Q454 VanDerWaalsContact OE1-NE2 3.08Å
455	S	31.6	Very low	35.7	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	72%	0.718	S	S	*	*			trans	-129.9	38.8	-165.7	62.8	0	0	0	0	117.8	T453	T453-S455 PolarHBondContact O-N 2.81Å
456	L	29.4	Very low	35.3	Very low	184 Å²	184	129 Å²	129	96%	0.963	72%	0.722	S	S	*	*			trans	-127.5	104.3	171.4	-81.3	170.3	0	0	0	113.6
457	G	28.1	Very low	34.9	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	74%	0.737	S	S	*	*			trans	-175.1	150.1	170.7	0	0	0	0	0	111.7
458	P	35.4	Very low	34	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	76%	0.757	S	S	*	*			trans	-98.9	127.6	-158.4	-0	21.4	0	0	0	115.8
459	L	29.3	Very low	33.5	Very low	156 Å²	156	138.1 Å²	138.1	82%	0.817	76%	0.76	S	S	*	*				34.5	126.2	125.1	-69.5	176.1	0	0	0	118.4
460	L	33.3	Very low	32.7	Very low	152 Å²	152	139 Å²	139	80%	0.796	77%	0.768	S	S	*	*			cis	-158	-172.2	48.1	-113.8	168.4	0	0	0	111.2
461	P	41.9	Very low	32	Very low	105 Å²	105	137.5 Å²	137.5	68%	0.682	78%	0.777	S	S	*	*				-116.2	179.7	-128.4	44.7	-30.1	0	0	0	116
462	P	33.2	Very low	31.5	Very low	122 Å²	122	136.8 Å²	136.8	79%	0.792	77%	0.774	S	S	*	*				-134.2	169.4	100.6	39.1	-30.7	0	0	0	116.5
463	T	29.7	Very low	30.9	Very low	128 Å²	128	140.2 Å²	140.2	79%	0.785	79%	0.787	S	S	*	*			trans	-49.6	156	178.1	55.6	0	0	0	0	116.5
464	T	28.3	Very low	30.6	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	79%	0.787	S	S	*	*			cis	-139.2	141.6	13.5	52.2	0	0	0	0	113.4
465	S	27.3	Very low	30.1	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	79%	0.791	S	S	*	*			trans	-151.5	147.5	159.1	-177.1	0	0	0	0	111.7
466	R	29.1	Very low	29.8	Very low	224 Å²	224	142.9 Å²	142.9	85%	0.845	80%	0.799	S	S	*	*			trans	-140.9	117.6	169.8	-75.6	-170.4	175.2	-161.6	-0.4	107.4
467	R	30.5	Very low	29.5	Very low	213 Å²	213	143.8 Å²	143.8	80%	0.804	80%	0.795	S	S	*	*				62.8	131.6	93.1	-64.9	-178	-174.1	-161	0.8	111.6
468	H	32.3	Very low	29.5	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.745	80%	0.795	S	S	*	*				-148.7	118.2	67.5	-88.1	-87.8	0	0	0	112.5
469	T	31.5	Very low	29	Very low	123 Å²	123	150.3 Å²	150.3	76%	0.755	80%	0.796	S	S	*	*				72.5	117.2	108.4	59.5	0	0	0	0	117
470	L	26.1	Very low	28.8	Very low	162 Å²	162	149.3 Å²	149.3	85%	0.848	80%	0.801	S	S	*	*			trans	-109.2	150.6	169.6	-157.3	167	0	0	0	107.3
471	A	28.6	Very low	28.4	Very low	96 Å²	96	149.6 Å²	149.6	79%	0.793	80%	0.803	S	S	*	*			trans	-120.6	125.4	174.2	0	0	0	0	0	110.5
472	E	28.4	Very low	28.7	Very low	168 Å²	168	149.8 Å²	149.8	79%	0.785	80%	0.804	S	S	*	*			trans	-87.4	150.9	173	-64.4	179.3	104.4	0	0	111.3
473	V	24.2	Very low	28.5	Very low	148 Å²	148	149.5 Å²	149.5	90%	0.897	80%	0.802	S	S	*	*			trans	-126.6	110	151.3	178.3	0	0	0	0	106.8
474	S	27.1	Very low	28.4	Very low	94 Å²	94	148.4 Å²	148.4	66%	0.657	80%	0.799	S	S	*	*			trans	-78.7	139.3	177	-92	0	0	0	0	111.5
475	A	26.3	Very low	28.2	Very low	96 Å²	96	149.5 Å²	149.5	79%	0.793	80%	0.798	S	S	*	*			trans	-131.1	102.9	160.7	0	0	0	0	0	108.9
476	R	26	Very low	28	Very low	222 Å²	222	149.5 Å²	149.5	84%	0.838	79%	0.792	S	S	*	*			trans	-99	133.6	168.1	-70.7	-175.5	178.9	179.1	-0.8	108.7
477	F	23.8	Very low	27.7	Very low	202 Å²	202	145 Å²	145	89%	0.886	79%	0.79	S	S	*	*			trans	-107.3	133.7	164.1	-89.2	-86.6	0	0	0	109.5
478	H	26.5	Very low	27.6	Very low	156 Å²	156	140 Å²	140	72%	0.722	79%	0.788	S	S	*	*			trans	-132.3	131.7	163	-87.2	-74.3	0	0	0	110
479	Q	25.7	Very low	28.4	Very low	175 Å²	175	138 Å²	138	82%	0.818	79%	0.789	S	S	*	*			trans	3.7	133.3	160.4	-65.4	151.7	-65.5	0	0	119.8
480	C	25.2	Very low	28.2	Very low	136 Å²	136	137.2 Å²	137.2	92%	0.919	79%	0.788	S	S	*	*				-150.6	167.2	113.9	-129.9	0	0	0	0	111.5
481	N	25.2	Very low	28.4	Very low	157 Å²	157	137.2 Å²	137.2	84%	0.84	79%	0.789	S	S	*	*			trans	-101.1	165.9	-162.7	-104.6	-4.9	0	0	0	114.9
482	P	47.1	Very low	28.3	Very low	110 Å²	110	136 Å²	136	71%	0.714	79%	0.786	S	S	*	*			trans	-90.4	169.4	-176.3	38.1	-37.5	0	0	0	114
483	P	30.2	Very low	28.3	Very low	116 Å²	116	133.2 Å²	133.2	75%	0.753	79%	0.792	S	S	*	*				-137.4	168.6	127.9	38.5	-27.3	0	0	0	112.1
484	C	26.6	Very low	28.6	Very low	105 Å²	105	131.6 Å²	131.6	71%	0.709	79%	0.787	S	S	*	*			cis	-173.2	162.3	-23.5	-99.9	0	0	0	0	107.6
485	I	24.2	Very low	28.8	Very low	158 Å²	158	131.9 Å²	131.9	81%	0.81	79%	0.789	S	S	*	*			trans	67.6	151.7	148.2	-74.7	162	0	0	0	118.5
486	V	22.9	Very low	28.8	Very low	117 Å²	117	134.7 Å²	134.7	71%	0.709	79%	0.791	S	S	*	*			cis	-166.2	156	-40.9	87.8	0	0	0	0	109.6
487	V	23.9	Very low	29.3	Very low	131 Å²	131	128.4 Å²	128.4	79%	0.794	78%	0.781	S	S	*	*			trans	71.5	135.4	159.1	165.5	0	0	0	0	120.4
488	S	29	Very low	29.7	Very low	108 Å²	108	124 Å²	124	76%	0.755	77%	0.774	S	S	*	*			trans	-97.5	-152.3	170.6	-38.3	0	0	0	0	110
489	P	48.1	Very low	30	Very low	119 Å²	119	123.6 Å²	123.6	77%	0.773	78%	0.776	S	S	*	*			cis	-130.1	174.5	-25.8	40.8	-26.4	0	0	0	113.7
490	S	28.2	Very low	30.1	Very low	105 Å²	105	124.3 Å²	124.3	73%	0.734	78%	0.776	S	S	*	*			trans	178.5	144.4	136.4	52.1	0	0	0	0	115.8
491	D	29.8	Very low	30.1	Very low	162 Å²	162	123.8 Å²	123.8	87%	0.866	77%	0.774	S	S	*	*			trans	30.2	130.8	140.9	-46.9	-29.4	0	0	0	125.2
492	G	26.4	Very low	30.4	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	77%	0.772	S	S	*	*				115.5	124.5	111.2	0	0	0	0	0	121.8
493	A	28.5	Very low	29.3	Very low	108 Å²	108	122.8 Å²	122.8	89%	0.893	78%	0.781	S	S	*	*			trans	62.9	166.4	152.6	0	0	0	0	0	119.1
494	S	29.1	Very low	29.2	Very low	114 Å²	114	122.5 Å²	122.5	80%	0.797	78%	0.782	S	S	*	*			cis	-162.2	168.3	-30.5	-179.3	0	0	0	0	109.8
495	S	32.1	Very low	30	Very low	100 Å²	100	123.6 Å²	123.6	70%	0.699	79%	0.787	S	S	*	*			trans	-42.7	157.3	-179.8	-40.9	0	0	0	0	118.8
496	D	27.2	Very low	30.1	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	78%	0.784	S	S	*	*				-170.9	171.6	98.8	-124.8	-42.8	0	0	0	118.3
497	S	35.8	Very low	31.2	Very low	91 Å²	91	119.8 Å²	119.8	64%	0.636	78%	0.783	S	S	*	*			trans	-92.4	165.9	-155.4	-48.7	0	0	0	0	118.2
498	C	31.5	Very low	31.4	Very low	108 Å²	108	119.4 Å²	119.4	73%	0.73	78%	0.781	S	S	*	*				141.1	123.8	124.2	-80.8	0	0	0	0	120
499	L	33	Very low	31.3	Very low	149 Å²	149	120.3 Å²	120.3	78%	0.78	78%	0.777	S	S	*	*			trans	60.3	162.5	131.4	-57.8	-179	0	0	0	121.7
500	K	29.1	Very low	30.2	Very low	189 Å²	189	123.1 Å²	123.1	82%	0.822	78%	0.78	S	S	*	*			cis	178.7	140.8	-40	-126.9	-166	-165.7	176.9	0	108.2
501	S	25	Very low	30.1	Very low	125 Å²	125	122.8 Å²	122.8	87%	0.874	78%	0.777	S	S	*	*			trans	-176.6	168.6	152.6	52.3	0	0	0	0	113.1
502	S	30.9	Very low	29.9	Very low	113 Å²	113	119.1 Å²	119.1	79%	0.79	77%	0.77	S	S	*	*			trans	-170.4	153.4	-163.6	54.6	0	0	0	0	113.4
503	C	23.2	Very low	29.9	Very low	133 Å²	133	122.7 Å²	122.7	90%	0.899	78%	0.777	S	S	*	*			trans	-167.7	161	144.9	-127.8	0	0	0	0	115
504	S	28.7	Very low	29.8	Very low	110 Å²	110	120.4 Å²	120.4	77%	0.769	76%	0.764	S	S	*	*			trans	-112.4	179	171.4	-45.9	0	0	0	0	110
505	P	43.5	Very low	29.7	Very low	128 Å²	128	124.1 Å²	124.1	83%	0.831	77%	0.768	S	S	*	*				-148.6	-171.9	74	38.5	-17.2	0	0	0	115.7
506	A	26.5	Very low	29.5	Very low	90 Å²	90	126.7 Å²	126.7	74%	0.744	77%	0.771	S	S	*	*			trans	-110.6	-152	174	0	0	0	0	0	109.2
507	P	46.3	Very low	29.6	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	76%	0.761	S	S	*	*			cis	-146.7	177.8	6	39.8	-16.8	0	0	0	119.2
508	T	26.9	Very low	29.2	Very low	122 Å²	122	124.5 Å²	124.5	75%	0.748	76%	0.764	S	S	*	*			trans	66.8	164.3	147.2	44.2	0	0	0	0	120.6
509	L	27.1	Very low	29	Very low	127 Å²	127	126.3 Å²	126.3	67%	0.665	77%	0.765	S	S	*	*			cis	-160.5	147.3	4.2	-125.3	160.2	0	0	0	111.8
510	Q	25.3	Very low	28.7	Very low	179 Å²	179	126.4 Å²	126.4	84%	0.836	77%	0.766	S	S	*	*			trans	58.9	167.9	151.1	-93.5	166.6	6.1	0	0	119.8
511	S	25.7	Very low	28.6	Very low	97 Å²	97	121.1 Å²	121.1	68%	0.678	76%	0.757	S	S	*	*			cis	-160	128.1	-7.4	160.4	0	0	0	0	112.8
512	A	25.7	Very low	28.8	Very low	86 Å²	86	120.9 Å²	120.9	71%	0.711	76%	0.756	S	S	*	*			trans	46.4	168.5	137.7	0	0	0	0	0	125.2
513	V	27.2	Very low	28.6	Very low	147 Å²	147	127 Å²	127	89%	0.891	76%	0.761	S	S	*	*			trans	70	137.3	168.4	-153	0	0	0	0	116.1
514	G	26.6	Very low	28.9	Very low	60 Å²	60	124.5 Å²	124.5	62%	0.619	75%	0.75	S	S	*	*			cis	159.7	148.7	-11.1	0	0	0	0	0	112.7
515	E	26.6	Very low	29	Very low	192 Å²	192	128.8 Å²	128.8	90%	0.897	76%	0.758	S	S	*	*			trans	61.9	167.1	163.5	-64.2	-175.3	143.8	0	0	118.9
516	M	28.3	Very low	28.4	Very low	153 Å²	153	126.7 Å²	126.7	75%	0.754	76%	0.76	S	S	*	*			cis	-168.9	142.1	-40.8	174	160.2	173.1	0	0	109.6
517	S	28.4	Very low	28.4	Very low	89 Å²	89	126.4 Å²	126.4	62%	0.622	77%	0.765	S	S	*	*			trans	65.8	165.4	159.3	-76.7	0	0	0	0	118.3
518	T	27.5	Very low	27.7	Very low	112 Å²	112	126.8 Å²	126.8	69%	0.687	78%	0.777	S	S	*	*			cis	-159.7	143.5	-8.7	19.4	0	0	0	0	112.1
519	L	27.6	Very low	27.8	Very low	146 Å²	146	124.6 Å²	124.6	76%	0.764	78%	0.779	S	S	*	*			trans	69.4	138.6	135.9	-69	170.2	0	0	0	125.4
520	L	26.9	Very low	27.9	Very low	151 Å²	151	126.8 Å²	126.8	79%	0.791	79%	0.791	S	S	*	*			trans	83.9	106.3	135.9	-73.3	165.1	0	0	0	123.8
521	A	26.6	Very low	28.9	Very low	78 Å²	78	123.7 Å²	123.7	65%	0.645	79%	0.786	S	S	*	*				88.5	124.5	111.3	0	0	0	0	0	123.5
522	S	28.6	Very low	29	Very low	120 Å²	120	124 Å²	124	84%	0.839	80%	0.795	S	S	*	*			trans	70.3	166.2	153	84.1	0	0	0	0	116.5
523	R	26.4	Very low	29.2	Very low	240 Å²	240	123.9 Å²	123.9	91%	0.906	80%	0.802	S	S	*	*			cis	-145.2	164.8	0.7	-166.6	169.6	171.7	150.2	-2.4	109.7
524	A	30.3	Very low	29.3	Very low	81 Å²	81	121.6 Å²	121.6	67%	0.669	80%	0.798	S	S	*	*			trans	-93.5	158.4	176.3	0	0	0	0	0	114.1
525	E	31.3	Very low	30.1	Very low	201 Å²	201	123.8 Å²	123.8	94%	0.939	80%	0.802	S	S	*	*			trans	65.9	138.2	159.8	-55.9	-152.5	133.4	0	0	122.2
526	G	29.5	Very low	30.1	Very low	83 Å²	83	122.5 Å²	122.5	86%	0.856	80%	0.8	S	S	*	*			trans	129.6	119.2	135.7	0	0	0	0	0	118
527	G	27.9	Very low	30	Very low	84 Å²	84	118.9 Å²	118.9	87%	0.866	79%	0.794	S	S	*	*			trans	122.7	121.2	151.2	0	0	0	0	0	117.9
528	A	30.2	Very low	29.9	Very low	114 Å²	114	122.4 Å²	122.4	94%	0.942	81%	0.805	S	S	*	*			trans	-66.9	157.9	-175.9	0	0	0	0	0	117.2
529	G	28.9	Very low	29.8	Very low	76 Å²	76	121.8 Å²	121.8	78%	0.784	81%	0.805	S	S	*	*			trans	179.7	132.6	166.2	0	0	0	0	0	115
530	L	30.9	Very low	29.7	Very low	174 Å²	174	119.3 Å²	119.3	91%	0.911	80%	0.8	S	S	*	*			trans	-121.8	165.8	164.7	-79.8	173	0	0	0	107.4
531	P	45.7	Very low	29.7	Very low	113 Å²	113	120.3 Å²	120.3	73%	0.734	80%	0.801	S	S	*	*			cis	-136.2	-175.8	11.4	43.1	-26.6	0	0	0	116.1
532	A	28.2	Very low	29.7	Very low	105 Å²	105	123.5 Å²	123.5	87%	0.868	81%	0.806	S	S	*	*			trans	71.5	139.6	153	0	0	0	0	0	119.9
533	G	29.5	Very low	29.6	Very low	83 Å²	83	123.4 Å²	123.4	86%	0.856	80%	0.8	S	S	*	*			trans	136	96.8	170.7	0	0	0	0	0	115
534	A	30	Very low	29.7	Very low	98 Å²	98	118 Å²	118	81%	0.81	80%	0.796	S	S	*	*			trans	-119.8	168.6	157.1	0	0	0	0	0	106.9
535	P	42.3	Very low	29.5	Very low	107 Å²	107	121.8 Å²	121.8	70%	0.695	80%	0.8	S	S	*	*			cis	-141.4	-163.9	16	32.5	-7	0	0	0	115
536	L	27.2	Very low	29.1	Very low	164 Å²	164	117.6 Å²	117.6	86%	0.859	79%	0.788	S	S	*	*			trans	73.2	156	162.6	-53.8	175.1	0	0	0	117.4
537	A	26.2	Very low	28.9	Very low	77 Å²	77	121.7 Å²	121.7	64%	0.636	79%	0.785	S	S	*	*			cis	-169	167.3	-28.5	0	0	0	0	0	110.4
538	L	26.7	Very low	28.8	Very low	163 Å²	163	123.3 Å²	123.3	85%	0.853	78%	0.783	S	S	*	*			trans	68.9	142.1	169.6	-58.2	165.9	0	0	0	114.9
539	S	24.2	Very low	28.5	Very low	99 Å²	99	123 Å²	123	69%	0.692	77%	0.774	S	S	*	*			cis	75.4	128.5	43.3	-148.7	0	0	0	0	111.9
540	S	26	Very low	28.4	Very low	94 Å²	94	127.8 Å²	127.8	66%	0.657	78%	0.781	S	S	*	*			cis	-173.1	157.4	4	21.5	0	0	0	0	113.3
541	H	26.3	Very low	28.3	Very low	173 Å²	173	125.2 Å²	125.2	80%	0.801	78%	0.775	S	S	*	*			trans	76.7	143.8	147.6	-90.8	-116.2	0	0	0	124
542	L	26.3	Very low	27.2	Very low	145 Å²	145	124.8 Å²	124.8	76%	0.759	78%	0.78	S	S	*	*			trans	79.6	81.8	146	-69.1	163.7	0	0	0	124
543	V	27.8	Very low	27.2	Very low	117 Å²	117	126 Å²	126	71%	0.709	78%	0.777	S	S	*	*				21	129.6	112.2	-175.5	0	0	0	0	119.6
544	P	28.1	Very low	26.9	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	77%	0.772	S	S	*	*				-114.9	174.6	117.9	-12.2	31.2	0	0	0	116.3
545	Q	25.9	Very low	26.8	Very low	161 Å²	161	132 Å²	132	75%	0.752	78%	0.775	S	S	*	*			trans	-92.2	173.1	-179.6	-59.7	173.9	-6.4	0	0	110.8
546	T	23.4	Very low	26.1	Very low	113 Å²	113	135.8 Å²	135.8	69%	0.693	78%	0.783	S	S	*	*			cis	-156.9	131.3	43	46.7	0	0	0	0	114.1
547	Q	25.4	Very low	26.5	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	77%	0.773	S	S	*	*				64.2	113	110.7	-58.6	-171.1	2.8	0	0	120.4
548	S	24.9	Very low	26.6	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	78%	0.781	S	S	*	*				-176.1	152.1	123.4	40.3	0	0	0	0	110.3
549	S	25.3	Very low	26.8	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	77%	0.772	S	S	*	*				171.6	96.1	-57.8	50.8	0	0	0	0	107.5
550	L	25.4	Very low	27.6	Very low	175 Å²	175	135 Å²	135	92%	0.916	76%	0.756	S	S	*	*			trans	-142	160.9	167.3	-88	-179.2	0	0	0	109
551	P	28.6	Very low	27.8	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-89.3	151	-130.9	31.9	-38.2	0	0	0	116.4
552	A	23.7	Very low	28.4	Very low	103 Å²	103	125.2 Å²	125.2	85%	0.851	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-89.4	141.9	166.9	0	0	0	0	0	111.4
553	V	26.8	Very low	28.9	Very low	130 Å²	130	121.9 Å²	121.9	79%	0.788	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-80.5	137.2	177.4	179.6	0	0	0	0	110.5
554	S	23.4	Very low	29.6	Very low	108 Å²	108	121 Å²	121	76%	0.755	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-73.3	133.4	-177.4	-173.5	0	0	0	0	112.7
555	F	28.2	Very low	30	Very low	200 Å²	200	118.2 Å²	118.2	88%	0.877	67%	0.67	S	S	*	*			trans	-94.8	115.8	173.8	-84.9	-103	0	0	0	110.9
556	Q	28.5	Very low	30.7	Very low	187 Å²	187	113 Å²	113	87%	0.874	65%	0.647	S	S	*	*			trans	-91.3	117.3	164.1	-79.3	-168.4	-27.5	0	0	111	G558	Q556-G558 PolarHBondContact O-N 2.72Å
557	E	34.8	Very low	31.6	Very low	137 Å²	137	110.9 Å²	110.9	64%	0.64	63%	0.634	S	S	*	*			trans	-77.8	98.6	-176.6	-174.7	-175.7	-131.2	0	0	112	R559	E557-R559 HydrophobicContact CG-CG 4.1Å; E557-R559 PolarHBondContact O-N 2.75Å; E557-R559 IonicContact OE2-CZ 2.79Å; E557-R559 VanDerWaalsContact OE2-CZ 3.22Å; E557-R559 IonicContact OE2-NE 2.65Å; E557-R559 PolarHBondContact OE2-NE 2.94Å; E557-R559 IonicContact OE2-NH2 2.75Å; E557-R559 PolarHBondContact OE2-NH2 3.4Å
558	G	28.8	Very low	32.2	Very low	77 Å²	77	109.7 Å²	109.7	79%	0.794	63%	0.629	S	S	*	*			trans	-71	85.2	172.8	0	0	0	0	0	112.9	Q556	Q556-G558 PolarHBondContact O-N 2.72Å
559	R	31.1	Very low	32.9	Very low	176 Å²	176	105.7 Å²	105.7	66%	0.664	61%	0.607	S	S	*	*			trans	-61.5	143.2	-177.5	-66.8	-174.9	177.9	-179.9	-0.3	113.2	E557	E557-R559 HydrophobicContact CG-CG 4.1Å; E557-R559 PolarHBondContact O-N 2.75Å; E557-R559 IonicContact OE2-CZ 2.79Å; E557-R559 VanDerWaalsContact OE2-CZ 3.22Å; E557-R559 IonicContact OE2-NE 2.65Å; E557-R559 PolarHBondContact OE2-NE 2.94Å; E557-R559 IonicContact OE2-NH2 2.75Å; E557-R559 PolarHBondContact OE2-NH2 3.4Å
560	R	41.3	Very low	33.9	Very low	95 Å²	95	102.7 Å²	102.7	36%	0.358	58%	0.582	S	S	.	*			trans	-109.7	167	-162.4	-169.7	177.8	-167.2	-120.8	11.1	111.9	G184 S562 D563	G184-R560 PolarHBondContact O-NH2 2.79Å; G184-R560 VanDerWaalsContact O-NH2 3.09Å; R560-S562 PolarHBondContact NH1-OG 3.35Å; R560-D563 WeakPolarHBondContact CB-OD2 3.45Å; R560-D563 IonicContact CZ-OD1 3.8Å; R560-D563 IonicContact NH1-OD1 2.84Å; R560-D563 PolarHBondContact NH1-OD1 3.08Å
561	A	29.4	Very low	34.8	Very low	30 Å²	30	100.2 Å²	100.2	25%	0.248	56%	0.563	C	S	.	*	S	Bend	trans	-131.2	36.8	-169.2	0	0	0	0	0	114.4	N36 F37	N36-A561 HydrophobicContact CB-CB 4.22Å; N36-A561 WeakPolarHBondContact CB-O 3.35Å; N36-A561 VanDerWaalsContact CG-O 3.27Å; N36-A561 PolarHBondContact ND2-O 2.69Å; F37-A561 HydrophobicContact CD2-CB 3.74Å; F37-A561 HydrophobicContact CE2-CB 3.14Å; F37-A561 HydrophobicContact CZ-CB 3.69Å
562	S	38.5	Very low	35.8	Very low	33 Å²	33	97 Å²	97	23%	0.231	55%	0.548	C	S	.	.			trans	-140.8	0.9	177.4	49.7	0	0	0	0	114.7	R560 T564 L566	R560-S562 PolarHBondContact NH1-OG 3.35Å; S562-T564 VanDerWaalsContact C-N 3.34Å; S562-T564 PolarHBondContact O-N 2.78Å; S562-L566 VanDerWaalsContact O-CB 3.32Å; S562-L566 WeakPolarHBondContact O-CB 3.35Å; S562-L566 PolarHBondContact O-N 3.31Å
563	D	37.8	Very low	36.9	Very low	74 Å²	74	92.8 Å²	92.8	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-82	-9.9	-163.1	-52.3	-46.7	0	0	0	114.5	R560 T567	R560-D563 WeakPolarHBondContact CB-OD2 3.45Å; R560-D563 IonicContact CZ-OD1 3.8Å; R560-D563 IonicContact NH1-OD1 2.84Å; R560-D563 PolarHBondContact NH1-OD1 3.08Å; D563-T567 WeakPolarHBondContact O-CB 3.37Å; D563-T567 PolarHBondContact O-OG1 3.46Å
564	T	41.5	Very low	38.4	Very low	100 Å²	100	89 Å²	89	61%	0.613	48%	0.482	S	S	*	.	H	α-helix	trans	-74.2	-50.2	173.3	44.8	0	0	0	0	112.2	S562	S562-T564 VanDerWaalsContact C-N 3.34Å; S562-T564 PolarHBondContact O-N 2.78Å
565	S	36.5	Very low	39.9	Very low	66 Å²	66	89.7 Å²	89.7	46%	0.462	47%	0.473	S	S	.	.	H	α-helix	trans	-80.6	-44.3	-179	57.5	0	0	0	0	112.7	T567 Q568 G569	S565-T567 VanDerWaalsContact C-N 3.27Å; S565-T567 PolarHBondContact O-N 3.04Å; S565-Q568 PolarHBondContact O-N 3.16Å; S565-G569 PolarHBondContact O-N 3.04Å
566	L	40.3	Very low	41.2	Very low	52 Å²	52	83.7 Å²	83.7	27%	0.272	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-40.2	-176.1	-163	74.6	0	0	0	111.8	S562 Q568 L570	S562-L566 VanDerWaalsContact O-CB 3.32Å; S562-L566 WeakPolarHBondContact O-CB 3.35Å; S562-L566 PolarHBondContact O-N 3.31Å; L566-Q568 VanDerWaalsContact C-N 3.35Å; L566-Q568 PolarHBondContact O-N 3.37Å; L566-L570 WeakPolarHBondContact O-CB 3.36Å; L566-L570 PolarHBondContact O-N 3.49Å
567	T	42.8	Very low	42.5	Very low	69 Å²	69	76.4 Å²	76.4	42%	0.423	41%	0.414	S	S	.	.	H	α-helix	trans	-68.9	-31.9	177.6	-51.9	0	0	0	0	112.4	D563 S565 K571	D563-T567 WeakPolarHBondContact O-CB 3.37Å; D563-T567 PolarHBondContact O-OG1 3.46Å; S565-T567 VanDerWaalsContact C-N 3.27Å; S565-T567 PolarHBondContact O-N 3.04Å; T567-K571 HydrophobicContact CG2-CD 4.36Å; T567-K571 WeakPolarHBondContact O-CB 3.47Å; T567-K571 WeakPolarHBondContact O-CD 3.21Å; T567-K571 WeakPolarHBondContact O-CG 3.47Å; T567-K571 PolarHBondContact O-N 2.88Å
568	Q	39.3	Very low	43.4	Very low	144 Å²	144	77.2 Å²	77.2	67%	0.673	41%	0.412	S	S	*	.	H	α-helix	trans	-79.4	-41.7	178.2	-169.4	168.6	-1.3	0	0	111.6	S565 L566 K571 A572	S565-Q568 PolarHBondContact O-N 3.16Å; L566-Q568 VanDerWaalsContact C-N 3.35Å; L566-Q568 PolarHBondContact O-N 3.37Å; Q568-K571 PolarHBondContact O-N 3.48Å; Q568-A572 WeakPolarHBondContact O-CB 3.46Å; Q568-A572 PolarHBondContact O-N 3.48Å
569	G	38.8	Very low	44.5	Very low	35 Å²	35	78.9 Å²	78.9	36%	0.361	40%	0.397	S	S	.	.	H	α-helix	trans	-58.6	-49.3	171.7	0	0	0	0	0	112.1	S565 K571 A572 F573	S565-G569 PolarHBondContact O-N 3.04Å; G569-K571 VanDerWaalsContact C-N 3.32Å; G569-K571 PolarHBondContact O-N 3.17Å; G569-A572 WeakPolarHBondContact O-CB 3.39Å; G569-A572 PolarHBondContact O-N 3.35Å; G569-A572 VanDerWaalsContact O-N 3.12Å; G569-F573 WeakPolarHBondContact O-CB 3.45Å; G569-F573 PolarHBondContact O-N 3.29Å
570	L	46.9	Very low	45	Very low	45 Å²	45	73 Å²	73	24%	0.236	38%	0.378	C	S	.	.	H	α-helix	trans	-64.7	-33.4	177.2	-172.8	62.8	0	0	0	112.7	P187 L221 L566 F573 R574	P187-L570 HydrophobicContact CG-CD1 4.36Å; P187-L570 HydrophobicContact CG-CD2 4.11Å; L221-L570 HydrophobicContact CD1-CD1 4.25Å; L566-L570 WeakPolarHBondContact O-CB 3.36Å; L566-L570 PolarHBondContact O-N 3.49Å; L570-F573 HydrophobicContact CD1-CD1 4.21Å; L570-R574 WeakPolarHBondContact O-CB 3.48Å; L570-R574 WeakPolarHBondContact O-CD 3.44Å; L570-R574 WeakPolarHBondContact O-CG 3.41Å; L570-R574 PolarHBondContact O-N 3.05Å
571	K	44.3	Very low	45.2	Very low	122 Å²	122	73.1 Å²	73.1	53%	0.53	39%	0.39	S	S	.	.	H	α-helix	trans	-67.6	-41.7	171.2	-78.9	169.8	-177.3	173.1	0	111.9	T567 Q568 G569 R574 Q575	T567-K571 HydrophobicContact CG2-CD 4.36Å; T567-K571 WeakPolarHBondContact O-CB 3.47Å; T567-K571 WeakPolarHBondContact O-CD 3.21Å; T567-K571 WeakPolarHBondContact O-CG 3.47Å; T567-K571 PolarHBondContact O-N 2.88Å; Q568-K571 PolarHBondContact O-N 3.48Å; G569-K571 VanDerWaalsContact C-N 3.32Å; G569-K571 PolarHBondContact O-N 3.17Å; K571-R574 PolarHBondContact O-N 3.21Å; K571-Q575 WeakPolarHBondContact O-CG 3.41Å; K571-Q575 PolarHBondContact O-N 2.97Å
572	A	48.4	Very low	45.9	Very low	55 Å²	55	81.8 Å²	81.8	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-46.4	175.6	0	0	0	0	0	111.2	Q568 G569 R574 Q575 Q576	Q568-A572 WeakPolarHBondContact O-CB 3.46Å; Q568-A572 PolarHBondContact O-N 3.48Å; G569-A572 WeakPolarHBondContact O-CB 3.39Å; G569-A572 PolarHBondContact O-N 3.35Å; G569-A572 VanDerWaalsContact O-N 3.12Å; A572-R574 PolarHBondContact O-N 2.96Å; A572-Q575 PolarHBondContact O-N 3Å; A572-Q575 VanDerWaalsContact O-N 3.15Å; A572-Q576 WeakPolarHBondContact O-CB 3.46Å; A572-Q576 PolarHBondContact O-N 3.33Å
573	F	47.4	Very low	46	Very low	14 Å²	14	84.1 Å²	84.1	6%	0.061	43%	0.429	C	S	.	.	H	α-helix	trans	-54.5	-52.2	173	-173.3	-121.7	0	0	0	112	F111 L221 G569 L570 Q575 Q576 L577	F111-F573 HydrophobicContact CD2-CD2 4.28Å; F111-F573 HydrophobicContact CD2-CE2 4.2Å; F111-F573 HydrophobicContact CE2-CB 4.12Å; F111-F573 HydrophobicContact CE2-CD1 4.43Å; F111-F573 AromaticContact CE2-CD2 3.24Å; F111-F573 HydrophobicContact CE2-CD2 3.24Å; F111-F573 AromaticContact CE2-CE2 3.56Å; F111-F573 HydrophobicContact CE2-CE2 3.56Å; F111-F573 AromaticContact CE2-CG 3.71Å; F111-F573 HydrophobicContact CE2-CG 3.71Å; F111-F573 HydrophobicContact CE2-CZ 4.26Å; F111-F573 HydrophobicContact CZ-CB 3.9Å; F111-F573 AromaticContact CZ-CD2 3.44Å; F111-F573 HydrophobicContact CZ-CD2 3.44Å; F111-F573 VanDerWaalsContact CZ-CD2 3.44Å; F111-F573 HydrophobicContact CZ-CE2 4.15Å; F111-F573 AromaticContact CZ-CG 3.92Å; F111-F573 HydrophobicContact CZ-CG 3.92Å; L221-F573 HydrophobicContact CD1-CD1 4.4Å; L221-F573 HydrophobicContact CD1-CE1 3.88Å; L221-F573 HydrophobicContact CG-CE1 4.05Å; G569-F573 WeakPolarHBondContact O-CB 3.45Å; G569-F573 PolarHBondContact O-N 3.29Å; L570-F573 HydrophobicContact CD1-CD1 4.21Å; F573-Q575 VanDerWaalsContact C-N 3.28Å; F573-Q575 PolarHBondContact O-N 3.04Å; F573-Q576 PolarHBondContact O-N 3.2Å; F573-Q576 VanDerWaalsContact O-N 3.16Å; F573-L577 HydrophobicContact CD1-CD1 4.11Å; F573-L577 HydrophobicContact CD2-CD1 4.14Å; F573-L577 HydrophobicContact CD2-CG 4.03Å; F573-L577 HydrophobicContact CE1-CD1 3.65Å; F573-L577 HydrophobicContact CE2-CD1 3.69Å; F573-L577 HydrophobicContact CE2-CD2 4.13Å; F573-L577 HydrophobicContact CE2-CG 3.91Å; F573-L577 HydrophobicContact CG-CD1 4.36Å; F573-L577 HydrophobicContact CG-CG 4.43Å; F573-L577 HydrophobicContact CZ-CD1 3.45Å; F573-L577 VanDerWaalsContact CZ-CD1 3.45Å; F573-L577 HydrophobicContact CZ-CG 4.2Å; F573-L577 WeakPolarHBondContact O-CB 3.25Å; F573-L577 WeakPolarHBondContact O-CG 3.43Å; F573-L577 PolarHBondContact O-N 3.23Å
574	R	59.1	Low	46.4	Very low	51 Å²	51	87.4 Å²	87.4	19%	0.192	44%	0.44	C	S	.	.	H	α-helix	trans	-55.9	-40.8	175.7	-77.2	165.7	168.6	177.2	-2.6	112.3	D224 A225 L570 K571 A572 R578	D224-R574 IonicContact OD1-CZ 2.62Å; D224-R574 IonicContact OD1-NE 3.56Å; D224-R574 PolarHBondContact OD1-NE 3.31Å; D224-R574 IonicContact OD1-NH2 2.66Å; D224-R574 PolarHBondContact OD1-NH2 3.35Å; D224-R574 IonicContact OD2-NE 3.22Å; A225-R574 PolarHBondContact O-NH2 3.12Å; L570-R574 WeakPolarHBondContact O-CB 3.48Å; L570-R574 WeakPolarHBondContact O-CD 3.44Å; L570-R574 WeakPolarHBondContact O-CG 3.41Å; L570-R574 PolarHBondContact O-N 3.05Å; K571-R574 PolarHBondContact O-N 3.21Å; A572-R574 PolarHBondContact O-N 2.96Å; R574-R578 WeakPolarHBondContact O-CB 3.5Å; R574-R578 WeakPolarHBondContact O-CD 3.49Å; R574-R578 WeakPolarHBondContact O-CG 3.3Å; R574-R578 PolarHBondContact O-N 2.62Å; R574-R578 PolarHBondContact O-NE 3.12Å
575	Q	54.2	Low	46.3	Very low	121 Å²	121	85.1 Å²	85.1	57%	0.565	44%	0.437	S	S	*	.	H	α-helix	trans	-72	-42	176.3	-71.7	-174.8	11.3	0	0	112.5	K571 A572 F573 R578 K579	K571-Q575 WeakPolarHBondContact O-CG 3.41Å; K571-Q575 PolarHBondContact O-N 2.97Å; A572-Q575 PolarHBondContact O-N 3Å; A572-Q575 VanDerWaalsContact O-N 3.15Å; F573-Q575 VanDerWaalsContact C-N 3.28Å; F573-Q575 PolarHBondContact O-N 3.04Å; Q575-R578 PolarHBondContact O-N 3.34Å; Q575-K579 VanDerWaalsContact O-CG 3.29Å; Q575-K579 WeakPolarHBondContact O-CG 3.36Å; Q575-K579 PolarHBondContact O-N 3.01Å
576	Q	56.4	Low	46.3	Very low	75 Å²	75	88.9 Å²	88.9	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-74.6	-38.9	-173.8	-166.5	66.2	-4.8	0	0	112.3	T115 A572 F573 K579 N580	T115-Q576 HydrophobicContact CG2-CG 3.99Å; A572-Q576 WeakPolarHBondContact O-CB 3.46Å; A572-Q576 PolarHBondContact O-N 3.33Å; F573-Q576 PolarHBondContact O-N 3.2Å; F573-Q576 VanDerWaalsContact O-N 3.16Å; Q576-K579 PolarHBondContact O-N 3.01Å; Q576-N580 WeakPolarHBondContact O-CB 3.33Å; Q576-N580 PolarHBondContact O-N 2.95Å
577	L	53.7	Low	46.2	Very low	33 Å²	33	93 Å²	93	17%	0.173	47%	0.472	C	S	.	.	H	α-helix	trans	-63.6	-40.7	170.4	-68.1	-168.8	0	0	0	112.1	G219 F573 K579 N580 T581	G219-L577 VanDerWaalsContact O-CD1 3.31Å; G219-L577 WeakPolarHBondContact O-CD1 3.5Å; G219-L577 VanDerWaalsContact O-CD2 3.22Å; G219-L577 WeakPolarHBondContact O-CD2 3.42Å; F573-L577 HydrophobicContact CD1-CD1 4.11Å; F573-L577 HydrophobicContact CD2-CD1 4.14Å; F573-L577 HydrophobicContact CD2-CG 4.03Å; F573-L577 HydrophobicContact CE1-CD1 3.65Å; F573-L577 HydrophobicContact CE2-CD1 3.69Å; F573-L577 HydrophobicContact CE2-CD2 4.13Å; F573-L577 HydrophobicContact CE2-CG 3.91Å; F573-L577 HydrophobicContact CG-CD1 4.36Å; F573-L577 HydrophobicContact CG-CG 4.43Å; F573-L577 HydrophobicContact CZ-CD1 3.45Å; F573-L577 VanDerWaalsContact CZ-CD1 3.45Å; F573-L577 HydrophobicContact CZ-CG 4.2Å; F573-L577 WeakPolarHBondContact O-CB 3.25Å; F573-L577 WeakPolarHBondContact O-CG 3.43Å; F573-L577 PolarHBondContact O-N 3.23Å; L577-K579 VanDerWaalsContact C-N 3.31Å; L577-K579 PolarHBondContact O-N 3.45Å; L577-N580 PolarHBondContact O-N 2.91Å; L577-T581 WeakPolarHBondContact O-CB 3.26Å; L577-T581 WeakPolarHBondContact O-CG2 3.4Å; L577-T581 PolarHBondContact O-N 2.84Å; L577-T581 PolarHBondContact O-OG1 2.85Å
578	R	54.2	Low	46	Very low	155 Å²	155	92.7 Å²	92.7	59%	0.585	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-30.1	175.5	-70.8	172.5	-163.6	-173.9	4.2	112.4	D224 R574 Q575 T581 R582	D224-R578 IonicContact OD2-NH2 3.15Å; D224-R578 PolarHBondContact OD2-NH2 3.18Å; R574-R578 WeakPolarHBondContact O-CB 3.5Å; R574-R578 WeakPolarHBondContact O-CD 3.49Å; R574-R578 WeakPolarHBondContact O-CG 3.3Å; R574-R578 PolarHBondContact O-N 2.62Å; R574-R578 PolarHBondContact O-NE 3.12Å; Q575-R578 PolarHBondContact O-N 3.34Å; R578-T581 PolarHBondContact O-OG1 3.42Å; R578-R582 VanDerWaalsContact O-CB 3.3Å; R578-R582 WeakPolarHBondContact O-CB 3.15Å; R578-R582 PolarHBondContact O-N 3.34Å
579	K	52.4	Low	46	Very low	112 Å²	112	92.9 Å²	92.9	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-68.6	-58.2	168.7	-72.6	164.7	-176.2	173.8	0	110.5	Q575 Q576 L577 T581 R582 T583	Q575-K579 VanDerWaalsContact O-CG 3.29Å; Q575-K579 WeakPolarHBondContact O-CG 3.36Å; Q575-K579 PolarHBondContact O-N 3.01Å; Q576-K579 PolarHBondContact O-N 3.01Å; L577-K579 VanDerWaalsContact C-N 3.31Å; L577-K579 PolarHBondContact O-N 3.45Å; K579-T581 VanDerWaalsContact C-N 3.35Å; K579-T581 PolarHBondContact O-N 3.29Å; K579-R582 PolarHBondContact O-N 3.38Å; K579-T583 PolarHBondContact O-N 2.79Å; K579-T583 PolarHBondContact O-OG1 3.31Å
580	N	42	Very low	45.8	Very low	51 Å²	51	98.4 Å²	98.4	27%	0.273	51%	0.509	S	S	.	.	H	α-helix	trans	-59	-39.9	-175.1	-83.5	-8.8	0	0	0	113.5	Q576 L577 K584	Q576-N580 WeakPolarHBondContact O-CB 3.33Å; Q576-N580 PolarHBondContact O-N 2.95Å; L577-N580 PolarHBondContact O-N 2.91Å; N580-K584 WeakPolarHBondContact O-CB 3.26Å; N580-K584 WeakPolarHBondContact O-CG 3.46Å; N580-K584 PolarHBondContact O-N 3.33Å
581	T	45.9	Very low	45.2	Very low	99 Å²	99	105.9 Å²	105.9	61%	0.607	54%	0.539	S	S	*	.	H	α-helix	trans	-65	-39.7	173.6	47	0	0	0	0	112.5	L577 R578 K579 G585	L577-T581 WeakPolarHBondContact O-CB 3.26Å; L577-T581 WeakPolarHBondContact O-CG2 3.4Å; L577-T581 PolarHBondContact O-N 2.84Å; L577-T581 PolarHBondContact O-OG1 2.85Å; R578-T581 PolarHBondContact O-OG1 3.42Å; K579-T581 VanDerWaalsContact C-N 3.35Å; K579-T581 PolarHBondContact O-N 3.29Å; T581-G585 PolarHBondContact O-N 3.1Å
582	R	43.9	Very low	45.1	Very low	211 Å²	211	107.6 Å²	107.6	80%	0.796	55%	0.552	S	S	*	*	H	α-helix	trans	-71	-39.8	178.2	-159.3	173.1	-167.5	175.7	3.3	112.5	R578 K579 L586	R578-R582 VanDerWaalsContact O-CB 3.3Å; R578-R582 WeakPolarHBondContact O-CB 3.15Å; R578-R582 PolarHBondContact O-N 3.34Å; K579-R582 PolarHBondContact O-N 3.38Å; R582-L586 PolarHBondContact O-N 3.32Å; R582-L586 VanDerWaalsContact O-N 3.16Å
583	T	40.3	Very low	44.2	Very low	82 Å²	82	114.9 Å²	114.9	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-68.7	-44.9	177.4	-43.1	0	0	0	0	111.9	K579 L586 L587	K579-T583 PolarHBondContact O-N 2.79Å; K579-T583 PolarHBondContact O-OG1 3.31Å; T583-L586 PolarHBondContact O-N 2.75Å; T583-L587 PolarHBondContact O-N 2.65Å
584	K	46.1	Very low	43.3	Very low	144 Å²	144	117.3 Å²	117.3	63%	0.626	60%	0.603	S	S	*	*	H	α-helix	trans	-69.9	-31.4	176.6	-69.1	-173.9	178	-177	0	112.2	N580	N580-K584 WeakPolarHBondContact O-CB 3.26Å; N580-K584 WeakPolarHBondContact O-CG 3.46Å; N580-K584 PolarHBondContact O-N 3.33Å
585	G	40.3	Very low	41.9	Very low	52 Å²	52	123.1 Å²	123.1	54%	0.536	64%	0.637	S	S	.	*	H	α-helix	trans	-67.4	-34.9	174.9	0	0	0	0	0	114.4	T581	T581-G585 PolarHBondContact O-N 3.1Å
586	L	35	Very low	40.7	Very low	145 Å²	145	124.3 Å²	124.3	76%	0.759	65%	0.653	S	S	*	*	H	α-helix	trans	-78.4	-27.3	-177.9	-162.6	67.3	0	0	0	113.4	R582 T583 G588	R582-L586 PolarHBondContact O-N 3.32Å; R582-L586 VanDerWaalsContact O-N 3.16Å; T583-L586 PolarHBondContact O-N 2.75Å; L586-G588 VanDerWaalsContact C-N 3.33Å
587	L	39.7	Very low	39.5	Very low	139 Å²	139	131.6 Å²	131.6	73%	0.728	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-5.6	179.8	-69.8	170.5	0	0	0	114	T583	T583-L587 PolarHBondContact O-N 2.65Å
588	G	36.8	Very low	38.3	Very low	62 Å²	62	138.9 Å²	138.9	64%	0.639	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-11.4	-175.2	0	0	0	0	0	116.5	L586	L586-G588 VanDerWaalsContact C-N 3.33Å
589	L	39.7	Very low	37.1	Very low	148 Å²	148	135.5 Å²	135.5	78%	0.775	72%	0.715	S	S	*	*	S	Bend	trans	-104.7	-6.5	-168	-68.5	174.5	0	0	0	115.7	K591	L589-K591 PolarHBondContact O-N 3.45Å
590	N	34.6	Very low	36.1	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	32.5	-174.2	-73.7	-16.7	0	0	0	114.6
591	K	34.7	Very low	35.7	Very low	202 Å²	202	139.8 Å²	139.8	88%	0.878	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	14.8	175.4	-85.1	-162.8	173.3	-172.8	0	116.1	L589	L589-K591 PolarHBondContact O-N 3.45Å
592	I	42.6	Very low	35.6	Very low	157 Å²	157	140.7 Å²	140.7	81%	0.805	76%	0.762	S	S	*	*	S	Bend	trans	-132.6	77.8	171.7	-48	179.2	0	0	0	111
593	K	30.3	Very low	35.2	Very low	208 Å²	208	136.8 Å²	136.8	90%	0.904	76%	0.764	S	S	*	*			trans	173.6	121.3	145.5	-98.4	161	-176.4	-179.5	0	110.3
594	G	27.3	Very low	34.6	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	78%	0.776	S	S	*	*			trans	-137.4	152.2	165.3	0	0	0	0	0	108.1
595	L	29.6	Very low	33.8	Very low	173 Å²	173	136.9 Å²	136.9	91%	0.906	78%	0.781	S	S	*	*			trans	69.2	127.1	-158.7	-46.8	162.7	0	0	0	110.2
596	T	29.6	Very low	33.3	Very low	146 Å²	146	141 Å²	141	90%	0.896	79%	0.791	S	S	*	*			cis	-130.1	176.1	24.6	-60.3	0	0	0	0	112.2
597	R	31.7	Very low	33.2	Very low	229 Å²	229	145.3 Å²	145.3	86%	0.864	80%	0.797	S	S	*	*			trans	-99.6	170.9	-167.2	-124.3	-174.6	-178.4	-144.1	3.4	114.1
598	Q	28.1	Very low	32.5	Very low	186 Å²	186	142.3 Å²	142.3	87%	0.869	80%	0.8	S	S	*	*			trans	82.2	151	168	-47.3	-171.7	21.1	0	0	117.6
599	A	28.8	Very low	32.3	Very low	83 Å²	83	144.9 Å²	144.9	69%	0.686	81%	0.808	S	S	*	*			cis	-171.9	142.8	-31.8	0	0	0	0	0	112.4
600	V	30.2	Very low	32	Very low	141 Å²	141	149.7 Å²	149.7	86%	0.855	82%	0.816	S	S	*	*			trans	73.7	158.8	148.2	170.3	0	0	0	0	114.6
601	P	35.6	Very low	31.7	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	82%	0.815	S	S	*	*				-125.4	-173.5	-108.3	27.1	1	0	0	0	115.3
602	P	41.9	Very low	31.4	Very low	118 Å²	118	141.5 Å²	141.5	77%	0.766	81%	0.808	S	S	*	*			trans	-103.7	163.6	-167.7	39.5	-35.3	0	0	0	116.7
603	P	35.5	Very low	30.7	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	81%	0.812	S	S	*	*			trans	-92.3	-177.9	164.3	37.4	-33.6	0	0	0	113.4
604	T	28.6	Very low	30.5	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	80%	0.803	S	S	*	*			trans	-124.5	176.5	-160.1	67.4	0	0	0	0	115.3
605	S	29.9	Very low	31.2	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	81%	0.811	S	S	*	*			trans	82	157.5	151.2	-64.1	0	0	0	0	119.7
606	N	28.6	Very low	31	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	81%	0.808	S	S	*	*			cis	-172.6	160.8	-31.2	-163.1	-8.4	0	0	0	109.7
607	R	32.5	Very low	30.9	Very low	235 Å²	235	137.9 Å²	137.9	89%	0.887	81%	0.808	S	S	*	*			trans	65.1	160.5	174.9	-61	175.7	169.5	177.3	-4.4	114.9
608	G	26.8	Very low	30.8	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	80%	0.803	S	S	*	*			cis	132.5	155.2	5.4	0	0	0	0	0	110
609	S	32.1	Very low	30.9	Very low	116 Å²	116	132 Å²	132	81%	0.811	80%	0.802	S	S	*	*			cis	-170.2	175.1	-2.7	-174.4	0	0	0	0	110
610	R	32.9	Very low	31.1	Very low	248 Å²	248	137.2 Å²	137.2	94%	0.936	81%	0.812	S	S	*	*			trans	70.6	150	177.3	-57.6	172.8	160	178.1	-8.2	115.6
611	G	27.4	Very low	31.3	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	80%	0.796	S	S	*	*			cis	-172.4	-174.2	-4.8	0	0	0	0	0	108.7
612	S	29.3	Very low	31.5	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	78%	0.781	S	S	*	*			cis	-166.6	141.2	-4.1	-168.8	0	0	0	0	110.5
613	L	28.8	Very low	31.7	Very low	171 Å²	171	136.6 Å²	136.6	90%	0.895	78%	0.782	S	S	*	*			trans	55	148.2	159	-63.6	168.1	0	0	0	121.9
614	G	26.3	Very low	31.9	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	77%	0.772	S	S	*	*			trans	-106.9	-147.5	167.4	0	0	0	0	0	111.6
615	P	41	Very low	32.5	Very low	127 Å²	127	136 Å²	136	83%	0.825	76%	0.763	S	S	*	*			cis	-133.1	170.6	10.2	42.5	-27.1	0	0	0	116.2
616	A	26.1	Very low	33.2	Very low	102 Å²	102	134.6 Å²	134.6	84%	0.843	75%	0.745	S	S	*	*			trans	-153.4	148.1	156.9	0	0	0	0	0	110.4
617	F	26.7	Very low	34	Very low	204 Å²	204	132.1 Å²	132.1	90%	0.895	73%	0.734	S	S	*	*			trans	-115.5	153.7	179.3	-98.9	-94.8	0	0	0	110.9
618	S	28.8	Very low	34.6	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	71%	0.714	S	S	*	*			trans	61.5	122.6	167.9	-157.7	0	0	0	0	115
619	E	30	Very low	35.5	Very low	179 Å²	179	125.5 Å²	125.5	84%	0.836	70%	0.695	S	S	*	*				-150.8	124.9	58.1	-73.6	-177.9	149.3	0	0	110.9
620	H	33.9	Very low	36.1	Very low	193 Å²	193	125.7 Å²	125.7	89%	0.894	68%	0.683	S	S	*	*			trans	-116.5	71.3	168.9	-146.2	-40.5	0	0	0	109.7	S622	H620-S622 PolarHBondContact O-N 3.14Å
621	R	33.8	Very low	36.4	Very low	139 Å²	139	118.1 Å²	118.1	53%	0.525	66%	0.659	S	S	.	*			trans	-55.8	132.7	179.6	-143.8	179.8	-160.3	-175.1	11.3	110.1	E626	R621-E626 IonicContact CZ-OE1 3.9Å; R621-E626 IonicContact NH1-OE1 2.96Å; R621-E626 PolarHBondContact NH1-OE1 2.98Å
622	S	41.4	Very low	37	Very low	61 Å²	61	122.7 Å²	122.7	43%	0.427	65%	0.652	S	S	.	*			trans	-78.9	129.4	-179.2	179.9	0	0	0	0	110.1	H620 L624 E625 E626	H620-S622 PolarHBondContact O-N 3.14Å; S622-L624 PolarHBondContact O-N 3.08Å; S622-L624 VanDerWaalsContact O-N 3.08Å; S622-L624 PolarHBondContact OG-N 2.89Å; S622-E625 WeakPolarHBondContact O-CA 3.24Å; S622-E625 WeakPolarHBondContact O-CB 3.13Å; S622-E625 PolarHBondContact O-N 3.49Å; S622-E626 PolarHBondContact O-N 3.4Å
623	M	46	Very low	37.4	Very low	159 Å²	159	122.8 Å²	122.8	78%	0.783	64%	0.642	S	S	*	*	H	α-helix	trans	-59	-23.6	175.5	-67.4	-166.2	-60.1	0	0	112.9	V627	M623-V627 WeakPolarHBondContact O-CB 3.23Å; M623-V627 VanDerWaalsContact O-CG2 3.26Å; M623-V627 WeakPolarHBondContact O-CG2 3.38Å; M623-V627 PolarHBondContact O-N 2.98Å; M623-V627 VanDerWaalsContact O-N 3.14Å
624	L	39.3	Very low	37.9	Very low	120 Å²	120	120.8 Å²	120.8	63%	0.628	63%	0.632	S	S	*	*	H	α-helix	trans	-68.8	-41.2	172.4	-177.6	65.2	0	0	0	111.4	S622 L628	S622-L624 PolarHBondContact O-N 3.08Å; S622-L624 VanDerWaalsContact O-N 3.08Å; S622-L624 PolarHBondContact OG-N 2.89Å; L624-L628 HydrophobicContact CD1-CD1 4.38Å; L624-L628 HydrophobicContact CG-CD1 4.09Å; L624-L628 WeakPolarHBondContact O-CB 3.42Å; L624-L628 VanDerWaalsContact O-CG 3.23Å; L624-L628 WeakPolarHBondContact O-CG 3.34Å; L624-L628 PolarHBondContact O-N 3.49Å
625	E	40.5	Very low	38.5	Very low	120 Å²	120	124.2 Å²	124.2	56%	0.561	63%	0.629	S	S	*	*	H	α-helix	trans	-72	-35.7	179.9	-170.3	170.5	-128.6	0	0	111.4	S622 L628 H629	S622-E625 WeakPolarHBondContact O-CA 3.24Å; S622-E625 WeakPolarHBondContact O-CB 3.13Å; S622-E625 PolarHBondContact O-N 3.49Å; E625-L628 PolarHBondContact O-N 2.95Å; E625-H629 WeakPolarHBondContact O-CB 3.38Å; E625-H629 PolarHBondContact O-N 2.79Å
626	E	43.7	Very low	38.5	Very low	74 Å²	74	123.8 Å²	123.8	35%	0.346	62%	0.619	S	S	.	*	H	α-helix	trans	-69.9	-38.7	175.1	-166.5	147.6	-113	0	0	112.7	R621 S622 H629 Q630	R621-E626 IonicContact CZ-OE1 3.9Å; R621-E626 IonicContact NH1-OE1 2.96Å; R621-E626 PolarHBondContact NH1-OE1 2.98Å; S622-E626 PolarHBondContact O-N 3.4Å; E626-H629 PolarHBondContact O-N 2.83Å; E626-Q630 WeakPolarHBondContact O-CG 3.46Å; E626-Q630 PolarHBondContact O-N 3.08Å
627	V	45.8	Very low	39	Very low	87 Å²	87	126.7 Å²	126.7	53%	0.527	62%	0.615	S	S	.	*	H	α-helix	trans	-64.4	-44.4	171.1	167.6	0	0	0	0	111.4	M623 H629 Q630 Q631	M623-V627 WeakPolarHBondContact O-CB 3.23Å; M623-V627 VanDerWaalsContact O-CG2 3.26Å; M623-V627 WeakPolarHBondContact O-CG2 3.38Å; M623-V627 PolarHBondContact O-N 2.98Å; M623-V627 VanDerWaalsContact O-N 3.14Å; V627-H629 VanDerWaalsContact C-N 3.32Å; V627-H629 PolarHBondContact O-N 2.76Å; V627-Q630 PolarHBondContact O-N 3.44Å; V627-Q631 WeakPolarHBondContact O-CB 3.45Å; V627-Q631 PolarHBondContact O-N 2.9Å
628	L	46.4	Very low	39.8	Very low	88 Å²	88	125 Å²	125	46%	0.461	61%	0.609	S	S	.	*	H	α-helix	trans	-67.5	-31.9	175.9	-71.8	170.3	0	0	0	112.4	L624 E625 R632	L624-L628 HydrophobicContact CD1-CD1 4.38Å; L624-L628 HydrophobicContact CG-CD1 4.09Å; L624-L628 WeakPolarHBondContact O-CB 3.42Å; L624-L628 VanDerWaalsContact O-CG 3.23Å; L624-L628 WeakPolarHBondContact O-CG 3.34Å; L624-L628 PolarHBondContact O-N 3.49Å; E625-L628 PolarHBondContact O-N 2.95Å; L628-R632 VanDerWaalsContact O-CB 3.25Å; L628-R632 WeakPolarHBondContact O-CB 3.49Å; L628-R632 PolarHBondContact O-N 3.37Å
629	H	45.7	Very low	39.9	Very low	86 Å²	86	127 Å²	127	40%	0.398	61%	0.607	S	S	.	*	H	α-helix	trans	-70.7	-45.6	175.6	-177.4	70.9	0	0	0	111.2	E625 E626 V627 Q631 R632 M633	E625-H629 WeakPolarHBondContact O-CB 3.38Å; E625-H629 PolarHBondContact O-N 2.79Å; E626-H629 PolarHBondContact O-N 2.83Å; V627-H629 VanDerWaalsContact C-N 3.32Å; V627-H629 PolarHBondContact O-N 2.76Å; H629-Q631 VanDerWaalsContact C-N 3.34Å; H629-Q631 PolarHBondContact O-N 3.2Å; H629-R632 PolarHBondContact O-N 3.46Å; H629-M633 WeakPolarHBondContact O-CB 3.39Å; H629-M633 VanDerWaalsContact O-CG 3.29Å; H629-M633 WeakPolarHBondContact O-CG 3.25Å; H629-M633 PolarHBondContact O-N 2.9Å
630	Q	43.7	Very low	40.1	Very low	120 Å²	120	123.9 Å²	123.9	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-59.6	-44.3	172.1	-72.6	178.8	4.1	0	0	111.3	E626 V627 R632 M633 L634	E626-Q630 WeakPolarHBondContact O-CG 3.46Å; E626-Q630 PolarHBondContact O-N 3.08Å; V627-Q630 PolarHBondContact O-N 3.44Å; Q630-R632 VanDerWaalsContact C-N 3.31Å; Q630-R632 PolarHBondContact O-N 3.4Å; Q630-M633 PolarHBondContact O-N 3.39Å; Q630-L634 WeakPolarHBondContact O-CG 3.29Å; Q630-L634 PolarHBondContact O-N 3.43Å; Q630-L634 VanDerWaalsContact O-N 3.08Å
631	Q	40.6	Very low	39.9	Very low	89 Å²	89	123.5 Å²	123.5	42%	0.416	60%	0.601	S	S	.	*	H	α-helix	trans	-66.3	-29.7	177.3	-169.7	160.4	65.4	0	0	113.2	V627 H629 Q635	V627-Q631 WeakPolarHBondContact O-CB 3.45Å; V627-Q631 PolarHBondContact O-N 2.9Å; H629-Q631 VanDerWaalsContact C-N 3.34Å; H629-Q631 PolarHBondContact O-N 3.2Å; Q631-Q635 WeakPolarHBondContact O-CG 3.34Å
632	R	39.8	Very low	39.8	Very low	171 Å²	171	121.9 Å²	121.9	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-77.9	-40.8	174.1	-173.1	177.6	-66	175.5	0.4	112.7	L628 H629 Q630 L634 Q635 I636	L628-R632 VanDerWaalsContact O-CB 3.25Å; L628-R632 WeakPolarHBondContact O-CB 3.49Å; L628-R632 PolarHBondContact O-N 3.37Å; H629-R632 PolarHBondContact O-N 3.46Å; Q630-R632 VanDerWaalsContact C-N 3.31Å; Q630-R632 PolarHBondContact O-N 3.4Å; R632-L634 VanDerWaalsContact C-N 3.3Å; R632-L634 PolarHBondContact O-N 3.28Å; R632-Q635 PolarHBondContact O-N 3.08Å; R632-Q635 VanDerWaalsContact O-N 3.08Å; R632-I636 PolarHBondContact O-N 3.4Å
633	M	37.4	Very low	39.2	Very low	108 Å²	108	127.4 Å²	127.4	53%	0.532	63%	0.627	S	S	.	*	H	α-helix	trans	-62	-39	176.6	-72.1	-63.5	-70.1	0	0	111.4	H629 Q630 Q635 I636	H629-M633 WeakPolarHBondContact O-CB 3.39Å; H629-M633 VanDerWaalsContact O-CG 3.29Å; H629-M633 WeakPolarHBondContact O-CG 3.25Å; H629-M633 PolarHBondContact O-N 2.9Å; Q630-M633 PolarHBondContact O-N 3.39Å; M633-Q635 VanDerWaalsContact C-N 3.25Å; M633-Q635 PolarHBondContact O-N 2.96Å; M633-I636 PolarHBondContact O-N 3.35Å
634	L	38.1	Very low	38.4	Very low	130 Å²	130	126.3 Å²	126.3	68%	0.681	63%	0.629	S	S	*	*	H	α-helix	trans	-68.2	-18.8	174.5	-69.7	170	0	0	0	114	Q630 R632	Q630-L634 WeakPolarHBondContact O-CG 3.29Å; Q630-L634 PolarHBondContact O-N 3.43Å; Q630-L634 VanDerWaalsContact O-N 3.08Å; R632-L634 VanDerWaalsContact C-N 3.3Å; R632-L634 PolarHBondContact O-N 3.28Å
635	Q	40.2	Very low	37.9	Very low	140 Å²	140	129 Å²	129	65%	0.654	64%	0.638	S	S	*	*	H	α-helix	trans	-82	-24.9	173.7	-77.4	-178.1	-30.6	0	0	113.4	Q631 R632 M633	Q631-Q635 WeakPolarHBondContact O-CG 3.34Å; R632-Q635 PolarHBondContact O-N 3.08Å; R632-Q635 VanDerWaalsContact O-N 3.08Å; M633-Q635 VanDerWaalsContact C-N 3.25Å; M633-Q635 PolarHBondContact O-N 2.96Å
636	I	40.3	Very low	37.3	Very low	118 Å²	118	127.7 Å²	127.7	61%	0.605	65%	0.648	S	S	*	*	H	α-helix	trans	-76	-25	-175.8	-67.4	170	0	0	0	112.1	R632 M633	R632-I636 PolarHBondContact O-N 3.4Å; M633-I636 PolarHBondContact O-N 3.35Å
637	Q	35.8	Very low	36.9	Very low	163 Å²	163	130.5 Å²	130.5	76%	0.762	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-8.5	-177.8	-102.2	-175.1	-7.5	0	0	115.6
638	H	44.8	Very low	36.1	Very low	168 Å²	168	135.2 Å²	135.2	78%	0.778	69%	0.689	S	S	*	*			trans	-130.2	50.5	-175.1	-81.5	18.3	0	0	0	112.5
639	Q	30.6	Very low	35.2	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	71%	0.709	S	S	*	*			trans	-108.5	111.7	168.8	-170	173.8	21.3	0	0	110.3
640	P	34.4	Very low	34.4	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.5	137.1	166.2	-19.5	32.4	0	0	0	110	P642	P640-P642 WeakPolarHBondContact O-CD 3.38Å
641	Q	30.3	Very low	34.2	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.2	174.4	-74	-177.3	-43.3	0	0	110.5	Q643	Q641-Q643 PolarHBondContact O-N 3.31Å
642	P	30.4	Very low	33.6	Very low	105 Å²	105	137.9 Å²	137.9	68%	0.682	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-73.1	116.4	163.3	29.9	-30.7	0	0	0	108.8	P640 V644	P640-P642 WeakPolarHBondContact O-CD 3.38Å; P642-V644 PolarHBondContact O-N 3.35Å
643	Q	28.8	Very low	33.1	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-67.2	121.3	167	-79.8	-170.1	-25.4	0	0	109.4	Q641	Q641-Q643 PolarHBondContact O-N 3.31Å
644	V	30.2	Very low	32.6	Very low	137 Å²	137	140.3 Å²	140.3	83%	0.83	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-86.3	126.6	171.6	178.8	0	0	0	0	108.4	P642	P642-V644 PolarHBondContact O-N 3.35Å
645	Q	29.3	Very low	33	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	77%	0.768	S	S	*	*			trans	-122.6	125.2	170.5	-77.2	-169.2	-11.2	0	0	111.1
646	A	26.1	Very low	32.4	Very low	92 Å²	92	139.5 Å²	139.5	76%	0.76	77%	0.773	S	S	*	*			trans	-167.8	155.4	161.7	0	0	0	0	0	108.8
647	P	35.3	Very low	31.8	Very low	133 Å²	133	140.1 Å²	140.1	86%	0.864	78%	0.777	S	S	*	*			cis	-118.5	-157.5	-13.4	39.5	-24.1	0	0	0	111.9
648	Q	29.5	Very low	31.4	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.874	78%	0.777	S	S	*	*			trans	-85.3	152.1	-169	-53.2	174	5.4	0	0	115.3
649	T	28.4	Very low	30.6	Very low	142 Å²	142	139.6 Å²	139.6	87%	0.871	78%	0.776	S	S	*	*			trans	-142.5	148.5	135.1	45.2	0	0	0	0	110.2
650	G	27.5	Very low	30.4	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	77%	0.771	S	S	*	*			trans	-88.1	-165	166.4	0	0	0	0	0	112
651	P	40.5	Very low	30.2	Very low	115 Å²	115	138.5 Å²	138.5	75%	0.747	77%	0.774	S	S	*	*			cis	-143.4	-178.9	21	38	-16.5	0	0	0	117.6
652	T	28.1	Very low	30.2	Very low	115 Å²	115	136.3 Å²	136.3	71%	0.706	76%	0.764	S	S	*	*			trans	71.2	136.5	147.6	36.5	0	0	0	0	123.8
653	Q	29.3	Very low	30.1	Very low	180 Å²	180	139.6 Å²	139.6	84%	0.841	77%	0.77	S	S	*	*			trans	84.9	111.9	143.5	-74	174.5	38.9	0	0	121.8
654	N	26	Very low	30.1	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	77%	0.766	S	S	*	*			trans	-67.8	180	143.9	-54.7	-41.8	0	0	0	109.7
655	P	47.7	Very low	31.1	Very low	107 Å²	107	135 Å²	135	70%	0.695	76%	0.761	S	S	*	*			cis	-143.5	175.4	5.9	32.9	-8.4	0	0	0	117.9
656	L	27.1	Very low	31.1	Very low	146 Å²	146	131.8 Å²	131.8	76%	0.764	76%	0.758	S	S	*	*			trans	56.3	133.2	137.7	-72	168.7	0	0	0	124.9
657	L	28.1	Very low	32.7	Very low	131 Å²	131	132.5 Å²	132.5	69%	0.686	76%	0.755	S	S	*	*			trans	83.5	128	133.4	-68.1	166	0	0	0	124.6
658	F	27.2	Very low	34	Very low	173 Å²	173	131.4 Å²	131.4	76%	0.759	75%	0.748	S	S	*	*			trans	79.3	110.8	132.2	-91.5	-141.9	0	0	0	124.9
659	L	27.1	Very low	35.6	Very low	146 Å²	146	127.7 Å²	127.7	76%	0.764	74%	0.74	S	S	*	*				70.9	154.4	113.3	-111.6	160.4	0	0	0	123.1
660	A	27.9	Very low	35.9	Very low	75 Å²	75	127 Å²	127	62%	0.62	74%	0.736	S	S	*	*			trans	76	122.7	168.2	0	0	0	0	0	116.7
661	Q	29.3	Very low	36.2	Very low	171 Å²	171	128.5 Å²	128.5	80%	0.799	74%	0.736	S	S	*	*				67.1	139.4	77.4	-73.8	-168.5	-7.6	0	0	113.7
662	Q	31.3	Very low	35.8	Very low	138 Å²	138	128.6 Å²	128.6	65%	0.645	73%	0.734	S	S	*	*			cis	-162.5	-179.5	7	-138	-176	53.4	0	0	112.8
663	Q	26.8	Very low	35.9	Very low	174 Å²	174	131.8 Å²	131.8	81%	0.813	74%	0.739	S	S	*	*			trans	89	152.4	151.1	-76.5	165.9	35.4	0	0	122.7
664	S	30	Very low	35.9	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	73%	0.731	S	S	*	*			trans	-125.3	-178.7	-174.6	58.1	0	0	0	0	109.9
665	P	50.7	Low	37	Very low	111 Å²	111	126.5 Å²	126.5	72%	0.721	73%	0.731	S	S	*	*				-163.2	134.3	91.2	40	-17.5	0	0	0	120.1
666	S	29.1	Very low	36.2	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	73%	0.733	S	S	*	*				64.3	-176.2	126	84.3	0	0	0	0	121.7
667	P	59.5	Low	36.4	Very low	108 Å²	108	124.6 Å²	124.6	70%	0.701	73%	0.732	S	S	*	*				-140	-126.1	-109.7	43.6	-18.8	0	0	0	111.9
668	P	63.2	Low	36.5	Very low	109 Å²	109	125.6 Å²	125.6	71%	0.708	74%	0.736	S	S	*	*			cis	-109.4	-133.4	-49.4	40	-22.7	0	0	0	107.9
669	P	62.3	Low	36.6	Very low	110 Å²	110	126.2 Å²	126.2	71%	0.714	74%	0.739	S	S	*	*			cis	-113.1	-154.6	-40.5	35.2	-15.6	0	0	0	109.3
670	T	35.2	Very low	36.6	Very low	128 Å²	128	126.4 Å²	126.4	79%	0.785	74%	0.741	S	S	*	*			cis	-157.1	-176	-10.1	-1.8	0	0	0	0	104
671	S	34.8	Very low	36.8	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	74%	0.742	S	S	*	*			cis	-179.3	152.9	-13	49.3	0	0	0	0	105.4
672	T	31.2	Very low	37.6	Very low	116 Å²	116	124.4 Å²	124.4	71%	0.712	74%	0.743	S	S	*	*			cis	-142.6	-166.7	9.8	58.7	0	0	0	0	107.4
673	F	29.8	Very low	37.5	Very low	183 Å²	183	121.8 Å²	121.8	80%	0.803	75%	0.745	S	S	*	*			cis	-146	-133.1	-3.5	-138.8	-43	0	0	0	110.9
674	S	29.1	Very low	37.7	Very low	98 Å²	98	120.4 Å²	120.4	69%	0.685	75%	0.748	S	S	*	*			trans	-162.3	-171.2	-168.3	-39.9	0	0	0	0	109
675	P	50.2	Low	37.8	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	75%	0.752	S	S	*	*			cis	-141.4	-174.7	13.1	43.8	-22.8	0	0	0	118.6
676	S	30.1	Very low	37.6	Very low	108 Å²	108	124 Å²	124	76%	0.755	75%	0.753	S	S	*	*			trans	-73.9	175.3	171.2	-15.6	0	0	0	0	113
677	S	30.9	Very low	37.6	Very low	104 Å²	104	123.1 Å²	123.1	73%	0.727	75%	0.753	S	S	*	*			cis	-179.5	-155.8	-12.4	44.3	0	0	0	0	108.2
678	I	30.1	Very low	36.4	Very low	153 Å²	153	125.7 Å²	125.7	79%	0.785	76%	0.76	S	S	*	*			trans	120.9	157.8	154.7	-65.8	164.7	0	0	0	116.7
679	F	30.1	Very low	35.5	Very low	186 Å²	186	126 Å²	126	82%	0.816	76%	0.762	S	S	*	*			trans	-31.5	158.6	171.8	-81.5	-126.7	0	0	0	116
680	D	26.6	Very low	34.7	Very low	150 Å²	150	125.7 Å²	125.7	80%	0.802	76%	0.76	S	S	*	*				-170.4	-179.6	65.9	-141.2	-13.4	0	0	0	115.9
681	A	32.1	Very low	35.8	Very low	77 Å²	77	125.6 Å²	125.6	64%	0.636	76%	0.761	S	S	*	*			trans	-149.2	147.9	168.1	0	0	0	0	0	109.8
682	P	45.6	Very low	36.5	Very low	126 Å²	126	126.5 Å²	126.5	82%	0.818	77%	0.765	S	S	*	*				-161.4	-161.5	79.5	39.9	-15.9	0	0	0	116.5
683	A	29.6	Very low	37.4	Very low	84 Å²	84	127 Å²	127	69%	0.694	77%	0.77	S	S	*	*			trans	102	111.4	138.8	0	0	0	0	0	123.4
684	V	30.5	Very low	38.7	Very low	145 Å²	145	123.8 Å²	123.8	88%	0.879	77%	0.768	S	S	*	*			trans	88.7	150.1	130.4	176.9	0	0	0	0	120.8
685	Q	32.1	Very low	38.8	Very low	177 Å²	177	123.3 Å²	123.3	83%	0.827	77%	0.77	S	S	*	*			trans	-99.1	-164	-168.7	-57.3	-178.7	-24	0	0	110.8
686	P	48.2	Very low	37.8	Very low	114 Å²	114	126.7 Å²	126.7	74%	0.74	78%	0.775	S	S	*	*			cis	-148.4	178.3	6.1	45.8	-25.2	0	0	0	120.3
687	A	29.1	Very low	38	Very low	91 Å²	91	129.8 Å²	129.8	75%	0.752	78%	0.777	S	S	*	*			trans	69.8	132.5	140.8	0	0	0	0	0	125
688	L	32.9	Very low	38.5	Very low	161 Å²	161	130.9 Å²	130.9	84%	0.843	78%	0.782	S	S	*	*			trans	-22.7	171.5	135.6	-71	156.4	0	0	0	117.6
689	P	44.4	Very low	38.5	Very low	115 Å²	115	129.1 Å²	129.1	75%	0.747	78%	0.779	S	S	*	*			cis	-129.2	-105.9	10.5	21.6	5.7	0	0	0	119.1
690	P	46.4	Very low	39.4	Very low	105 Å²	105	125.2 Å²	125.2	68%	0.682	77%	0.772	S	S	*	*				-123.1	178.5	-117.8	40.3	-22.9	0	0	0	116.7
691	P	58.9	Low	39.5	Very low	125 Å²	125	124.8 Å²	124.8	81%	0.812	78%	0.775	S	S	*	*			trans	-89.4	152.6	-179.8	35.2	-36.7	0	0	0	115.6
692	P	48.7	Very low	39.3	Very low	118 Å²	118	124 Å²	124	77%	0.766	77%	0.774	S	S	*	*			trans	-120.4	166	164	29.7	-12.3	0	0	0	114.8
693	P	50.5	Low	38.5	Very low	125 Å²	125	127.1 Å²	127.1	81%	0.812	78%	0.775	S	S	*	*			trans	-119.8	-112.9	-154.3	24.9	1	0	0	0	117.8
694	P	56.5	Low	38.6	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	79%	0.785	S	S	*	*				-126.6	166.6	-122.2	40.2	-23.1	0	0	0	117.6
695	A	31.9	Very low	38.4	Very low	88 Å²	88	138.2 Å²	138.2	73%	0.727	78%	0.783	S	S	*	*			trans	-145	113.8	165.1	0	0	0	0	0	109.2
696	Q	29.6	Very low	38.2	Very low	191 Å²	191	137.5 Å²	137.5	89%	0.893	78%	0.78	S	S	*	*				98.4	128.2	76.4	-85.4	179.4	10.5	0	0	112.9
697	Q	32.9	Very low	37.2	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	78%	0.778	S	S	*	*			trans	-82.5	163.8	161.5	-58.3	-179	-33.3	0	0	109.2
698	P	40.8	Very low	37.2	Very low	127 Å²	127	139.7 Å²	139.7	83%	0.825	78%	0.776	S	S	*	*				-142.2	173.6	88.4	36.3	-20	0	0	0	115.7
699	T	30	Very low	36.8	Very low	116 Å²	116	140.8 Å²	140.8	71%	0.712	78%	0.777	S	S	*	*			trans	-89.9	-166	169.4	58.2	0	0	0	0	109.4
700	P	50.7	Low	36	Very low	105 Å²	105	140.7 Å²	140.7	68%	0.682	78%	0.775	S	S	*	*			cis	-141.5	-149.9	2.2	41.7	-19	0	0	0	115.1
701	T	28.9	Very low	35.1	Very low	140 Å²	140	141.6 Å²	141.6	86%	0.859	78%	0.783	S	S	*	*			trans	88.4	134.8	172.1	73.7	0	0	0	0	117.1
702	G	27.9	Very low	33.6	Very low	60 Å²	60	140.8 Å²	140.8	62%	0.619	78%	0.781	S	S	*	*			cis	172.8	153.6	-13.8	0	0	0	0	0	114.3
703	F	28.6	Very low	32.5	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.842	79%	0.786	S	S	*	*			trans	55.5	140.9	164.3	-61.7	-86.1	0	0	0	118.1
704	W	30.1	Very low	31.5	Very low	240 Å²	240	144 Å²	144	91%	0.909	78%	0.784	S	S	*	*			cis	-141.2	171.2	48.1	-83.2	85.3	0	0	0	115.2
705	R	26.8	Very low	30.1	Very low	222 Å²	222	142 Å²	142	84%	0.838	79%	0.785	S	S	*	*			trans	-155.5	129.2	-179.2	179.8	-161	-156.6	-142.3	10.1	110.1
706	Q	27.9	Very low	29.9	Very low	162 Å²	162	143.3 Å²	143.3	76%	0.757	79%	0.787	S	S	*	*			trans	-175.8	116	154.4	-104.1	167.3	-4.6	0	0	108
707	T	27.8	Very low	29.9	Very low	112 Å²	112	139.5 Å²	139.5	69%	0.687	78%	0.782	S	S	*	*				68.2	149.6	90.4	59.1	0	0	0	0	115.3
708	L	29.6	Very low	30	Very low	139 Å²	139	136.5 Å²	136.5	73%	0.728	78%	0.78	S	S	*	*			cis	162.4	121.6	-24.8	-128.7	169.3	0	0	0	104.4	T710	L708-T710 HydrophobicContact CD2-CG2 4Å
709	E	25	Very low	29.7	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	77%	0.774	S	S	*	*			trans	-176.6	131.6	155.9	-106.5	167.1	-147.5	0	0	106
710	T	27.1	Very low	29.8	Very low	112 Å²	112	136 Å²	136	69%	0.687	78%	0.779	S	S	*	*			cis	85	93	21	74.8	0	0	0	0	117.5	L708	L708-T710 HydrophobicContact CD2-CG2 4Å
711	S	26.8	Very low	28.8	Very low	124 Å²	124	135.4 Å²	135.4	87%	0.867	78%	0.777	S	S	*	*			trans	-150.6	152.8	144.2	54.8	0	0	0	0	110.1
712	S	26.9	Very low	28.8	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	77%	0.767	S	S	*	*			trans	-153.8	139.1	-159.4	-47.2	0	0	0	0	113.7
713	F	26	Very low	28.8	Very low	200 Å²	200	135.6 Å²	135.6	88%	0.877	77%	0.774	S	S	*	*			trans	-160.7	116.2	157	-101.2	-87	0	0	0	106.1
714	S	30.6	Very low	28.8	Very low	111 Å²	111	137 Å²	137	78%	0.776	78%	0.775	S	S	*	*				66.7	133.2	52.9	80.7	0	0	0	0	113.8
715	G	26.9	Very low	28.7	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	77%	0.773	S	S	*	*			cis	-144	-164.7	-10.6	0	0	0	0	0	109.3
716	C	26.6	Very low	28.9	Very low	116 Å²	116	126.7 Å²	126.7	78%	0.784	77%	0.773	S	S	*	*			cis	-154.9	157.3	-1	-108.5	0	0	0	0	107.8
717	S	31.1	Very low	29.1	Very low	111 Å²	111	124.1 Å²	124.1	78%	0.776	77%	0.773	S	S	*	*				61.6	133.2	74.7	-38.8	0	0	0	0	114.1
718	S	33.7	Very low	29.1	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	78%	0.783	S	S	*	*			cis	-153.1	179	14.2	65.3	0	0	0	0	109.9
719	S	34.4	Very low	29.1	Very low	98 Å²	98	125 Å²	125	69%	0.685	78%	0.782	S	S	*	*			cis	-173.1	163.8	6.9	16.6	0	0	0	0	105.8
720	T	31.9	Very low	30.3	Very low	135 Å²	135	121.5 Å²	121.5	83%	0.828	77%	0.774	S	S	*	*			cis	-169.2	171.6	2.9	13.7	0	0	0	0	106.4
721	S	30.9	Very low	30.3	Very low	92 Å²	92	122.6 Å²	122.6	64%	0.643	78%	0.781	S	S	*	*			cis	-164.3	-177.4	-7.2	51.5	0	0	0	0	109.2
722	S	29.1	Very low	30.4	Very low	91 Å²	91	121.4 Å²	121.4	64%	0.636	78%	0.778	S	S	*	*			trans	33.1	106.6	147.8	58.8	0	0	0	0	119
723	C	28	Very low	30.4	Very low	113 Å²	113	122.1 Å²	122.1	76%	0.764	78%	0.784	S	S	*	*			cis	65.4	123.6	31.9	-41.8	0	0	0	0	115.7
724	Y	26.9	Very low	30.4	Very low	222 Å²	222	117.2 Å²	117.2	87%	0.871	78%	0.78	S	S	*	*				-156.5	141.5	124.7	-99.5	-67.3	0	0	0	110.6
725	S	28.9	Very low	30.2	Very low	123 Å²	123	116.1 Å²	116.1	86%	0.86	78%	0.778	S	S	*	*			trans	-163.5	137.3	168.9	-76.1	0	0	0	0	108.3
726	S	30.8	Very low	30.2	Very low	122 Å²	122	123.4 Å²	123.4	85%	0.853	78%	0.784	S	S	*	*			trans	-129.5	142.5	-179.1	-62.7	0	0	0	0	110.1
727	S	31.2	Very low	30.2	Very low	107 Å²	107	125 Å²	125	75%	0.748	78%	0.783	S	S	*	*			trans	-86.6	154.6	-172	49.2	0	0	0	0	113.6
728	L	28.5	Very low	30.2	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	79%	0.791	S	S	*	*				174.7	164.6	117.4	-91.7	161.4	0	0	0	112.3
729	S	29.1	Very low	30	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	79%	0.789	S	S	*	*			trans	-157.6	177.6	171.1	75.1	0	0	0	0	107.9
730	P	49.9	Very low	29.7	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	80%	0.796	S	S	*	*			cis	-133.5	-157.8	-2.9	28.3	-3.2	0	0	0	113.1
731	V	28.8	Very low	29.7	Very low	135 Å²	135	134.1 Å²	134.1	82%	0.818	79%	0.794	S	S	*	*			trans	106.2	133	152.5	-177.8	0	0	0	0	119.3
732	A	27.4	Very low	29.6	Very low	99 Å²	99	137 Å²	137	82%	0.818	80%	0.802	S	S	*	*			trans	75.6	158	159.8	0	0	0	0	0	120.7
733	S	26.9	Very low	29.6	Very low	124 Å²	124	140.6 Å²	140.6	87%	0.867	81%	0.808	S	S	*	*			trans	-125	167	-168.1	-55.4	0	0	0	0	112.4
734	A	25.8	Very low	29.7	Very low	97 Å²	97	142.3 Å²	142.3	80%	0.802	81%	0.808	S	S	*	*			trans	108.5	122.4	148.9	0	0	0	0	0	118.5
735	A	26.5	Very low	29.6	Very low	88 Å²	88	136.5 Å²	136.5	73%	0.727	80%	0.8	S	S	*	*			trans	49.9	130.2	149.8	0	0	0	0	0	121
736	Y	27.6	Very low	29.5	Very low	226 Å²	226	139.7 Å²	139.7	89%	0.886	80%	0.801	S	S	*	*				-154.7	171.2	111.8	-115.2	-77	0	0	0	111.8
737	L	27.6	Very low	29.4	Very low	149 Å²	149	141.5 Å²	141.5	78%	0.78	80%	0.796	S	S	*	*			trans	-74.4	157.3	-168	-64.8	158.3	0	0	0	114.4
738	L	30.1	Very low	29.7	Very low	179 Å²	179	142.3 Å²	142.3	94%	0.937	80%	0.799	S	S	*	*			trans	-136.2	104.3	147.7	-99.9	173.8	0	0	0	110.3
739	E	29.6	Very low	29.7	Very low	157 Å²	157	141.1 Å²	141.1	73%	0.734	79%	0.789	S	S	*	*			trans	-104	141.8	161.8	-163.8	-167.2	179.2	0	0	107.3
740	A	28.9	Very low	30.3	Very low	100 Å²	100	141.4 Å²	141.4	83%	0.826	79%	0.788	S	S	*	*			trans	-140.9	125.8	175.8	0	0	0	0	0	110.5
741	R	30.2	Very low	29.2	Very low	212 Å²	212	143.3 Å²	143.3	80%	0.8	79%	0.791	S	S	*	*			trans	-101.7	155.8	-171.2	-84	-172.7	172.5	-161.7	-1	114.3
742	L	29.1	Very low	30	Very low	152 Å²	152	141.8 Å²	141.8	80%	0.796	79%	0.785	S	S	*	*			trans	-67.3	153.5	163.6	-69.8	153.7	0	0	0	113.1
743	H	30.7	Very low	30	Very low	167 Å²	167	147.4 Å²	147.4	77%	0.773	79%	0.791	S	S	*	*			trans	-154.9	115.8	141.2	-88.7	79.4	0	0	0	105.5
744	I	30.2	Very low	30.1	Very low	148 Å²	148	145.6 Å²	145.6	76%	0.759	78%	0.783	S	S	*	*				76.1	115	66.9	-64.7	170.5	0	0	0	113.9
745	S	24.3	Very low	30.2	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	78%	0.784	S	S	*	*			trans	-161.3	110.5	145.1	-163.7	0	0	0	0	114.2
746	Q	26.9	Very low	30.3	Very low	190 Å²	190	150 Å²	150	89%	0.888	79%	0.785	S	S	*	*			trans	64.5	163	145.2	-58.7	-175.2	33.5	0	0	122.5
747	Q	28.8	Very low	30.3	Very low	160 Å²	160	147.9 Å²	147.9	75%	0.748	78%	0.783	S	S	*	*			trans	-146.8	158.6	-169.9	-155.8	-169.8	44.1	0	0	108.7
748	P	37.5	Very low	30.4	Very low	124 Å²	124	148.4 Å²	148.4	81%	0.805	78%	0.782	S	S	*	*				-150.4	179.2	103.9	37	-17.9	0	0	0	116.4
749	Q	28.1	Very low	31.1	Very low	146 Å²	146	145.6 Å²	145.6	68%	0.682	77%	0.774	S	S	*	*			trans	-93.4	-177.4	174.5	-76.1	-84.7	-12.5	0	0	111.4
750	P	40.9	Very low	31.3	Very low	106 Å²	106	146 Å²	146	69%	0.688	78%	0.776	S	S	*	*			cis	-139.9	174.3	7.5	43.5	-24.9	0	0	0	118.7
751	L	26.3	Very low	31.3	Very low	150 Å²	150	147 Å²	147	79%	0.785	78%	0.777	S	S	*	*			trans	19.6	170.5	139.4	-60.2	174.9	0	0	0	123.4
752	P	47.6	Very low	31.4	Very low	104 Å²	104	141.5 Å²	141.5	68%	0.675	78%	0.777	S	S	*	*			cis	-137.1	179.6	-43.4	40.2	-23.9	0	0	0	114
753	F	27.3	Very low	31.4	Very low	217 Å²	217	139.1 Å²	139.1	95%	0.952	78%	0.779	S	S	*	*			trans	-163.4	175	151.8	-110.7	-68.6	0	0	0	113.2
754	A	28.9	Very low	31.4	Very low	85 Å²	85	140 Å²	140	70%	0.702	78%	0.783	S	S	*	*			trans	-158.9	169.9	-152.2	0	0	0	0	0	119.3
755	V	27.3	Very low	31.7	Very low	134 Å²	134	138.6 Å²	138.6	81%	0.812	78%	0.782	S	S	*	*			trans	80.8	154.6	154.3	175.8	0	0	0	0	120.2
756	L	29	Very low	33.3	Very low	143 Å²	143	139.5 Å²	139.5	75%	0.749	79%	0.785	S	S	*	*			trans	97.4	136.9	175.7	-59.8	178.9	0	0	0	116.2
757	Q	27.8	Very low	33.4	Very low	183 Å²	183	140 Å²	140	86%	0.855	79%	0.785	S	S	*	*			cis	-159.3	169.2	-19.3	-152.7	167.9	17.8	0	0	110.3
758	Q	28.9	Very low	34.7	Very low	160 Å²	160	137.8 Å²	137.8	75%	0.748	78%	0.784	S	S	*	*			trans	-120.7	148.6	-179.5	-158.2	-167.7	54.4	0	0	111.4
759	P	45.8	Very low	34.3	Very low	119 Å²	119	137 Å²	137	77%	0.773	78%	0.777	S	S	*	*				-149.5	-174.6	114.2	36.4	-18.8	0	0	0	114
760	Q	33	Very low	34.4	Very low	165 Å²	165	138.5 Å²	138.5	77%	0.771	78%	0.784	S	S	*	*				-163.5	176.3	-50.1	-96.6	-159.8	11.8	0	0	109.1
761	S	29.2	Very low	33.8	Very low	121 Å²	121	137.9 Å²	137.9	85%	0.846	78%	0.782	S	S	*	*			trans	81	148.7	162.3	80.6	0	0	0	0	120.3
762	A	31	Very low	34	Very low	98 Å²	98	139.9 Å²	139.9	81%	0.81	79%	0.785	S	S	*	*			cis	-170.5	126.8	-30.9	0	0	0	0	0	111.7
763	A	30.5	Very low	33	Very low	101 Å²	101	141.6 Å²	141.6	84%	0.835	79%	0.787	S	S	*	*			trans	-175.3	148.8	154.2	0	0	0	0	0	113
764	Q	30.9	Very low	33.1	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	77%	0.772	S	S	*	*			trans	-143.9	-173.5	168.2	-59.6	-171.9	1.4	0	0	107.8
765	V	36.3	Very low	33	Very low	120 Å²	120	138 Å²	138	73%	0.727	77%	0.773	S	S	*	*			cis	-158.5	-169.9	18.5	-123.1	0	0	0	0	106.6
766	P	56.5	Low	33	Very low	119 Å²	119	142.7 Å²	142.7	77%	0.773	78%	0.777	S	S	*	*			cis	-132.3	-178.9	-10.6	24.6	0.9	0	0	0	116.5
767	F	30.2	Very low	32.9	Very low	200 Å²	200	140.8 Å²	140.8	88%	0.877	78%	0.775	S	S	*	*			trans	-73.7	-173.3	168.7	-87.6	-79.1	0	0	0	113.9
768	P	55.1	Low	32.9	Very low	113 Å²	113	141.1 Å²	141.1	73%	0.734	78%	0.779	S	S	*	*			cis	-132.3	-168.3	18.8	28.4	-0	0	0	0	115.1
769	V	29.6	Very low	32.9	Very low	108 Å²	108	136.6 Å²	136.6	66%	0.655	78%	0.776	S	S	*	*			cis	-165.5	137.3	47.2	172.7	0	0	0	0	113.5
770	Q	29.8	Very low	33	Very low	178 Å²	178	137 Å²	137	83%	0.832	78%	0.779	S	S	*	*			trans	55.5	163.4	154.9	-69.5	163	0.4	0	0	123.3
771	S	29.6	Very low	32.9	Very low	93 Å²	93	134 Å²	134	65%	0.65	78%	0.782	S	S	*	*			cis	-177.9	139.5	-48.5	57.4	0	0	0	0	114.4
772	K	29.1	Very low	32.9	Very low	192 Å²	192	134.2 Å²	134.2	84%	0.835	78%	0.784	S	S	*	*			trans	61.6	156.2	144.6	-82.2	-171.6	175.6	-178.7	0	120.3
773	L	28.1	Very low	32.8	Very low	139 Å²	139	132.8 Å²	132.8	73%	0.728	78%	0.778	S	S	*	*			cis	-168.8	172.5	-12.8	-173.1	64.4	0	0	0	110.2
774	A	29	Very low	32.8	Very low	77 Å²	77	132.7 Å²	132.7	64%	0.636	78%	0.778	S	S	*	*			trans	81	131.6	162.6	0	0	0	0	0	117.1
775	M	26.4	Very low	32.7	Very low	149 Å²	149	131.6 Å²	131.6	73%	0.734	78%	0.777	S	S	*	*			cis	76.5	138.7	48.9	-67.4	-172.7	-73.6	0	0	113.2
776	W	27.9	Very low	32.4	Very low	233 Å²	233	130.3 Å²	130.3	88%	0.883	78%	0.779	S	S	*	*			cis	-120.1	165.8	13.4	-51.4	-71.3	0	0	0	111.8
777	S	26.4	Very low	30.9	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	78%	0.783	S	S	*	*			cis	82.6	104	21.2	-174.5	0	0	0	0	117.7
778	M	27.9	Very low	30.8	Very low	190 Å²	190	128 Å²	128	94%	0.936	79%	0.785	S	S	*	*			trans	-169.2	152.3	142.6	-93.2	-47.9	171.1	0	0	110.9
779	G	27.9	Very low	29.5	Very low	66 Å²	66	130.3 Å²	130.3	68%	0.68	79%	0.787	S	S	*	*			trans	-129.7	-140.4	166.8	0	0	0	0	0	109.2
780	P	49.1	Very low	29.4	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	79%	0.787	S	S	*	*			cis	-137.4	-169.5	-20.5	42.5	-25.7	0	0	0	113
781	A	30.2	Very low	29.3	Very low	102 Å²	102	131 Å²	131	84%	0.843	79%	0.787	S	S	*	*			trans	64.6	160.8	168.1	0	0	0	0	0	115.8
782	S	30.4	Very low	29.1	Very low	126 Å²	126	130.3 Å²	130.3	88%	0.881	80%	0.795	S	S	*	*			cis	-151.3	-178.8	-12.8	54.7	0	0	0	0	107.1
783	G	28	Very low	29.1	Very low	67 Å²	67	129.7 Å²	129.7	69%	0.691	80%	0.799	S	S	*	*			cis	170.2	-168.4	-0.2	0	0	0	0	0	111
784	A	30.9	Very low	29.1	Very low	100 Å²	100	128 Å²	128	83%	0.826	81%	0.806	S	S	*	*			trans	54.4	96.5	164.6	0	0	0	0	0	120.7
785	D	28.1	Very low	29	Very low	161 Å²	161	127.6 Å²	127.6	86%	0.861	81%	0.808	S	S	*	*				63.8	150.5	112.6	-142.5	3	0	0	0	124.2
786	A	29.3	Very low	29.1	Very low	93 Å²	93	128.4 Å²	128.4	77%	0.769	81%	0.811	S	S	*	*			trans	48.9	130.6	156.6	0	0	0	0	0	122.8
787	G	26.5	Very low	29.1	Very low	82 Å²	82	125 Å²	125	85%	0.845	80%	0.804	S	S	*	*			trans	165.2	119.4	159.9	0	0	0	0	0	114.8
788	M	28.4	Very low	29.2	Very low	189 Å²	189	128.2 Å²	128.2	93%	0.931	81%	0.808	S	S	*	*			trans	-94.6	162.6	167.2	-81.8	-175.5	159.2	0	0	111.4
789	Q	27.8	Very low	29.2	Very low	162 Å²	162	126.6 Å²	126.6	76%	0.757	80%	0.803	S	S	*	*			trans	118.4	119.6	131.1	-155.7	161.6	1.3	0	0	118.4
790	E	27.1	Very low	29.2	Very low	141 Å²	141	127.3 Å²	127.3	66%	0.659	81%	0.809	S	S	*	*			trans	51.9	135.2	150.2	-72.3	179	92.6	0	0	125.2
791	L	27.8	Very low	28.2	Very low	159 Å²	159	127.1 Å²	127.1	83%	0.832	81%	0.811	S	S	*	*			trans	55.3	116.7	138.1	-62.4	169.7	0	0	0	120.5
792	G	26.1	Very low	28.1	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	81%	0.808	S	S	*	*			trans	-171	119.5	165.6	0	0	0	0	0	115.1
793	L	28.8	Very low	27.9	Very low	178 Å²	178	127.6 Å²	127.6	93%	0.932	80%	0.802	S	S	*	*			trans	-58.3	175.4	178.9	-78.6	151.4	0	0	0	117
794	A	28.1	Very low	27.8	Very low	105 Å²	105	132.6 Å²	132.6	87%	0.868	81%	0.809	S	S	*	*			trans	73.1	158.9	175.2	0	0	0	0	0	115.1
795	G	26.6	Very low	28	Very low	67 Å²	67	134.7 Å²	134.7	69%	0.691	81%	0.811	S	S	*	*			cis	160.5	157.5	-8.2	0	0	0	0	0	112
796	Q	27.3	Very low	28.4	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	83%	0.826	S	S	*	*			trans	66.9	129.6	178.3	-70	177.5	-106.5	0	0	118.9
797	Q	28.3	Very low	28.4	Very low	160 Å²	160	142.3 Å²	142.3	75%	0.748	83%	0.829	S	S	*	*				42.2	124.2	129.9	-56.4	165.7	-13.5	0	0	119.6
798	Q	28.9	Very low	28.5	Very low	172 Å²	172	145.4 Å²	145.4	80%	0.804	83%	0.828	S	S	*	*				-161.8	144.4	107.1	-108.5	-178.7	14.5	0	0	114.8
799	L	29	Very low	28.5	Very low	156 Å²	156	143 Å²	143	82%	0.817	82%	0.823	S	S	*	*			trans	19.9	121.8	142.1	-60.4	165.9	0	0	0	118.9
800	G	26.9	Very low	28.6	Very low	80 Å²	80	141.9 Å²	141.9	83%	0.825	83%	0.826	S	S	*	*			trans	-79.9	159.8	157.1	0	0	0	0	0	112.2
801	S	28.6	Very low	28.6	Very low	123 Å²	123	141.9 Å²	141.9	86%	0.86	84%	0.837	S	S	*	*			trans	-142.4	146.6	159.8	-170	0	0	0	0	109.8
802	C	27.7	Very low	28.7	Very low	114 Å²	114	140.8 Å²	140.8	77%	0.77	84%	0.837	S	S	*	*			trans	-110.3	135.3	-178.1	-177.4	0	0	0	0	109.5
803	V	26.1	Very low	28.9	Very low	125 Å²	125	145.2 Å²	145.2	76%	0.758	84%	0.839	S	S	*	*			trans	-129.7	106.5	174.1	-178.5	0	0	0	0	109.1
804	M	26.8	Very low	28.9	Very low	172 Å²	172	142.7 Å²	142.7	85%	0.847	83%	0.832	S	S	*	*			trans	-75.6	140.4	157.2	-65.8	-166.6	-59.8	0	0	109
805	V	34.4	Very low	29	Very low	143 Å²	143	145.8 Å²	145.8	87%	0.867	83%	0.829	S	S	*	*			trans	-96.6	151.2	159.2	-175.8	0	0	0	0	107.8
806	K	37.2	Very low	29.2	Very low	271 Å²	271	153 Å²	153	100%	1.178	84%	0.841	S	S	*	*			trans	-113.9	0	-152.2	-159.9	-178.1	-172.9	-178	0	113.1

Retrieved 806 of 806 residues in 1266.1 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).