A0A087YET8_POEFO Loading...

Heparan-alpha-glucosaminide N-acetyltransferase

AlphaFold DB , UniProt , Accession A0A087YET8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 654 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	32.7	Very low	250 Å²	250	177.3 Å²	177.3	100%	1.232	89%	0.891	S	S	*	*				0	129	0	-96.3	175.9	165.4	0	0	109.2
2	A	40.8	Very low	32.6	Very low	98 Å²	98	182.5 Å²	182.5	81%	0.81	89%	0.892	S	S	*	*			trans	-46.5	149.8	-174	0	0	0	0	0	117.5
3	K	30.9	Very low	32.7	Very low	217 Å²	217	181.4 Å²	181.4	94%	0.943	89%	0.89	S	S	*	*			trans	-157.1	124.7	134.3	-115.1	172	-176.2	179.2	0	114.1
4	K	30.8	Very low	32.8	Very low	211 Å²	211	175.5 Å²	175.5	92%	0.917	88%	0.876	S	S	*	*			trans	-42	143.6	173.3	-95.6	166.4	162.7	177.5	0	116.1
5	K	28.3	Very low	32.8	Very low	202 Å²	202	170.2 Å²	170.2	88%	0.878	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-94	140.6	157.2	-120.5	178.7	-179.3	-178.7	0	108.9
6	P	35.8	Very low	32.9	Very low	124 Å²	124	170 Å²	170	81%	0.805	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-92.9	152.7	173.8	33	-25.8	0	0	0	112.9
7	E	30.6	Very low	33.1	Very low	199 Å²	199	166.3 Å²	166.3	93%	0.93	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-67.6	145.9	178	-71.3	166.9	124.1	0	0	113.5
8	E	30.2	Very low	33.4	Very low	193 Å²	193	161.5 Å²	161.5	90%	0.902	83%	0.829	S	S	*	*			trans	-115.6	131.6	167.1	-151.8	175	-160.1	0	0	108.8
9	N	30.7	Very low	33.7	Very low	139 Å²	139	157.1 Å²	157.1	74%	0.743	81%	0.814	S	S	*	*			trans	-103.6	120.9	-166.7	-175.9	8.9	0	0	0	110.9
10	P	32	Very low	33.9	Very low	122 Å²	122	152 Å²	152	79%	0.792	80%	0.796	S	S	*	*			trans	-111.1	89.6	173.5	35.7	-23.4	0	0	0	111.2
11	K	34.8	Very low	34.2	Very low	195 Å²	195	147.6 Å²	147.6	85%	0.848	78%	0.782	S	S	*	*			trans	-120.4	75.8	161.8	-85.7	-172.6	-179.9	176.2	0	110.4
12	R	31.5	Very low	34.3	Very low	240 Å²	240	144.4 Å²	144.4	91%	0.906	76%	0.756	S	S	*	*	S	Bend	trans	-159	36.7	162	-134	178.5	-147.4	-162.7	5.8	115.9
13	I	34.6	Very low	34.1	Very low	168 Å²	168	144.4 Å²	144.4	86%	0.862	74%	0.739	S	S	*	*	S	Bend	trans	-145.6	70.7	172.2	-47.2	175.6	0	0	0	109.7
14	S	33.2	Very low	34.4	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	73%	0.728	S	S	*	*	S	Bend	trans	-150.3	-2.4	168.3	78.8	0	0	0	0	116.5
15	S	33.1	Very low	34.7	Very low	96 Å²	96	134.4 Å²	134.4	67%	0.671	71%	0.706	S	S	*	*	S	Bend	trans	-87	-21.3	-177.2	56.8	0	0	0	0	114.9
16	H	33.9	Very low	35	Very low	167 Å²	167	130.6 Å²	130.6	77%	0.773	69%	0.692	S	S	*	*	H	α-helix	trans	-87.8	-21.5	-176.3	-85.6	-71.3	0	0	0	115
17	T	36.4	Very low	35	Very low	107 Å²	107	130.7 Å²	130.7	66%	0.656	68%	0.679	S	S	*	*	H	α-helix	trans	-85	-22.4	-177.7	14.7	0	0	0	0	113.7	A21	T17-A21 PolarHBondContact O-N 3.08Å
18	S	39.5	Very low	35.2	Very low	80 Å²	80	131.1 Å²	131.1	56%	0.559	67%	0.672	S	S	*	*	H	α-helix	trans	-75	-38.9	178.6	178.5	0	0	0	0	112.8	A21 R22	S18-A21 PolarHBondContact O-N 2.7Å; S18-R22 WeakPolarHBondContact O-CB 3.33Å; S18-R22 PolarHBondContact O-N 2.95Å; S18-R22 VanDerWaalsContact O-N 3.08Å
19	S	38.2	Very low	35.3	Very low	78 Å²	78	130.1 Å²	130.1	55%	0.545	67%	0.665	S	S	.	*	H	α-helix	trans	-64.6	-44.5	178.6	-173.3	0	0	0	0	112.2	A21 R22 E23	S19-A21 PolarHBondContact O-N 3.41Å; S19-R22 PolarHBondContact O-N 3.45Å; S19-E23 WeakPolarHBondContact O-CB 3.42Å; S19-E23 PolarHBondContact O-N 3.47Å
20	A	37.7	Very low	35.3	Very low	55 Å²	55	129.9 Å²	129.9	46%	0.455	66%	0.66	S	S	.	*	H	α-helix	trans	-70.7	-29.4	-178.6	0	0	0	0	0	113.3	K24	A20-K24 WeakPolarHBondContact O-CB 3.35Å; A20-K24 PolarHBondContact O-N 3.19Å; A20-K24 VanDerWaalsContact O-N 3.09Å
21	A	39.5	Very low	35.2	Very low	60 Å²	60	132 Å²	132	50%	0.496	66%	0.661	S	S	.	*	H	α-helix	trans	-76.2	-37.6	175.8	0	0	0	0	0	112	T17 S18 S19 K24 A25	T17-A21 PolarHBondContact O-N 3.08Å; S18-A21 PolarHBondContact O-N 2.7Å; S19-A21 PolarHBondContact O-N 3.41Å; A21-K24 PolarHBondContact O-N 3.49Å; A21-A25 WeakPolarHBondContact O-CB 3.34Å; A21-A25 PolarHBondContact O-N 3.46Å
22	R	36.9	Very low	35.1	Very low	183 Å²	183	131 Å²	131	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-70.4	-40.5	176	-157.6	171.2	-177.7	173.5	-0.3	111.5	S18 S19 A25 E26	S18-R22 WeakPolarHBondContact O-CB 3.33Å; S18-R22 PolarHBondContact O-N 2.95Å; S18-R22 VanDerWaalsContact O-N 3.08Å; S19-R22 PolarHBondContact O-N 3.45Å; R22-A25 PolarHBondContact O-N 3.09Å; R22-E26 PolarHBondContact O-N 3.23Å
23	E	37.6	Very low	35.3	Very low	97 Å²	97	126.3 Å²	126.3	45%	0.453	65%	0.645	S	S	.	*	H	α-helix	trans	-67.2	-35.6	174.2	-160	-167.6	149.9	0	0	112.4	S19 K27	S19-E23 WeakPolarHBondContact O-CB 3.42Å; S19-E23 PolarHBondContact O-N 3.47Å; E23-K27 VanDerWaalsContact O-CB 3.24Å; E23-K27 WeakPolarHBondContact O-CB 3.35Å; E23-K27 WeakPolarHBondContact O-CG 3.24Å; E23-K27 PolarHBondContact O-N 2.92Å; E23-K27 IonicContact OE1-NZ 2.73Å; E23-K27 PolarHBondContact OE1-NZ 2.9Å
24	K	37.5	Very low	35.1	Very low	162 Å²	162	122.1 Å²	122.1	70%	0.704	63%	0.628	S	S	*	*	H	α-helix	trans	-69.2	-33	170.9	-90.8	179.6	175.9	174	0	112.8	A20 A21 R28	A20-K24 WeakPolarHBondContact O-CB 3.35Å; A20-K24 PolarHBondContact O-N 3.19Å; A20-K24 VanDerWaalsContact O-N 3.09Å; A21-K24 PolarHBondContact O-N 3.49Å; K24-R28 VanDerWaalsContact O-CB 3.29Å; K24-R28 WeakPolarHBondContact O-CB 3.47Å; K24-R28 PolarHBondContact O-N 3.12Å; K24-R28 VanDerWaalsContact O-N 3.07Å
25	A	36.7	Very low	35.5	Very low	57 Å²	57	125.4 Å²	125.4	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-75.1	-37.4	177.5	0	0	0	0	0	112.4	A21 R22 R28 K29	A21-A25 WeakPolarHBondContact O-CB 3.34Å; A21-A25 PolarHBondContact O-N 3.46Å; R22-A25 PolarHBondContact O-N 3.09Å; A25-R28 PolarHBondContact O-N 3.09Å; A25-K29 PolarHBondContact O-N 2.97Å; A25-K29 VanDerWaalsContact O-N 3.11Å
26	E	35.9	Very low	35.9	Very low	122 Å²	122	124 Å²	124	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-68.5	-45	171.2	-88.1	173.6	159.5	0	0	111.8	R22 R28 K29 E30	R22-E26 PolarHBondContact O-N 3.23Å; E26-R28 PolarHBondContact O-N 3.36Å; E26-K29 PolarHBondContact O-N 2.98Å; E26-E30 PolarHBondContact O-N 3.42Å
27	K	35.7	Very low	36	Very low	126 Å²	126	118.9 Å²	118.9	55%	0.548	60%	0.6	S	S	.	*	H	α-helix	trans	-58.9	-29.3	171.5	-81.3	173.2	172.4	160.8	0	112.9	E23 M31	E23-K27 VanDerWaalsContact O-CB 3.24Å; E23-K27 WeakPolarHBondContact O-CB 3.35Å; E23-K27 WeakPolarHBondContact O-CG 3.24Å; E23-K27 PolarHBondContact O-N 2.92Å; E23-K27 IonicContact OE1-NZ 2.73Å; E23-K27 PolarHBondContact OE1-NZ 2.9Å; K27-M31 WeakPolarHBondContact O-CB 3.4Å; K27-M31 PolarHBondContact O-N 3.13Å
28	R	33.3	Very low	36.5	Very low	207 Å²	207	116.9 Å²	116.9	78%	0.781	59%	0.585	S	S	*	*	H	α-helix	trans	-81.4	-23.6	177.2	-149	176.6	-160.7	-162.1	5.5	113.5	K24 A25 E26	K24-R28 VanDerWaalsContact O-CB 3.29Å; K24-R28 WeakPolarHBondContact O-CB 3.47Å; K24-R28 PolarHBondContact O-N 3.12Å; K24-R28 VanDerWaalsContact O-N 3.07Å; A25-R28 PolarHBondContact O-N 3.09Å; E26-R28 PolarHBondContact O-N 3.36Å
29	K	32.2	Very low	36.7	Very low	172 Å²	172	114.4 Å²	114.4	75%	0.748	57%	0.565	S	S	*	*	H	α-helix	trans	-82.5	-39.1	171.8	-84.5	-176.6	175.5	-179.7	0	111.9	A25 E26 M31 K32	A25-K29 PolarHBondContact O-N 2.97Å; A25-K29 VanDerWaalsContact O-N 3.11Å; E26-K29 PolarHBondContact O-N 2.98Å; K29-M31 VanDerWaalsContact C-N 3.33Å; K29-M31 PolarHBondContact O-N 2.87Å; K29-K32 PolarHBondContact O-N 3.18Å
30	E	32	Very low	37	Very low	135 Å²	135	115.7 Å²	115.7	63%	0.631	56%	0.561	S	S	*	*	H	α-helix	trans	-69.8	-25.3	178	-72.4	-167	152.4	0	0	113.9	E26 K32	E26-E30 PolarHBondContact O-N 3.42Å; E30-K32 PolarHBondContact O-N 3.33Å
31	M	30	Very low	37.3	Very low	167 Å²	167	119.8 Å²	119.8	82%	0.823	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-1.7	-179.6	-137.5	174.9	76.1	0	0	114.7	K27 K29	K27-M31 WeakPolarHBondContact O-CB 3.4Å; K27-M31 PolarHBondContact O-N 3.13Å; K29-M31 VanDerWaalsContact C-N 3.33Å; K29-M31 PolarHBondContact O-N 2.87Å
32	K	31.5	Very low	37.7	Very low	172 Å²	172	119 Å²	119	75%	0.748	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-10.8	-176	-97.3	-177.8	178.1	178.2	0	115.9	K29 E30	K29-K32 PolarHBondContact O-N 3.18Å; E30-K32 PolarHBondContact O-N 3.33Å
33	Q	35.2	Very low	38.1	Very low	143 Å²	143	111.5 Å²	111.5	67%	0.668	53%	0.533	S	S	*	.	S	Bend	trans	-119.3	-6.7	-165	-139.9	165.5	-9.1	0	0	120
34	P	31.5	Very low	38.6	Very low	79 Å²	79	109.8 Å²	109.8	51%	0.513	53%	0.529	S	S	.	.	S	Bend	trans	-88.7	-17.9	179.4	32.1	-31.8	0	0	0	114.6
35	K	41.3	Very low	39.4	Very low	168 Å²	168	105.1 Å²	105.1	73%	0.73	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-15.1	179.9	-79.6	-171.5	175.3	-173.9	0	114.5
36	Q	41.3	Very low	40.2	Very low	68 Å²	68	103.6 Å²	103.6	32%	0.318	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-18.3	-162.7	-141.4	164.5	-1.3	0	0	113.8	Y643	Q36-Y643 PolarHBondContact O-OH 3.18Å
37	A	35.7	Very low	41	Very low	59 Å²	59	99.6 Å²	99.6	49%	0.488	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-37.8	172.5	0	0	0	0	0	112.2	M39 F40 F41	A37-M39 PolarHBondContact O-N 3.4Å; A37-M39 VanDerWaalsContact O-N 3.13Å; A37-F40 PolarHBondContact O-N 3.11Å; A37-F41 PolarHBondContact O-N 3.07Å
38	N	48.2	Very low	41.8	Very low	65 Å²	65	97.1 Å²	97.1	35%	0.348	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-23.8	-179.7	-71.4	4.1	0	0	0	114.5	L42 L209	N38-L42 PolarHBondContact O-N 3.26Å; N38-L42 VanDerWaalsContact O-N 3.15Å; N38-L209 WeakPolarHBondContact ND2-CD1 3.22Å
39	M	43.8	Very low	42.7	Very low	28 Å²	28	89.5 Å²	89.5	14%	0.138	45%	0.449	C	S	.	.	H	α-helix	trans	-89.3	-22.4	-178.6	-163.6	161.1	55.2	0	0	113.4	A37 F41 L42 A43 A589 Y593 Y643	A37-M39 PolarHBondContact O-N 3.4Å; A37-M39 VanDerWaalsContact O-N 3.13Å; M39-F41 VanDerWaalsContact C-N 3.34Å; M39-L42 PolarHBondContact O-N 3.18Å; M39-A43 WeakPolarHBondContact O-CB 3.49Å; M39-A43 PolarHBondContact O-N 3.11Å; M39-A589 HydrophobicContact CE-CB 3.88Å; M39-A589 HydrophobicContact SD-CB 3.55Å; M39-A589 VanDerWaalsContact SD-CB 3.55Å; M39-Y593 HydrophobicContact CE-CE2 3.74Å; M39-Y593 WeakPolarHBondContact CE-OH 3.37Å; M39-Y593 HydrophobicContact SD-CE2 4.48Å; M39-Y643 HydrophobicContact CE-CE2 4.35Å
40	F	44.2	Very low	43.6	Very low	104 Å²	104	82.2 Å²	82.2	46%	0.456	42%	0.421	S	S	.	.	H	α-helix	trans	-67.2	-41.8	166.4	179.1	-104	0	0	0	109.6	A37 L42 A43 V44 Y643	A37-F40 PolarHBondContact O-N 3.11Å; F40-L42 VanDerWaalsContact C-N 3.34Å; F40-L42 PolarHBondContact O-N 3.27Å; F40-A43 PolarHBondContact O-N 2.92Å; F40-V44 HydrophobicContact CD1-CG2 4.26Å; F40-V44 HydrophobicContact CD2-CG2 4.45Å; F40-V44 HydrophobicContact CE1-CG2 3.96Å; F40-V44 HydrophobicContact CE2-CG2 4.17Å; F40-V44 HydrophobicContact CZ-CG2 3.92Å; F40-V44 WeakPolarHBondContact O-CB 3.29Å; F40-V44 VanDerWaalsContact O-CG2 3.24Å; F40-V44 WeakPolarHBondContact O-CG2 3.24Å; F40-V44 PolarHBondContact O-N 3.37Å; F40-Y643 HydrophobicContact CB-CE1 4.35Å; F40-Y643 AromaticContact CD2-CE1 3.97Å; F40-Y643 HydrophobicContact CD2-CE1 3.97Å
41	F	44.6	Very low	44.5	Very low	142 Å²	142	79.8 Å²	79.8	62%	0.623	42%	0.415	S	S	*	.	H	α-helix	trans	-58.7	-42.3	170.1	-108.3	-88.3	0	0	0	112.1	A37 M39 V44 I45	A37-F41 PolarHBondContact O-N 3.07Å; M39-F41 VanDerWaalsContact C-N 3.34Å; F41-V44 PolarHBondContact O-N 3.1Å; F41-I45 HydrophobicContact CD1-CD1 4.17Å; F41-I45 WeakPolarHBondContact O-CB 3.39Å; F41-I45 WeakPolarHBondContact O-CD1 3.49Å; F41-I45 WeakPolarHBondContact O-CG1 3.35Å; F41-I45 PolarHBondContact O-N 3.47Å
42	L	47	Very low	45.1	Very low	44 Å²	44	75.9 Å²	75.9	23%	0.23	40%	0.403	C	S	.	.	H	α-helix	trans	-66	-40.9	177.1	-164.7	74.8	0	0	0	112.9	N38 M39 F40 I45 V46 F202	N38-L42 PolarHBondContact O-N 3.26Å; N38-L42 VanDerWaalsContact O-N 3.15Å; M39-L42 PolarHBondContact O-N 3.18Å; F40-L42 VanDerWaalsContact C-N 3.34Å; F40-L42 PolarHBondContact O-N 3.27Å; L42-I45 PolarHBondContact O-N 3.07Å; L42-V46 WeakPolarHBondContact O-CB 3.38Å; L42-V46 VanDerWaalsContact O-CG2 3.26Å; L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 3.14Å; L42-F202 HydrophobicContact CB-CD2 4.37Å; L42-F202 HydrophobicContact CB-CE2 4.49Å; L42-F202 HydrophobicContact CD1-CB 4.02Å; L42-F202 HydrophobicContact CD1-CD2 3.9Å; L42-F202 HydrophobicContact CD1-CG 4.23Å; L42-F202 HydrophobicContact CD2-CB 4.22Å; L42-F202 HydrophobicContact CD2-CD1 4.29Å; L42-F202 HydrophobicContact CD2-CD2 3.7Å; L42-F202 HydrophobicContact CD2-CE2 4.06Å; L42-F202 HydrophobicContact CD2-CG 3.81Å; L42-F202 HydrophobicContact CG-CD2 4.21Å
43	A	45.1	Very low	45.8	Very low	25 Å²	25	69.7 Å²	69.7	21%	0.207	38%	0.38	C	S	.	.	H	α-helix	trans	-66.3	-41.2	176.7	0	0	0	0	0	112.1	M39 F40 V46 V47 V640	M39-A43 WeakPolarHBondContact O-CB 3.49Å; M39-A43 PolarHBondContact O-N 3.11Å; F40-A43 PolarHBondContact O-N 2.92Å; A43-V46 PolarHBondContact O-N 3.26Å; A43-V47 WeakPolarHBondContact O-CG2 3.3Å; A43-V47 PolarHBondContact O-N 3.31Å; A43-V640 HydrophobicContact CB-CG2 4.05Å
44	V	48.9	Very low	46.4	Very low	60 Å²	60	63.4 Å²	63.4	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-39	173.2	172.9	0	0	0	0	110.5	F40 F41 V47 V48	F40-V44 HydrophobicContact CD1-CG2 4.26Å; F40-V44 HydrophobicContact CD2-CG2 4.45Å; F40-V44 HydrophobicContact CE1-CG2 3.96Å; F40-V44 HydrophobicContact CE2-CG2 4.17Å; F40-V44 HydrophobicContact CZ-CG2 3.92Å; F40-V44 WeakPolarHBondContact O-CB 3.29Å; F40-V44 VanDerWaalsContact O-CG2 3.24Å; F40-V44 WeakPolarHBondContact O-CG2 3.24Å; F40-V44 PolarHBondContact O-N 3.37Å; F41-V44 PolarHBondContact O-N 3.1Å; V44-V47 PolarHBondContact O-N 3Å; V44-V48 HydrophobicContact CG1-CG2 4Å; V44-V48 VanDerWaalsContact O-CB 3.22Å; V44-V48 WeakPolarHBondContact O-CB 3.49Å; V44-V48 WeakPolarHBondContact O-CG2 3.12Å; V44-V48 PolarHBondContact O-N 3.39Å
45	I	52.8	Low	47.1	Very low	64 Å²	64	63.4 Å²	63.4	33%	0.328	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-39.8	174.4	-74	164.2	0	0	0	111	F41 L42 V48 I49 L198	F41-I45 HydrophobicContact CD1-CD1 4.17Å; F41-I45 WeakPolarHBondContact O-CB 3.39Å; F41-I45 WeakPolarHBondContact O-CD1 3.49Å; F41-I45 WeakPolarHBondContact O-CG1 3.35Å; F41-I45 PolarHBondContact O-N 3.47Å; L42-I45 PolarHBondContact O-N 3.07Å; I45-V48 PolarHBondContact O-N 3.28Å; I45-I49 HydrophobicContact CG2-CD1 3.44Å; I45-I49 VanDerWaalsContact CG2-CD1 3.44Å; I45-I49 HydrophobicContact CG2-CG1 4.09Å; I45-I49 WeakPolarHBondContact O-CB 3.23Å; I45-I49 WeakPolarHBondContact O-CG1 3.48Å; I45-I49 PolarHBondContact O-N 2.95Å; I45-L198 HydrophobicContact CG2-CD2 4.21Å
46	V	53.8	Low	47.1	Very low	25 Å²	25	60.1 Å²	60.1	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-41.9	175.2	168.5	0	0	0	0	110.9	L42 A43 A50 F195 L198	L42-V46 WeakPolarHBondContact O-CB 3.38Å; L42-V46 VanDerWaalsContact O-CG2 3.26Å; L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 3.14Å; A43-V46 PolarHBondContact O-N 3.26Å; V46-A50 WeakPolarHBondContact O-CB 3.14Å; V46-A50 PolarHBondContact O-N 3.46Å; V46-F195 HydrophobicContact CG1-CE1 4Å; V46-F195 HydrophobicContact CG1-CZ 4.5Å; V46-L198 HydrophobicContact CG2-CD1 4.19Å
47	V	53.6	Low	47.2	Very low	38 Å²	38	59.1 Å²	59.1	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-45.9	174.8	171.6	0	0	0	0	111	A43 V44 A50 V51 V640	A43-V47 WeakPolarHBondContact O-CG2 3.3Å; A43-V47 PolarHBondContact O-N 3.31Å; V44-V47 PolarHBondContact O-N 3Å; V47-A50 PolarHBondContact O-N 2.86Å; V47-V51 HydrophobicContact CG1-CG2 4.4Å; V47-V51 VanDerWaalsContact O-CB 3.29Å; V47-V51 WeakPolarHBondContact O-CB 3.24Å; V47-V51 WeakPolarHBondContact O-CG2 3.32Å; V47-V51 PolarHBondContact O-N 2.65Å; V47-V640 HydrophobicContact CG2-CG2 4.28Å
48	V	51.4	Low	47.6	Very low	74 Å²	74	58.6 Å²	58.6	45%	0.448	34%	0.335	S	S	.	.	H	α-helix	trans	-65.3	-40.8	179	169.5	0	0	0	0	110.9	V44 I45 V51 C52	V44-V48 HydrophobicContact CG1-CG2 4Å; V44-V48 VanDerWaalsContact O-CB 3.22Å; V44-V48 WeakPolarHBondContact O-CB 3.49Å; V44-V48 WeakPolarHBondContact O-CG2 3.12Å; V44-V48 PolarHBondContact O-N 3.39Å; I45-V48 PolarHBondContact O-N 3.28Å; V48-V51 PolarHBondContact O-N 3.4Å; V48-C52 WeakPolarHBondContact O-CB 3.47Å; V48-C52 PolarHBondContact O-N 2.88Å; V48-C52 PolarHBondContact O-SG 2.8Å
49	I	53.6	Low	47.3	Very low	47 Å²	47	62.6 Å²	62.6	24%	0.241	35%	0.352	C	S	.	.	H	α-helix	trans	-70.2	-42.7	176.4	-71.8	175.2	0	0	0	110.7	I45 V51 C52 V53 V194 L198	I45-I49 HydrophobicContact CG2-CD1 3.44Å; I45-I49 VanDerWaalsContact CG2-CD1 3.44Å; I45-I49 HydrophobicContact CG2-CG1 4.09Å; I45-I49 WeakPolarHBondContact O-CB 3.23Å; I45-I49 WeakPolarHBondContact O-CG1 3.48Å; I45-I49 PolarHBondContact O-N 2.95Å; I49-V51 PolarHBondContact O-N 3.25Å; I49-C52 PolarHBondContact O-N 3.37Å; I49-V53 HydrophobicContact CG2-CB 4.31Å; I49-V53 HydrophobicContact CG2-CG2 3.66Å; I49-V53 WeakPolarHBondContact O-CA 3.46Å; I49-V53 WeakPolarHBondContact O-CB 3.49Å; I49-V53 WeakPolarHBondContact O-CG2 3.32Å; I49-V53 PolarHBondContact O-N 3.1Å; I49-V194 HydrophobicContact CG2-CG1 4.11Å; I49-L198 HydrophobicContact CD1-CD1 4.1Å; I49-L198 HydrophobicContact CD1-CD2 3.66Å; I49-L198 HydrophobicContact CD1-CG 4.43Å
50	A	51	Low	47.4	Very low	19 Å²	19	67.3 Å²	67.3	16%	0.157	38%	0.376	C	S	.	.	H	α-helix	trans	-65.8	-29.9	176.9	0	0	0	0	0	112.2	V46 V47 G54 L633	V46-A50 WeakPolarHBondContact O-CB 3.14Å; V46-A50 PolarHBondContact O-N 3.46Å; V47-A50 PolarHBondContact O-N 2.86Å; A50-G54 PolarHBondContact O-N 3.46Å; A50-L633 HydrophobicContact CB-CD1 4.46Å; A50-L633 HydrophobicContact CB-CD2 3.25Å; A50-L633 HydrophobicContact CB-CG 3.76Å
51	V	50.6	Low	47.1	Very low	85 Å²	85	65.4 Å²	65.4	52%	0.515	38%	0.376	S	S	.	.	H	α-helix	trans	-78.6	-36.3	172.6	171.9	0	0	0	0	112.8	V47 V48 I49 P55 L633	V47-V51 HydrophobicContact CG1-CG2 4.4Å; V47-V51 VanDerWaalsContact O-CB 3.29Å; V47-V51 WeakPolarHBondContact O-CB 3.24Å; V47-V51 WeakPolarHBondContact O-CG2 3.32Å; V47-V51 PolarHBondContact O-N 2.65Å; V48-V51 PolarHBondContact O-N 3.4Å; I49-V51 PolarHBondContact O-N 3.25Å; V51-P55 WeakPolarHBondContact O-CD 3.4Å; V51-L633 HydrophobicContact CG2-CD2 4.16Å
52	C	41.7	Very low	46.5	Very low	84 Å²	84	62.2 Å²	62.2	57%	0.568	38%	0.376	S	S	*	.	H	α-helix	trans	-90.5	-26.7	-176.1	-68	0	0	0	0	114.2	V48 I49	V48-C52 WeakPolarHBondContact O-CB 3.47Å; V48-C52 PolarHBondContact O-N 2.88Å; V48-C52 PolarHBondContact O-SG 2.8Å; I49-C52 PolarHBondContact O-N 3.37Å
53	V	46.6	Very low	46.1	Very low	43 Å²	43	64 Å²	64	26%	0.261	39%	0.39	S	S	.	.	H	α-helix	trans	-92.3	-22.8	178.6	-179.8	0	0	0	0	111.4	I49 L56 M57	I49-V53 HydrophobicContact CG2-CB 4.31Å; I49-V53 HydrophobicContact CG2-CG2 3.66Å; I49-V53 WeakPolarHBondContact O-CA 3.46Å; I49-V53 WeakPolarHBondContact O-CB 3.49Å; I49-V53 WeakPolarHBondContact O-CG2 3.32Å; I49-V53 PolarHBondContact O-N 3.1Å; V53-L56 PolarHBondContact O-N 3.08Å; V53-M57 HydrophobicContact CG1-CE 3.48Å; V53-M57 VanDerWaalsContact CG1-CE 3.48Å; V53-M57 HydrophobicContact CG1-CG 3.65Å; V53-M57 HydrophobicContact CG1-SD 4.41Å; V53-M57 WeakPolarHBondContact O-CB 3.31Å; V53-M57 WeakPolarHBondContact O-CG 3.29Å; V53-M57 PolarHBondContact O-N 3.2Å
54	G	48.8	Very low	45.5	Very low	11 Å²	11	70.9 Å²	70.9	11%	0.113	42%	0.423	C	S	.	.	H	α-helix	trans	-52.8	-47.9	174.1	0	0	0	0	0	113.9	A50 A58	A50-G54 PolarHBondContact O-N 3.46Å; G54-A58 PolarHBondContact O-N 2.98Å
55	P	45.9	Very low	45.1	Very low	79 Å²	79	75.4 Å²	75.4	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-65.7	-39.8	174.9	-21.2	32.5	0	0	0	113.3	V51 M57 A58 E59	V51-P55 WeakPolarHBondContact O-CD 3.4Å; P55-M57 VanDerWaalsContact C-N 3.31Å; P55-M57 PolarHBondContact O-N 3.16Å; P55-A58 PolarHBondContact O-N 3.07Å; P55-E59 PolarHBondContact O-N 3.3Å
56	L	41.3	Very low	44.1	Very low	98 Å²	98	75.5 Å²	75.5	51%	0.513	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-32.7	-179.6	-155.5	80.2	0	0	0	112.1	V53 I60	V53-L56 PolarHBondContact O-N 3.08Å; L56-I60 HydrophobicContact CG-CD1 4.43Å; L56-I60 WeakPolarHBondContact O-CD1 3.41Å; L56-I60 VanDerWaalsContact O-CG1 3.25Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.83Å
57	M	43.7	Very low	43.2	Very low	47 Å²	47	84 Å²	84	23%	0.232	49%	0.493	C	S	.	.	H	α-helix	trans	-76	-30.3	177.4	-68.3	-68.1	148	0	0	113	V53 P55 S61 V190	V53-M57 HydrophobicContact CG1-CE 3.48Å; V53-M57 VanDerWaalsContact CG1-CE 3.48Å; V53-M57 HydrophobicContact CG1-CG 3.65Å; V53-M57 HydrophobicContact CG1-SD 4.41Å; V53-M57 WeakPolarHBondContact O-CB 3.31Å; V53-M57 WeakPolarHBondContact O-CG 3.29Å; V53-M57 PolarHBondContact O-N 3.2Å; P55-M57 VanDerWaalsContact C-N 3.31Å; P55-M57 PolarHBondContact O-N 3.16Å; M57-S61 PolarHBondContact O-N 2.87Å; M57-S61 PolarHBondContact O-OG 3.49Å; M57-V190 HydrophobicContact CE-CG1 3.57Å; M57-V190 HydrophobicContact SD-CB 4.42Å; M57-V190 HydrophobicContact SD-CG1 3.59Å; M57-V190 VanDerWaalsContact SD-CG1 3.59Å
58	A	43.7	Very low	42.3	Very low	49 Å²	49	86.1 Å²	86.1	41%	0.405	51%	0.51	S	S	.	.	H	α-helix	trans	-68.8	-37.9	173.1	0	0	0	0	0	111.3	G54 P55	G54-A58 PolarHBondContact O-N 2.98Å; P55-A58 PolarHBondContact O-N 3.07Å
59	E	42.3	Very low	41.9	Very low	149 Å²	149	92.4 Å²	92.4	70%	0.696	53%	0.531	S	S	*	.	H	α-helix	trans	-71	-37.1	175.9	-87.6	177.2	157.1	0	0	113.6	P55 S61	P55-E59 PolarHBondContact O-N 3.3Å; E59-S61 PolarHBondContact O-N 3.38Å
60	I	45.5	Very low	41.6	Very low	126 Å²	126	95.2 Å²	95.2	65%	0.646	54%	0.543	S	S	*	.	H	α-helix	trans	-70.5	-19.8	178.6	-64.9	163.5	0	0	0	112.1	L56	L56-I60 HydrophobicContact CG-CD1 4.43Å; L56-I60 WeakPolarHBondContact O-CD1 3.41Å; L56-I60 VanDerWaalsContact O-CG1 3.25Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.83Å
61	S	37	Very low	41.8	Very low	64 Å²	64	98 Å²	98	45%	0.448	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	6	-175.5	-49.7	0	0	0	0	114.3	M57 E59 P63	M57-S61 PolarHBondContact O-N 2.87Å; M57-S61 PolarHBondContact O-OG 3.49Å; E59-S61 PolarHBondContact O-N 3.38Å; S61-P63 WeakPolarHBondContact O-CD 3.47Å
62	A	32.2	Very low	42.8	Very low	75 Å²	75	97.4 Å²	97.4	62%	0.62	57%	0.569	S	S	*	*			trans	-95.6	94.4	179	0	0	0	0	0	110.7
63	P	38.5	Very low	44.8	Very low	83 Å²	83	95.6 Å²	95.6	54%	0.539	55%	0.553	S	S	.	*			trans	-71.1	134.9	161.9	30.5	-32	0	0	0	109	S61 F65	S61-P63 WeakPolarHBondContact O-CD 3.47Å; P63-F65 HydrophobicContact CG-CD2 4.2Å; P63-F65 HydrophobicContact CG-CE2 3.88Å; P63-F65 PolarHBondContact O-N 2.79Å; P63-F65 VanDerWaalsContact O-N 3.07Å
64	D	33.8	Very low	46.7	Very low	168 Å²	168	99.3 Å²	99.3	90%	0.898	57%	0.566	S	S	*	*			trans	-63.5	101.3	174.8	-159	8.3	0	0	0	109.2	G66	D64-G66 PolarHBondContact O-N 3.48Å; D64-G66 VanDerWaalsContact O-N 3.16Å
65	F	38.6	Very low	48.6	Very low	155 Å²	155	99.5 Å²	99.5	68%	0.68	56%	0.564	S	S	*	*			trans	-81.7	96	-177.8	-98.7	-83.7	0	0	0	110.4	P63 H67	P63-F65 HydrophobicContact CG-CD2 4.2Å; P63-F65 HydrophobicContact CG-CE2 3.88Å; P63-F65 PolarHBondContact O-N 2.79Å; P63-F65 VanDerWaalsContact O-N 3.07Å; F65-H67 PolarHBondContact O-N 3.48Å
66	G	32	Very low	50.6	Low	67 Å²	67	96.4 Å²	96.4	69%	0.691	54%	0.543	S	S	*	.			trans	-57.4	127	161.3	0	0	0	0	0	110.9	D64 S68	D64-G66 PolarHBondContact O-N 3.48Å; D64-G66 VanDerWaalsContact O-N 3.16Å; G66-S68 PolarHBondContact O-N 3.2Å; G66-S68 VanDerWaalsContact O-N 3.11Å
67	H	35.9	Very low	53	Low	203 Å²	203	94 Å²	94	94%	0.94	53%	0.529	S	S	*	.			trans	-54.1	108.9	179.9	-79.7	-59.2	0	0	0	113.3	F65	F65-H67 PolarHBondContact O-N 3.48Å
68	S	35.4	Very low	55.4	Low	83 Å²	83	91.8 Å²	91.8	58%	0.58	52%	0.518	S	S	*	.			trans	-121.2	133.4	149.6	-177.6	0	0	0	0	109.1	G66 H70	G66-S68 PolarHBondContact O-N 3.2Å; G66-S68 VanDerWaalsContact O-N 3.11Å; S68-H70 PolarHBondContact O-N 2.92Å; S68-H70 PolarHBondContact OG-CD2 3.17Å; S68-H70 VanDerWaalsContact OG-CD2 3.26Å; S68-H70 PolarHBondContact OG-NE2 3.5Å; S68-H70 VanDerWaalsContact OG-NE2 3.08Å
69	K	41.4	Very low	57.8	Low	206 Å²	206	89.7 Å²	89.7	90%	0.896	50%	0.5	S	S	*	.			trans	-63.4	96.3	177.9	-75	174.3	173.5	176	0	109.5
70	H	47	Very low	60.2	Low	105 Å²	105	82.6 Å²	82.6	49%	0.486	47%	0.467	S	S	.	.			trans	-131.9	153.5	171.8	-72.8	-65.1	0	0	0	111.6	S68 G72	S68-H70 PolarHBondContact O-N 2.92Å; S68-H70 PolarHBondContact OG-CD2 3.17Å; S68-H70 VanDerWaalsContact OG-CD2 3.26Å; S68-H70 PolarHBondContact OG-NE2 3.5Å; S68-H70 VanDerWaalsContact OG-NE2 3.08Å; H70-G72 PolarHBondContact O-N 3.13Å
71	V	56.9	Low	62.5	Low	79 Å²	79	77.7 Å²	77.7	48%	0.479	44%	0.443	S	S	.	.			trans	-36	126.7	168.7	178.5	0	0	0	0	109.5	L73	V71-L73 VanDerWaalsContact C-N 3.29Å; V71-L73 PolarHBondContact O-N 2.83Å
72	G	71.3	Confident	65.1	Low	72 Å²	72	74.7 Å²	74.7	74%	0.742	42%	0.422	S	S	*	.			trans	-66.3	89	177.7	0	0	0	0	0	110.4	H70	H70-G72 PolarHBondContact O-N 3.13Å
73	L	82.6	Confident	67.9	Low	45 Å²	45	72 Å²	72	24%	0.236	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-62.4	138.1	177.3	-64.7	173.8	0	0	0	109.6	V71 E77 L79	V71-L73 VanDerWaalsContact C-N 3.29Å; V71-L73 PolarHBondContact O-N 2.83Å; L73-E77 HydrophobicContact CD2-CB 4.39Å; L73-L79 HydrophobicContact CD1-CB 4.16Å; L73-L79 HydrophobicContact CD2-CB 4.3Å
74	K	87.8	Confident	70.3	Confident	121 Å²	121	68 Å²	68	53%	0.526	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-91.9	167.6	171.4	-59.6	173.5	-174.8	166.8	0	110.1	E77	K74-E77 HydrophobicContact CB-CG 4.26Å; K74-E77 PolarHBondContact N-OE2 3.14Å; K74-E77 VanDerWaalsContact O-CB 3.29Å; K74-E77 WeakPolarHBondContact O-CB 2.9Å; K74-E77 PolarHBondContact O-N 3Å; K74-E77 VanDerWaalsContact O-N 3.12Å
75	M	87.4	Confident	72.8	Confident	16 Å²	16	64.2 Å²	64.2	8%	0.079	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	143.6	167.2	-177.9	176.6	36.3	0	0	110.5	E77 E154 R282 Q622 H624	M75-E77 VanDerWaalsContact C-N 3.25Å; M75-E77 PolarHBondContact O-N 3.2Å; M75-E154 WeakPolarHBondContact CA-OE1 3.44Å; M75-R282 HydrophobicContact CE-CB 4.35Å; M75-R282 HydrophobicContact SD-CB 4.15Å; M75-Q622 HydrophobicContact CB-CB 4.28Å; M75-Q622 WeakPolarHBondContact CB-O 3.33Å; M75-H624 WeakPolarHBondContact CG-NE2 3.35Å
76	D	89.5	Confident	74.9	Confident	14 Å²	14	57.8 Å²	57.8	8%	0.075	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	20.5	-173.9	-59.4	-50.6	0	0	0	115.1	S127 T128 Q129 E154 R287 H624	D76-S127 WeakPolarHBondContact O-CA 3.48Å; D76-T128 VanDerWaalsContact CA-OG1 3.28Å; D76-T128 WeakPolarHBondContact CA-OG1 3.26Å; D76-T128 PolarHBondContact O-N 3.35Å; D76-T128 PolarHBondContact O-OG1 2.97Å; D76-Q129 HydrophobicContact CB-CG 3.83Å; D76-Q129 PolarHBondContact OD2-NE2 3.13Å; D76-E154 PolarHBondContact N-OE1 3.13Å; D76-R287 IonicContact OD2-CZ 2.68Å; D76-R287 IonicContact OD2-NH1 2.95Å; D76-R287 IonicContact OD2-NH2 3.03Å; D76-R287 PolarHBondContact OD2-NH2 3.15Å; D76-H624 IonicContact OD1-CE1 3.22Å; D76-H624 IonicContact OD1-NE2 2.74Å; D76-H624 PolarHBondContact OD1-NE2 3.15Å
77	E	91.6	Very high	77.2	Confident	47 Å²	47	63.4 Å²	63.4	22%	0.22	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	151.5	176.3	-59.5	179.2	169.3	0	0	113.2	L73 K74 M75 V126 H155	L73-E77 HydrophobicContact CD2-CB 4.39Å; K74-E77 HydrophobicContact CB-CG 4.26Å; K74-E77 PolarHBondContact N-OE2 3.14Å; K74-E77 VanDerWaalsContact O-CB 3.29Å; K74-E77 WeakPolarHBondContact O-CB 2.9Å; K74-E77 PolarHBondContact O-N 3Å; K74-E77 VanDerWaalsContact O-N 3.12Å; M75-E77 VanDerWaalsContact C-N 3.25Å; M75-E77 PolarHBondContact O-N 3.2Å; E77-V126 CarbonylContact C-O 3.6Å; E77-V126 VanDerWaalsContact CA-O 3.32Å; E77-V126 WeakPolarHBondContact CA-O 3.25Å; E77-H155 PolarHBondContact O-N 3.01Å
78	A	92.4	Very high	79.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	156	172.5	0	0	0	0	0	110.9	S125 V126 T128 F152 G153 Y158	A78-S125 WeakPolarHBondContact O-CA 3.32Å; A78-V126 HydrophobicContact CB-CG2 4.09Å; A78-V126 PolarHBondContact N-O 3.16Å; A78-V126 PolarHBondContact O-N 3.18Å; A78-T128 HydrophobicContact CB-CG2 3.5Å; A78-F152 HydrophobicContact CB-CB 4.02Å; A78-G153 WeakPolarHBondContact CB-O 3.4Å; A78-Y158 HydrophobicContact CB-CD2 4.16Å; A78-Y158 HydrophobicContact CB-CE2 3.93Å
79	L	93.9	Very high	82.1	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.9	174.1	-178	66	0	0	0	109.8	L73 D123 G156 Y158	L73-L79 HydrophobicContact CD1-CB 4.16Å; L73-L79 HydrophobicContact CD2-CB 4.3Å; L79-D123 HydrophobicContact CD1-CB 4.05Å; L79-G156 PolarHBondContact N-O 3.47Å; L79-Y158 PolarHBondContact O-N 2.83Å
80	L	93.6	Very high	84.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	112.1	172.3	175.3	66.5	0	0	0	109.5	V82 L107 F124 V126 L134 F152 Y158 L160 L175	L80-V82 HydrophobicContact CD2-CG2 4.11Å; L80-V82 HydrophobicContact CG-CG2 4.03Å; L80-L107 HydrophobicContact CD2-CD2 4.42Å; L80-F124 PolarHBondContact N-O 2.87Å; L80-F124 PolarHBondContact O-N 3.41Å; L80-V126 HydrophobicContact CB-CG1 4Å; L80-V126 HydrophobicContact CB-CG2 4.08Å; L80-V126 HydrophobicContact CD2-CG1 3.82Å; L80-L134 HydrophobicContact CD2-CD1 3.59Å; L80-L134 HydrophobicContact CD2-CD2 4.34Å; L80-F152 HydrophobicContact CD1-CE1 4.07Å; L80-F152 HydrophobicContact CD1-CZ 4.28Å; L80-F152 HydrophobicContact CD2-CZ 4.35Å; L80-Y158 WeakPolarHBondContact CA-O 3.36Å; L80-L160 HydrophobicContact CD1-CB 4.12Å; L80-L175 HydrophobicContact CD1-CD1 4.01Å
81	T	93.1	Very high	86.5	Confident	23 Å²	23	45.7 Å²	45.7	14%	0.141	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	115.2	170.9	-58.1	0	0	0	0	109.2	I83 D123 Y158 S159 L160	T81-I83 HydrophobicContact CG2-CD1 4.39Å; T81-I83 HydrophobicContact CG2-CG1 3.97Å; T81-D123 WeakPolarHBondContact CB-OD1 3.24Å; T81-D123 VanDerWaalsContact CG2-OD1 3.26Å; T81-D123 WeakPolarHBondContact CG2-OD1 3.38Å; T81-D123 PolarHBondContact OG1-OD1 2.82Å; T81-Y158 PolarHBondContact N-O 2.95Å; T81-S159 CarbonylContact O-C 3.58Å; T81-S159 VanDerWaalsContact O-CA 3.3Å; T81-S159 WeakPolarHBondContact O-CA 3.44Å; T81-L160 PolarHBondContact O-N 3.18Å
82	V	92.2	Very high	88.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	124.3	175.8	-176.2	0	0	0	0	108.9	L80 V92 V110 S121 A122 F124 L136 L160 M162	L80-V82 HydrophobicContact CD2-CG2 4.11Å; L80-V82 HydrophobicContact CG-CG2 4.03Å; V82-V92 HydrophobicContact CG1-CG2 4.2Å; V82-V92 HydrophobicContact CG2-CG2 4.36Å; V82-V110 HydrophobicContact CB-CG2 3.88Å; V82-V110 HydrophobicContact CG1-CG2 3.79Å; V82-S121 VanDerWaalsContact O-CA 3.32Å; V82-S121 WeakPolarHBondContact O-CA 3.17Å; V82-A122 PolarHBondContact N-O 3.48Å; V82-A122 PolarHBondContact O-N 3.44Å; V82-A122 VanDerWaalsContact O-N 3.09Å; V82-F124 HydrophobicContact CB-CE2 4.16Å; V82-F124 HydrophobicContact CG2-CD2 3.86Å; V82-F124 HydrophobicContact CG2-CE2 3.9Å; V82-L136 HydrophobicContact CG1-CD2 4.07Å; V82-L160 HydrophobicContact CG1-CD2 4.41Å; V82-L160 HydrophobicContact CG2-CB 4.37Å; V82-L160 HydrophobicContact CG2-CD2 4.39Å; V82-M162 HydrophobicContact CG1-CE 3.75Å
83	I	91.3	Very high	89.2	Confident	18 Å²	18	40.4 Å²	40.4	9%	0.092	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.2	-173.8	-57.3	173.4	0	0	0	108.8	T81 P119 L160 W161 M162	T81-I83 HydrophobicContact CG2-CD1 4.39Å; T81-I83 HydrophobicContact CG2-CG1 3.97Å; I83-P119 HydrophobicContact CG2-CB 3.53Å; I83-P119 HydrophobicContact CG2-CG 3.67Å; I83-L160 PolarHBondContact N-O 3.47Å; I83-W161 HydrophobicContact CB-CD2 4.34Å; I83-W161 HydrophobicContact CB-CE3 4.3Å; I83-W161 HydrophobicContact CD1-CD2 3.99Å; I83-W161 VanDerWaalsContact CD1-CE2 3.5Å; I83-W161 HydrophobicContact CD1-CE3 4.36Å; I83-W161 HydrophobicContact CD1-CH2 3.9Å; I83-W161 HydrophobicContact CD1-CZ2 3.46Å; I83-W161 VanDerWaalsContact CD1-CZ2 3.46Å; I83-W161 HydrophobicContact CD1-CZ3 4.33Å; I83-W161 HydrophobicContact CG2-CD2 4.38Å; I83-W161 HydrophobicContact CG2-CE3 3.86Å; I83-W161 HydrophobicContact CG2-CH2 4.34Å; I83-W161 HydrophobicContact CG2-CZ3 3.84Å; I83-M162 PolarHBondContact O-N 3.26Å
84	N	89.7	Confident	89.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107	-175.1	-174.3	24.1	0	0	0	111.7	L86 T88 V110 P111 P119 G120 M162	N84-L86 VanDerWaalsContact C-N 3.33Å; N84-L86 WeakPolarHBondContact OD1-CB 3.23Å; N84-L86 WeakPolarHBondContact OD1-CG 3.46Å; N84-L86 PolarHBondContact OD1-N 2.89Å; N84-T88 PolarHBondContact ND2-O 3.48Å; N84-V110 HydrophobicContact CB-CG1 3.64Å; N84-P111 PolarHBondContact ND2-O 3.02Å; N84-P119 CarbonylContact O-C 3.48Å; N84-P119 VanDerWaalsContact O-CA 3.28Å; N84-P119 WeakPolarHBondContact O-CA 3.15Å; N84-P119 WeakPolarHBondContact O-CB 3.05Å; N84-G120 PolarHBondContact N-O 3.31Å; N84-G120 PolarHBondContact O-N 3.3Å; N84-M162 HydrophobicContact CB-CE 3.47Å; N84-M162 VanDerWaalsContact CB-CE 3.47Å
85	E	85.7	Confident	90	Very high	88 Å²	88	39.6 Å²	39.6	41%	0.411	18%	0.184	S	C	.	.			trans	-88.7	0.3	170.9	-64.7	177.6	-176.7	0	0	112.6	P119 M162	E85-P119 HydrophobicContact CG-CB 3.93Å; E85-M162 WeakPolarHBondContact CB-O 3.3Å
86	L	81.5	Confident	90.2	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.105	19%	0.185	C	C	.	.	S	Bend	trans	-82.8	155.2	-179.7	-52.7	172.4	0	0	0	111.5	N84 T88 I90 G113 I145 N164 T171	N84-L86 VanDerWaalsContact C-N 3.33Å; N84-L86 WeakPolarHBondContact OD1-CB 3.23Å; N84-L86 WeakPolarHBondContact OD1-CG 3.46Å; N84-L86 PolarHBondContact OD1-N 2.89Å; L86-T88 PolarHBondContact O-N 2.9Å; L86-I90 HydrophobicContact CD1-CD1 4.09Å; L86-I90 HydrophobicContact CD1-CG1 4.49Å; L86-G113 PolarHBondContact O-N 3.44Å; L86-G113 VanDerWaalsContact O-N 3.09Å; L86-I145 HydrophobicContact CD1-CD1 4.22Å; L86-N164 HydrophobicContact CD2-CB 4.17Å; L86-T171 HydrophobicContact CD1-CG2 4.46Å; L86-T171 HydrophobicContact CD2-CG2 4.18Å
87	E	81.5	Confident	90.2	Very high	186 Å²	186	44.7 Å²	44.7	87%	0.869	21%	0.209	S	C	*	.	S	Bend	trans	-75.7	-11.2	178.3	-61.8	-178.7	179.9	0	0	112.9	A112	E87-A112 VanDerWaalsContact O-CB 3.26Å; E87-A112 WeakPolarHBondContact O-CB 3.37Å
88	T	84.5	Confident	90	Very high	54 Å²	54	46.6 Å²	46.6	33%	0.331	21%	0.214	S	C	.	.	S	Bend	trans	-105.5	153.3	179.2	59.4	0	0	0	0	112	N84 L86 P140	N84-T88 PolarHBondContact ND2-O 3.48Å; L86-T88 PolarHBondContact O-N 2.9Å; T88-P140 HydrophobicContact CG2-CG 4.5Å
89	K	88.4	Confident	89.8	Confident	130 Å²	130	47 Å²	47	57%	0.565	22%	0.217	S	C	*	.			trans	-70.5	141.3	171.3	-63.4	179.3	-177.2	176.9	0	109.7	A139	K89-A139 HydrophobicContact CB-CB 4.01Å; K89-A139 WeakPolarHBondContact O-CB 2.85Å; K89-A139 PolarHBondContact O-N 2.89Å
90	I	89.3	Confident	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.8	-178.4	-58.4	-51.5	0	0	0	110.6	L86 V92 V109 V110 L136 I145 M162	L86-I90 HydrophobicContact CD1-CD1 4.09Å; L86-I90 HydrophobicContact CD1-CG1 4.49Å; I90-V92 HydrophobicContact CG2-CG2 4.48Å; I90-V109 WeakPolarHBondContact O-CA 3.35Å; I90-V110 HydrophobicContact CB-CB 4.44Å; I90-V110 PolarHBondContact N-O 2.89Å; I90-V110 PolarHBondContact O-N 2.97Å; I90-L136 HydrophobicContact CG2-CB 4.01Å; I90-L136 HydrophobicContact CG2-CD2 4.11Å; I90-L136 HydrophobicContact CG2-CG 4.43Å; I90-I145 HydrophobicContact CD1-CD1 3.29Å; I90-I145 HydrophobicContact CG1-CD1 4.41Å; I90-M162 HydrophobicContact CB-CE 4.2Å; I90-M162 HydrophobicContact CB-SD 4.48Å; I90-M162 HydrophobicContact CG1-CE 3.95Å; I90-M162 HydrophobicContact CG1-SD 4.09Å; I90-M162 HydrophobicContact CG2-CE 4.22Å; I90-M162 HydrophobicContact CG2-SD 4.01Å
91	L	92	Very high	89.4	Confident	40 Å²	40	54.3 Å²	54.3	21%	0.209	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.3	171.6	-59	177.2	0	0	0	108.4	F93 L106 V109 L136 N137 A139	L91-F93 HydrophobicContact CB-CD2 4.28Å; L91-F93 HydrophobicContact CB-CE2 3.56Å; L91-F93 HydrophobicContact CB-CZ 4.14Å; L91-F93 HydrophobicContact CD1-CE2 4.28Å; L91-F93 HydrophobicContact CD1-CZ 4.27Å; L91-L106 HydrophobicContact CB-CD1 4.23Å; L91-L106 HydrophobicContact CD2-CD1 4.39Å; L91-V109 HydrophobicContact CD2-CB 4.35Å; L91-V109 HydrophobicContact CD2-CG1 4.09Å; L91-V109 HydrophobicContact CD2-CG2 3.63Å; L91-L136 WeakPolarHBondContact O-CA 3.43Å; L91-N137 PolarHBondContact N-O 3.45Å; L91-N137 PolarHBondContact O-N 2.89Å; L91-A139 HydrophobicContact CG-CB 4.34Å
92	V	92.3	Very high	89.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.3	178.1	-176.4	0	0	0	0	108	V82 I90 L107 G108 V110 F124 L134 L136	V82-V92 HydrophobicContact CG1-CG2 4.2Å; V82-V92 HydrophobicContact CG2-CG2 4.36Å; I90-V92 HydrophobicContact CG2-CG2 4.48Å; V92-L107 HydrophobicContact CB-CB 4.41Å; V92-L107 HydrophobicContact CG1-CB 4.18Å; V92-L107 HydrophobicContact CG1-CD2 4Å; V92-L107 WeakPolarHBondContact O-CA 3.41Å; V92-L107 WeakPolarHBondContact O-CB 3.32Å; V92-L107 PolarHBondContact O-N 2.98Å; V92-G108 PolarHBondContact N-O 3.03Å; V92-G108 PolarHBondContact O-N 3.04Å; V92-V110 HydrophobicContact CG2-CG2 3.65Å; V92-F124 HydrophobicContact CG2-CE2 4.42Å; V92-L134 HydrophobicContact CG1-CD2 4.46Å; V92-L136 HydrophobicContact CG2-CD2 4.17Å; V92-L136 HydrophobicContact CG2-CG 4.32Å
93	F	93.6	Very high	89.3	Confident	41 Å²	41	56.7 Å²	56.7	18%	0.18	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	155.6	173.3	-61	-92.9	0	0	0	111	L91 Y104 Q105 L106 L134 Q135 N137	L91-F93 HydrophobicContact CB-CD2 4.28Å; L91-F93 HydrophobicContact CB-CE2 3.56Å; L91-F93 HydrophobicContact CB-CZ 4.14Å; L91-F93 HydrophobicContact CD1-CE2 4.28Å; L91-F93 HydrophobicContact CD1-CZ 4.27Å; F93-Y104 HydrophobicContact CB-CD1 4.42Å; F93-Q105 CarbonylContact C-O 3.59Å; F93-Q105 WeakPolarHBondContact CA-O 3.19Å; F93-L106 HydrophobicContact CD1-CB 4.12Å; F93-L106 HydrophobicContact CD1-CD1 4.19Å; F93-L106 HydrophobicContact CE1-CB 3.99Å; F93-L106 HydrophobicContact CE1-CD1 3.85Å; F93-L106 HydrophobicContact CE2-CD1 4.4Å; F93-L106 HydrophobicContact CZ-CD1 3.97Å; F93-L134 CarbonylContact O-C 3.55Å; F93-L134 WeakPolarHBondContact O-CA 3.43Å; F93-Q135 HydrophobicContact CB-CB 4.36Å; F93-Q135 PolarHBondContact N-O 2.84Å; F93-Q135 PolarHBondContact O-N 2.92Å; F93-N137 HydrophobicContact CD2-CB 4.44Å; F93-N137 HydrophobicContact CE2-CB 4.1Å
94	W	93.1	Very high	89.3	Confident	85 Å²	85	58.5 Å²	58.5	32%	0.322	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.1	179.2	77	-78.2	0	0	0	111.8	Q105 L107 I132 T133 L134	W94-Q105 VanDerWaalsContact CD1-O 3.24Å; W94-Q105 PolarHBondContact N-O 3.13Å; W94-Q105 PolarHBondContact O-N 2.75Å; W94-L107 HydrophobicContact CG-CD1 4.45Å; W94-I132 HydrophobicContact CB-CG2 4.04Å; W94-I132 HydrophobicContact CE3-CD1 4.38Å; W94-I132 HydrophobicContact CE3-CG2 4.1Å; W94-T133 CarbonylContact C-O 3.51Å; W94-T133 WeakPolarHBondContact CA-O 3.32Å; W94-L134 HydrophobicContact CB-CD2 3.86Å
95	R	93.6	Very high	89.3	Confident	64 Å²	64	61.8 Å²	61.8	24%	0.242	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	132.2	172.3	-174.7	-177.9	69	176.5	4.1	109.8	C99 C102 Y104 T133	R95-C99 HydrophobicContact CG-CB 4.49Å; R95-C102 VanDerWaalsContact CD-O 3.27Å; R95-C102 WeakPolarHBondContact CD-O 3.32Å; R95-C102 HydrophobicContact CG-CB 4.39Å; R95-Y104 HydrophobicContact CB-CD1 3.63Å; R95-Y104 HydrophobicContact CB-CE1 3.7Å; R95-Y104 HydrophobicContact CB-CG 4.39Å; R95-T133 PolarHBondContact N-O 3.28Å; R95-T133 PolarHBondContact O-N 3.49Å
96	S	91.5	Very high	89.6	Confident	14 Å²	14	62.1 Å²	62.1	10%	0.098	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	143.7	172	-179.4	0	0	0	0	111.3	R98 C99	S96-R98 PolarHBondContact O-N 3.14Å; S96-R98 PolarHBondContact OG-N 2.93Å; S96-C99 WeakPolarHBondContact O-CB 3.48Å; S96-C99 PolarHBondContact O-N 3.24Å
97	E	89.1	Confident	90.1	Very high	122 Å²	122	63 Å²	63	57%	0.57	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-34.6	172.6	-168.7	-160.8	171.8	0	0	112.6	C99 E131	E97-C99 PolarHBondContact O-N 2.54Å; E97-E131 HydrophobicContact CB-CB 4.26Å; E97-E131 PolarHBondContact N-O 3.41Å
98	R	87.4	Confident	90.5	Very high	87 Å²	87	54.9 Å²	54.9	33%	0.328	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-7.1	178.7	-64	-67.3	-70.7	173.4	2.2	113.8	S96 Y100 H130 S289 N292 I480 Y481	S96-R98 PolarHBondContact O-N 3.14Å; S96-R98 PolarHBondContact OG-N 2.93Å; R98-Y100 PolarHBondContact O-N 3.01Å; R98-H130 HydrophobicContact CG-CB 4.09Å; R98-H130 VanDerWaalsContact CG-CD2 3.47Å; R98-H130 WeakPolarHBondContact CG-CD2 3.49Å; R98-H130 VanDerWaalsContact CG-CG 3.49Å; R98-S289 PolarHBondContact NH2-OG 3.5Å; R98-S289 VanDerWaalsContact NH2-OG 3.09Å; R98-N292 PolarHBondContact NH2-O 3.21Å; R98-I480 HydrophobicContact CB-CD1 4.07Å; R98-Y481 PolarHBondContact O-OH 3.05Å
99	C	89.1	Confident	90.8	Very high	8 Å²	8	56 Å²	56	5%	0.054	26%	0.263	C	S	.	.	S	Bend	trans	-93.9	88.3	177.4	-151.4	0	0	0	0	109.9	R95 S96 E97 Q101 C102 I480	R95-C99 HydrophobicContact CG-CB 4.49Å; S96-C99 WeakPolarHBondContact O-CB 3.48Å; S96-C99 PolarHBondContact O-N 3.24Å; E97-C99 PolarHBondContact O-N 2.54Å; C99-Q101 PolarHBondContact O-N 3.24Å; C99-C102 WeakPolarHBondContact CA-SG 3.48Å; C99-C102 HydrophobicContact CB-CB 3.66Å; C99-C102 WeakPolarHBondContact CB-SG 3.39Å; C99-C102 PolarHBondContact O-N 3.43Å; C99-C102 PolarHBondContact O-SG 3.2Å; C99-C102 WeakPolarHBondContact SG-CB 3.36Å; C99-C102 CovalentContact SG-SG 2.01Å; C99-C102 PolarHBondContact SG-SG 3.07Å; C99-I480 HydrophobicContact CB-CG2 3.6Å; C99-I480 VanDerWaalsContact SG-CG2 3.53Å; C99-I480 PolarHBondContact SG-O 3.08Å; C99-I480 VanDerWaalsContact SG-O 3.34Å
100	Y	88.8	Confident	90.9	Very high	69 Å²	69	49.8 Å²	49.8	27%	0.271	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	123.2	-178.6	-175	-105.1	0	0	0	112	R98 C102 Y481 D546	R98-Y100 PolarHBondContact O-N 3.01Å; Y100-C102 PolarHBondContact O-N 3.33Å; Y100-C102 VanDerWaalsContact O-N 3.12Å; Y100-Y481 PolarHBondContact N-OH 3.31Å; Y100-D546 HydrophobicContact CD1-CB 4.03Å; Y100-D546 HydrophobicContact CD2-CB 3.47Å; Y100-D546 VanDerWaalsContact CD2-CB 3.47Å; Y100-D546 HydrophobicContact CE1-CB 4.05Å; Y100-D546 HydrophobicContact CE2-CB 3.51Å; Y100-D546 HydrophobicContact CG-CB 3.74Å
101	Q	88.9	Confident	91	Very high	92 Å²	92	52.7 Å²	52.7	43%	0.43	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	34.6	-179.8	-66	-173.6	-25.3	0	0	114.5	C99 D446 M447	C99-Q101 PolarHBondContact O-N 3.24Å; Q101-D446 PolarHBondContact O-N 2.89Å; Q101-M447 PolarHBondContact O-N 3.42Å
102	C	91.3	Very high	90.7	Very high	2 Å²	2	52 Å²	52	1%	0.014	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-81	148.9	-179.9	-63.9	0	0	0	0	113.8	R95 C99 Y100 I444 Y481	R95-C102 VanDerWaalsContact CD-O 3.27Å; R95-C102 WeakPolarHBondContact CD-O 3.32Å; R95-C102 HydrophobicContact CG-CB 4.39Å; C99-C102 WeakPolarHBondContact CA-SG 3.48Å; C99-C102 HydrophobicContact CB-CB 3.66Å; C99-C102 WeakPolarHBondContact CB-SG 3.39Å; C99-C102 PolarHBondContact O-N 3.43Å; C99-C102 PolarHBondContact O-SG 3.2Å; C99-C102 WeakPolarHBondContact SG-CB 3.36Å; C99-C102 CovalentContact SG-SG 2.01Å; C99-C102 PolarHBondContact SG-SG 3.07Å; Y100-C102 PolarHBondContact O-N 3.33Å; Y100-C102 VanDerWaalsContact O-N 3.12Å; C102-I444 VanDerWaalsContact CA-O 3.27Å; C102-I444 WeakPolarHBondContact CA-O 3.19Å; C102-I444 HydrophobicContact CB-CD1 4.18Å; C102-I444 HydrophobicContact CB-CG1 4.22Å; C102-Y481 WeakPolarHBondContact SG-CD1 3.44Å; C102-Y481 WeakPolarHBondContact SG-CE1 3.11Å
103	L	92.1	Very high	90.1	Very high	71 Å²	71	53.3 Å²	53.3	37%	0.372	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64.1	136.9	165.2	-67.8	176.1	0	0	0	110.9	Q105 I444 M447	L103-Q105 PolarHBondContact O-N 3.09Å; L103-Q105 PolarHBondContact O-NE2 3.11Å; L103-I444 HydrophobicContact CB-CB 4.46Å; L103-I444 PolarHBondContact N-O 3.23Å; L103-M447 HydrophobicContact CD2-CB 4.44Å; L103-M447 HydrophobicContact CD2-CE 4.18Å; L103-M447 WeakPolarHBondContact CD2-O 3.44Å
104	Y	91	Very high	89.2	Confident	56 Å²	56	56.4 Å²	56.4	22%	0.22	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-61.1	134	172.8	-74.9	-86	0	0	0	110.9	F93 R95 T133 Q135 K147	F93-Y104 HydrophobicContact CB-CD1 4.42Å; R95-Y104 HydrophobicContact CB-CD1 3.63Å; R95-Y104 HydrophobicContact CB-CE1 3.7Å; R95-Y104 HydrophobicContact CB-CG 4.39Å; Y104-T133 HydrophobicContact CE1-CG2 4.16Å; Y104-Q135 HydrophobicContact CD1-CB 4.03Å; Y104-Q135 VanDerWaalsContact CD2-OE1 3.28Å; Y104-Q135 HydrophobicContact CE1-CB 3.89Å; Y104-Q135 VanDerWaalsContact CZ-OE1 3.25Å; Y104-K147 VanDerWaalsContact OH-CE 3.25Å; Y104-K147 WeakPolarHBondContact OH-CE 3.5Å; Y104-K147 PolarHBondContact OH-NZ 3.33Å
105	Q	91.3	Very high	88.1	Confident	68 Å²	68	54.9 Å²	54.9	32%	0.318	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140.1	179.2	-62.2	-58.1	-62.7	0	0	109.7	F93 W94 L103 L107 I444	F93-Q105 CarbonylContact C-O 3.59Å; F93-Q105 WeakPolarHBondContact CA-O 3.19Å; W94-Q105 VanDerWaalsContact CD1-O 3.24Å; W94-Q105 PolarHBondContact N-O 3.13Å; W94-Q105 PolarHBondContact O-N 2.75Å; L103-Q105 PolarHBondContact O-N 3.09Å; L103-Q105 PolarHBondContact O-NE2 3.11Å; Q105-L107 PolarHBondContact O-N 2.91Å; Q105-I444 HydrophobicContact CG-CD1 3.92Å
106	L	91.9	Very high	86.9	Confident	95 Å²	95	58.6 Å²	58.6	50%	0.497	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	119.7	176.5	-177.1	69	0	0	0	109.2	L91 F93	L91-L106 HydrophobicContact CB-CD1 4.23Å; L91-L106 HydrophobicContact CD2-CD1 4.39Å; F93-L106 HydrophobicContact CD1-CB 4.12Å; F93-L106 HydrophobicContact CD1-CD1 4.19Å; F93-L106 HydrophobicContact CE1-CB 3.99Å; F93-L106 HydrophobicContact CE1-CD1 3.85Å; F93-L106 HydrophobicContact CE2-CD1 4.4Å; F93-L106 HydrophobicContact CZ-CD1 3.97Å
107	L	90.9	Very high	85.8	Confident	40 Å²	40	61.8 Å²	61.8	21%	0.209	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-41.5	172.8	-170.3	61.8	0	0	0	110.6	L80 V92 W94 Q105 F124 V126 L134	L80-L107 HydrophobicContact CD2-CD2 4.42Å; V92-L107 HydrophobicContact CB-CB 4.41Å; V92-L107 HydrophobicContact CG1-CB 4.18Å; V92-L107 HydrophobicContact CG1-CD2 4Å; V92-L107 WeakPolarHBondContact O-CA 3.41Å; V92-L107 WeakPolarHBondContact O-CB 3.32Å; V92-L107 PolarHBondContact O-N 2.98Å; W94-L107 HydrophobicContact CG-CD1 4.45Å; Q105-L107 PolarHBondContact O-N 2.91Å; L107-F124 HydrophobicContact CD1-CB 4.45Å; L107-F124 HydrophobicContact CD2-CB 3.81Å; L107-F124 HydrophobicContact CD2-CD1 4.37Å; L107-F124 HydrophobicContact CD2-CD2 4.21Å; L107-F124 HydrophobicContact CD2-CG 3.86Å; L107-F124 HydrophobicContact CG-CB 4.03Å; L107-F124 HydrophobicContact CG-CD1 3.89Å; L107-F124 HydrophobicContact CG-CG 3.9Å; L107-V126 HydrophobicContact CD2-CG1 3.97Å; L107-L134 HydrophobicContact CD2-CD2 4.31Å
108	G	90.5	Very high	85.4	Confident	15 Å²	15	61.8 Å²	61.8	16%	0.155	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-171	173.4	0	0	0	0	0	113.4	V92	V92-G108 PolarHBondContact N-O 3.03Å; V92-G108 PolarHBondContact O-N 3.04Å
109	V	91.2	Very high	85.3	Confident	77 Å²	77	60.2 Å²	60.2	47%	0.467	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.9	-174.5	-172.5	0	0	0	0	109.7	I90 L91	I90-V109 WeakPolarHBondContact O-CA 3.35Å; L91-V109 HydrophobicContact CD2-CB 4.35Å; L91-V109 HydrophobicContact CD2-CG1 4.09Å; L91-V109 HydrophobicContact CD2-CG2 3.63Å
110	V	91.1	Very high	85.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.9	176.6	-170.3	0	0	0	0	108.6	V82 N84 I90 V92 A122 F124	V82-V110 HydrophobicContact CB-CG2 3.88Å; V82-V110 HydrophobicContact CG1-CG2 3.79Å; N84-V110 HydrophobicContact CB-CG1 3.64Å; I90-V110 HydrophobicContact CB-CB 4.44Å; I90-V110 PolarHBondContact N-O 2.89Å; I90-V110 PolarHBondContact O-N 2.97Å; V92-V110 HydrophobicContact CG2-CG2 3.65Å; V110-A122 HydrophobicContact CG1-CB 4.43Å; V110-A122 HydrophobicContact CG2-CB 4.18Å; V110-F124 HydrophobicContact CG2-CE2 3.99Å; V110-F124 HydrophobicContact CG2-CZ 4.19Å
111	P	90.1	Very high	85.3	Confident	61 Å²	61	60.3 Å²	60.3	40%	0.396	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-65	158	178.7	27.4	-33.3	0	0	0	111.5	N84	N84-P111 PolarHBondContact ND2-O 3.02Å
112	A	85.4	Confident	85.4	Confident	26 Å²	26	56.9 Å²	56.9	22%	0.215	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-68.7	157.5	170.6	0	0	0	0	0	111.1	E87 S114	E87-A112 VanDerWaalsContact O-CB 3.26Å; E87-A112 WeakPolarHBondContact O-CB 3.37Å; A112-S114 PolarHBondContact O-N 2.75Å
113	G	80.2	Confident	85.4	Confident	26 Å²	26	60.4 Å²	60.4	27%	0.268	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-56.6	133.7	169.6	0	0	0	0	0	111.1	L86 Q118	L86-G113 PolarHBondContact O-N 3.44Å; L86-G113 VanDerWaalsContact O-N 3.09Å; G113-Q118 WeakPolarHBondContact CA-O 3.2Å
114	S	75.1	Confident	85.4	Confident	107 Å²	107	58.3 Å²	58.3	75%	0.748	37%	0.372	S	S	*	.	S	Bend	trans	-80.3	-27.5	-176.4	-59.7	0	0	0	0	112.5	A112 Q118	A112-S114 PolarHBondContact O-N 2.75Å; S114-Q118 PolarHBondContact N-O 3.45Å; S114-Q118 VanDerWaalsContact N-O 3.17Å
115	S	70.3	Confident	85.4	Confident	53 Å²	53	58.4 Å²	58.4	37%	0.371	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-158.8	161.2	176.8	58.3	0	0	0	0	110	G117 Q118	S115-G117 PolarHBondContact O-N 3.35Å; S115-G117 VanDerWaalsContact O-N 3.08Å; S115-Q118 PolarHBondContact O-N 2.75Å; S115-Q118 PolarHBondContact OG-OE1 2.88Å
116	P	67.4	Low	85.5	Confident	142 Å²	142	55.5 Å²	55.5	92%	0.922	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	116.9	173.6	-22.8	32.5	0	0	0	110.5
117	G	69.6	Low	85.4	Confident	81 Å²	81	53 Å²	53	84%	0.835	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	94	-4.1	-177.2	0	0	0	0	0	116.1	S115	S115-G117 PolarHBondContact O-N 3.35Å; S115-G117 VanDerWaalsContact O-N 3.08Å
118	Q	79.3	Confident	85.4	Confident	122 Å²	122	51.8 Å²	51.8	57%	0.57	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-114.1	93	168.7	-73.7	-172.6	-17.9	0	0	110.8	G113 S114 S115	G113-Q118 WeakPolarHBondContact CA-O 3.2Å; S114-Q118 PolarHBondContact N-O 3.45Å; S114-Q118 VanDerWaalsContact N-O 3.17Å; S115-Q118 PolarHBondContact O-N 2.75Å; S115-Q118 PolarHBondContact OG-OE1 2.88Å
119	P	85.4	Confident	85.2	Confident	53 Å²	53	53.2 Å²	53.2	34%	0.344	35%	0.354	S	S	.	.			trans	-69.5	148.8	178.3	28.3	-32.9	0	0	0	111.5	I83 N84 E85	I83-P119 HydrophobicContact CG2-CB 3.53Å; I83-P119 HydrophobicContact CG2-CG 3.67Å; N84-P119 CarbonylContact O-C 3.48Å; N84-P119 VanDerWaalsContact O-CA 3.28Å; N84-P119 WeakPolarHBondContact O-CA 3.15Å; N84-P119 WeakPolarHBondContact O-CB 3.05Å; E85-P119 HydrophobicContact CG-CB 3.93Å
120	G	86.8	Confident	85.1	Confident	6 Å²	6	51.1 Å²	51.1	6%	0.062	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	138.1	166.4	0	0	0	0	0	109.7	N84	N84-G120 PolarHBondContact N-O 3.31Å; N84-G120 PolarHBondContact O-N 3.3Å
121	S	90.7	Very high	85.1	Confident	73 Å²	73	53.6 Å²	53.6	51%	0.51	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.9	177.7	62.3	0	0	0	0	111.7	V82	V82-S121 VanDerWaalsContact O-CA 3.32Å; V82-S121 WeakPolarHBondContact O-CA 3.17Å
122	A	91.3	Very high	85.2	Confident	20 Å²	20	50.9 Å²	50.9	17%	0.165	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.2	168.9	0	0	0	0	0	110.5	V82 V110 F124	V82-A122 PolarHBondContact N-O 3.48Å; V82-A122 PolarHBondContact O-N 3.44Å; V82-A122 VanDerWaalsContact O-N 3.09Å; V110-A122 HydrophobicContact CG1-CB 4.43Å; V110-A122 HydrophobicContact CG2-CB 4.18Å; A122-F124 HydrophobicContact CB-CE1 4.46Å; A122-F124 HydrophobicContact CB-CE2 3.8Å; A122-F124 HydrophobicContact CB-CZ 3.66Å
123	D	92.3	Very high	85.6	Confident	77 Å²	77	49.9 Å²	49.9	41%	0.412	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.6	179.2	-68.5	-21.1	0	0	0	110.3	L79 T81	L79-D123 HydrophobicContact CD1-CB 4.05Å; T81-D123 WeakPolarHBondContact CB-OD1 3.24Å; T81-D123 VanDerWaalsContact CG2-OD1 3.26Å; T81-D123 WeakPolarHBondContact CG2-OD1 3.38Å; T81-D123 PolarHBondContact OG1-OD1 2.82Å
124	F	92.1	Very high	86.2	Confident	27 Å²	27	48.7 Å²	48.7	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.9	178	-56.6	-71.9	0	0	0	110.6	L80 V82 V92 L107 V110 A122	L80-F124 PolarHBondContact N-O 2.87Å; L80-F124 PolarHBondContact O-N 3.41Å; V82-F124 HydrophobicContact CB-CE2 4.16Å; V82-F124 HydrophobicContact CG2-CD2 3.86Å; V82-F124 HydrophobicContact CG2-CE2 3.9Å; V92-F124 HydrophobicContact CG2-CE2 4.42Å; L107-F124 HydrophobicContact CD1-CB 4.45Å; L107-F124 HydrophobicContact CD2-CB 3.81Å; L107-F124 HydrophobicContact CD2-CD1 4.37Å; L107-F124 HydrophobicContact CD2-CD2 4.21Å; L107-F124 HydrophobicContact CD2-CG 3.86Å; L107-F124 HydrophobicContact CG-CB 4.03Å; L107-F124 HydrophobicContact CG-CD1 3.89Å; L107-F124 HydrophobicContact CG-CG 3.9Å; V110-F124 HydrophobicContact CG2-CE2 3.99Å; V110-F124 HydrophobicContact CG2-CZ 4.19Å; A122-F124 HydrophobicContact CB-CE1 4.46Å; A122-F124 HydrophobicContact CB-CE2 3.8Å; A122-F124 HydrophobicContact CB-CZ 3.66Å
125	S	91.6	Very high	87	Confident	57 Å²	57	44.8 Å²	44.8	40%	0.399	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.7	166	55.1	0	0	0	0	109.3	A78	A78-S125 WeakPolarHBondContact O-CA 3.32Å
126	V	91.8	Very high	88	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.8	178.7	-64	0	0	0	0	110.9	E77 A78 L80 L107 I132 F152	E77-V126 CarbonylContact C-O 3.6Å; E77-V126 VanDerWaalsContact CA-O 3.32Å; E77-V126 WeakPolarHBondContact CA-O 3.25Å; A78-V126 HydrophobicContact CB-CG2 4.09Å; A78-V126 PolarHBondContact N-O 3.16Å; A78-V126 PolarHBondContact O-N 3.18Å; L80-V126 HydrophobicContact CB-CG1 4Å; L80-V126 HydrophobicContact CB-CG2 4.08Å; L80-V126 HydrophobicContact CD2-CG1 3.82Å; L107-V126 HydrophobicContact CD2-CG1 3.97Å; V126-I132 HydrophobicContact CB-CD1 4.3Å; V126-F152 HydrophobicContact CB-CD2 4.44Å; V126-F152 HydrophobicContact CG2-CB 4.25Å; V126-F152 HydrophobicContact CG2-CD1 3.96Å; V126-F152 HydrophobicContact CG2-CD2 3.78Å; V126-F152 HydrophobicContact CG2-CE1 4.26Å; V126-F152 HydrophobicContact CG2-CE2 4.1Å; V126-F152 HydrophobicContact CG2-CG 3.71Å; V126-F152 HydrophobicContact CG2-CZ 4.33Å
127	S	90.3	Very high	89.1	Confident	44 Å²	44	36.2 Å²	36.2	31%	0.308	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	145.9	179.1	-173.8	0	0	0	0	112	D76 Q129 I132	D76-S127 WeakPolarHBondContact O-CA 3.48Å; S127-Q129 PolarHBondContact OG-N 3.38Å; S127-I132 WeakPolarHBondContact O-CD1 3.19Å
128	T	90.7	Very high	89.9	Confident	13 Å²	13	33.1 Å²	33.1	8%	0.08	19%	0.19	C	C	.	.			trans	-110.6	5.3	-179.8	65.1	0	0	0	0	113.2	D76 A78 F152 G153	D76-T128 VanDerWaalsContact CA-OG1 3.28Å; D76-T128 WeakPolarHBondContact CA-OG1 3.26Å; D76-T128 PolarHBondContact O-N 3.35Å; D76-T128 PolarHBondContact O-OG1 2.97Å; A78-T128 HydrophobicContact CB-CG2 3.5Å; T128-F152 WeakPolarHBondContact CA-O 3.33Å; T128-F152 WeakPolarHBondContact CB-O 3.45Å; T128-F152 HydrophobicContact CG2-CB 3.97Å; T128-G153 WeakPolarHBondContact CG2-O 3.03Å
129	Q	86.9	Confident	90	Very high	45 Å²	45	29.4 Å²	29.4	21%	0.21	18%	0.18	C	C	.	.	S	Bend	trans	-72.5	-35.7	-177.2	-68.2	172.8	7.4	0	0	112.5	D76 S127 W284	D76-Q129 HydrophobicContact CB-CG 3.83Å; D76-Q129 PolarHBondContact OD2-NE2 3.13Å; S127-Q129 PolarHBondContact OG-N 3.38Å; Q129-W284 HydrophobicContact CB-CB 4.36Å; Q129-W284 HydrophobicContact CG-CB 4.48Å
130	H	88.6	Confident	89.4	Confident	34 Å²	34	31.2 Å²	31.2	16%	0.157	19%	0.192	C	C	.	.	S	Bend	trans	-143.1	162.1	-173.1	-60.2	-49.5	0	0	0	110	R98 W284	R98-H130 HydrophobicContact CG-CB 4.09Å; R98-H130 VanDerWaalsContact CG-CD2 3.47Å; R98-H130 WeakPolarHBondContact CG-CD2 3.49Å; R98-H130 VanDerWaalsContact CG-CG 3.49Å; H130-W284 AromaticContact CE1-CE3 3.74Å
131	E	90.9	Very high	88.6	Confident	52 Å²	52	37.9 Å²	37.9	24%	0.243	22%	0.221	C	C	.	.			trans	-63.1	138.8	174.8	-164.1	173.9	-157.8	0	0	111	E97 Q149 H151	E97-E131 HydrophobicContact CB-CB 4.26Å; E97-E131 PolarHBondContact N-O 3.41Å; E131-Q149 HydrophobicContact CG-CG 3.88Å; E131-Q149 WeakPolarHBondContact OE1-CG 3.44Å; E131-Q149 PolarHBondContact OE1-NE2 3.08Å; E131-Q149 PolarHBondContact OE2-NE2 2.99Å; E131-H151 HydrophobicContact CB-CB 4.47Å; E131-H151 HydrophobicContact CG-CB 4.3Å
132	I	93	Very high	87.9	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.6	-179.6	-62	176.7	0	0	0	108.9	W94 V126 S127 L134 F150 F152	W94-I132 HydrophobicContact CB-CG2 4.04Å; W94-I132 HydrophobicContact CE3-CD1 4.38Å; W94-I132 HydrophobicContact CE3-CG2 4.1Å; V126-I132 HydrophobicContact CB-CD1 4.3Å; S127-I132 WeakPolarHBondContact O-CD1 3.19Å; I132-L134 HydrophobicContact CG2-CD2 4.09Å; I132-L134 HydrophobicContact CG2-CG 4.41Å; I132-F150 PolarHBondContact N-O 2.94Å; I132-F150 PolarHBondContact O-N 2.76Å; I132-F152 HydrophobicContact CB-CD2 4.48Å; I132-F152 HydrophobicContact CB-CE2 4.3Å; I132-F152 HydrophobicContact CD1-CD2 4.39Å
133	T	93.4	Very high	87.4	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.6	166.5	-52.6	0	0	0	0	109	W94 R95 Y104 K147 V148	W94-T133 CarbonylContact C-O 3.51Å; W94-T133 WeakPolarHBondContact CA-O 3.32Å; R95-T133 PolarHBondContact N-O 3.28Å; R95-T133 PolarHBondContact O-N 3.49Å; Y104-T133 HydrophobicContact CE1-CG2 4.16Å; T133-K147 HydrophobicContact CG2-CD 4.17Å; T133-K147 HydrophobicContact CG2-CG 3.73Å; T133-V148 CarbonylContact C-O 3.6Å; T133-V148 WeakPolarHBondContact CA-O 3.43Å
134	L	93.1	Very high	87	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.6	170.7	-61.9	173	0	0	0	109.3	L80 V92 F93 W94 L107 I132 L136 K147 V148 F152 L160	L80-L134 HydrophobicContact CD2-CD1 3.59Å; L80-L134 HydrophobicContact CD2-CD2 4.34Å; V92-L134 HydrophobicContact CG1-CD2 4.46Å; F93-L134 CarbonylContact O-C 3.55Å; F93-L134 WeakPolarHBondContact O-CA 3.43Å; W94-L134 HydrophobicContact CB-CD2 3.86Å; L107-L134 HydrophobicContact CD2-CD2 4.31Å; I132-L134 HydrophobicContact CG2-CD2 4.09Å; I132-L134 HydrophobicContact CG2-CG 4.41Å; L134-L136 HydrophobicContact CB-CD1 4.2Å; L134-K147 CarbonylContact O-C 3.54Å; L134-K147 VanDerWaalsContact O-CA 3.32Å; L134-K147 WeakPolarHBondContact O-CA 3.38Å; L134-V148 PolarHBondContact N-O 2.92Å; L134-V148 PolarHBondContact O-N 3.5Å; L134-F152 HydrophobicContact CD1-CE2 4.42Å; L134-F152 HydrophobicContact CD1-CZ 3.99Å; L134-L160 HydrophobicContact CD1-CD2 4.33Å
135	Q	92.3	Very high	86.7	Confident	24 Å²	24	44 Å²	44	11%	0.112	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.7	174.6	175.7	174.2	-9.7	0	0	108.6	F93 Y104 N137 E144	F93-Q135 HydrophobicContact CB-CB 4.36Å; F93-Q135 PolarHBondContact N-O 2.84Å; F93-Q135 PolarHBondContact O-N 2.92Å; Y104-Q135 HydrophobicContact CD1-CB 4.03Å; Y104-Q135 VanDerWaalsContact CD2-OE1 3.28Å; Y104-Q135 HydrophobicContact CE1-CB 3.89Å; Y104-Q135 VanDerWaalsContact CZ-OE1 3.25Å; Q135-N137 WeakPolarHBondContact CG-OD1 3.38Å; Q135-N137 PolarHBondContact NE2-ND2 3.46Å; Q135-N137 PolarHBondContact NE2-OD1 3.5Å; Q135-N137 VanDerWaalsContact NE2-OD1 3.09Å; Q135-E144 HydrophobicContact CG-CG 4.29Å
136	L	90.6	Very high	86.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.6	-177.6	-68.5	88.5	0	0	0	108.9	V82 I90 L91 V92 L134 I145 C146 L160 M162	V82-L136 HydrophobicContact CG1-CD2 4.07Å; I90-L136 HydrophobicContact CG2-CB 4.01Å; I90-L136 HydrophobicContact CG2-CD2 4.11Å; I90-L136 HydrophobicContact CG2-CG 4.43Å; L91-L136 WeakPolarHBondContact O-CA 3.43Å; V92-L136 HydrophobicContact CG2-CD2 4.17Å; V92-L136 HydrophobicContact CG2-CG 4.32Å; L134-L136 HydrophobicContact CB-CD1 4.2Å; L136-I145 WeakPolarHBondContact O-CB 3.47Å; L136-I145 PolarHBondContact O-N 3.12Å; L136-C146 PolarHBondContact N-O 3.45Å; L136-L160 HydrophobicContact CD1-CD2 3.81Å; L136-L160 HydrophobicContact CD2-CD2 3.85Å; L136-L160 HydrophobicContact CG-CD2 4.49Å; L136-M162 HydrophobicContact CD2-CE 4.14Å; L136-M162 HydrophobicContact CD2-CG 4.18Å; L136-M162 HydrophobicContact CD2-SD 3.33Å; L136-M162 WeakPolarHBondContact CD2-SD 3.45Å
137	N	90.5	Very high	86.3	Confident	15 Å²	15	46.8 Å²	46.8	8%	0.08	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.4	-177.9	-63.6	-9.6	0	0	0	110.6	L91 F93 Q135 Q143 E144	L91-N137 PolarHBondContact N-O 3.45Å; L91-N137 PolarHBondContact O-N 2.89Å; F93-N137 HydrophobicContact CD2-CB 4.44Å; F93-N137 HydrophobicContact CE2-CB 4.1Å; Q135-N137 WeakPolarHBondContact CG-OD1 3.38Å; Q135-N137 PolarHBondContact NE2-ND2 3.46Å; Q135-N137 PolarHBondContact NE2-OD1 3.5Å; Q135-N137 VanDerWaalsContact NE2-OD1 3.09Å; N137-Q143 VanDerWaalsContact CA-O 3.3Å; N137-Q143 WeakPolarHBondContact CA-O 3.3Å; N137-E144 WeakPolarHBondContact OD1-CA 3.34Å
138	S	86.4	Confident	86.4	Confident	17 Å²	17	45.7 Å²	45.7	12%	0.119	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131	172.7	-164.5	0	0	0	0	110.2	P140 A142 Q143	S138-P140 WeakPolarHBondContact OG-CD 3.34Å; S138-A142 VanDerWaalsContact O-CA 3.28Å; S138-A142 WeakPolarHBondContact O-CA 3.02Å; S138-A142 PolarHBondContact O-N 2.92Å; S138-Q143 PolarHBondContact N-O 2.84Å
139	A	81.1	Confident	86.5	Confident	43 Å²	43	50.2 Å²	50.2	36%	0.355	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-39	-179	0	0	0	0	0	116.3	K89 L91	K89-A139 HydrophobicContact CB-CB 4.01Å; K89-A139 WeakPolarHBondContact O-CB 2.85Å; K89-A139 PolarHBondContact O-N 2.89Å; L91-A139 HydrophobicContact CG-CB 4.34Å
140	P	72.4	Confident	86.7	Confident	92 Å²	92	51.1 Å²	51.1	60%	0.597	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-28.2	-176.5	24.6	-33.6	0	0	0	115.1	T88 S138	T88-P140 HydrophobicContact CG2-CG 4.5Å; S138-P140 WeakPolarHBondContact OG-CD 3.34Å
141	E	70.8	Confident	86.9	Confident	145 Å²	145	54.3 Å²	54.3	68%	0.678	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	-1.6	-171.2	-67.7	176.8	-177.8	0	0	113.6	Q143	E141-Q143 HydrophobicContact CB-CB 4.41Å; E141-Q143 PolarHBondContact O-N 3.23Å
142	A	75.3	Confident	86.9	Confident	66 Å²	66	51.9 Å²	51.9	55%	0.545	27%	0.273	S	S	.	.			trans	50.1	20.2	-172.4	0	0	0	0	0	114	S138 E144	S138-A142 VanDerWaalsContact O-CA 3.28Å; S138-A142 WeakPolarHBondContact O-CA 3.02Å; S138-A142 PolarHBondContact O-N 2.92Å; A142-E144 PolarHBondContact O-N 3.42Å
143	Q	81.1	Confident	86.8	Confident	123 Å²	123	52.4 Å²	52.4	58%	0.575	28%	0.279	S	S	*	.			trans	-69	131.8	178.3	-173	175.4	1.9	0	0	109.5	N137 S138 E141 I145	N137-Q143 VanDerWaalsContact CA-O 3.3Å; N137-Q143 WeakPolarHBondContact CA-O 3.3Å; S138-Q143 PolarHBondContact N-O 2.84Å; E141-Q143 HydrophobicContact CB-CB 4.41Å; E141-Q143 PolarHBondContact O-N 3.23Å; Q143-I145 PolarHBondContact O-N 2.91Å
144	E	85	Confident	86.6	Confident	100 Å²	100	52.8 Å²	52.8	47%	0.467	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	117.9	174.6	-176.3	177	154.9	0	0	109.5	Q135 N137 A142 K147	Q135-E144 HydrophobicContact CG-CG 4.29Å; N137-E144 WeakPolarHBondContact OD1-CA 3.34Å; A142-E144 PolarHBondContact O-N 3.42Å; E144-K147 WeakPolarHBondContact OE1-CB 3.43Å
145	I	84.5	Confident	86.5	Confident	36 Å²	36	55.6 Å²	55.6	19%	0.185	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-53.7	178.1	-61.8	176.1	0	0	0	108.6	L86 I90 L136 Q143 T171	L86-I145 HydrophobicContact CD1-CD1 4.22Å; I90-I145 HydrophobicContact CD1-CD1 3.29Å; I90-I145 HydrophobicContact CG1-CD1 4.41Å; L136-I145 WeakPolarHBondContact O-CB 3.47Å; L136-I145 PolarHBondContact O-N 3.12Å; Q143-I145 PolarHBondContact O-N 2.91Å; I145-T171 HydrophobicContact CG2-CG2 4.21Å; I145-T171 WeakPolarHBondContact CG2-OG1 3.33Å
146	C	86.6	Confident	86.4	Confident	16 Å²	16	54.4 Å²	54.4	11%	0.108	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	157.4	179.3	70.9	0	0	0	0	112.4	L136 C173	L136-C146 PolarHBondContact N-O 3.45Å; C146-C173 HydrophobicContact CB-CB 3.64Å; C146-C173 WeakPolarHBondContact CB-SG 3.39Å; C146-C173 WeakPolarHBondContact SG-CB 3.41Å; C146-C173 CovalentContact SG-SG 2.02Å; C146-C173 PolarHBondContact SG-SG 3.46Å
147	K	89.8	Confident	86.5	Confident	107 Å²	107	55.9 Å²	55.9	47%	0.465	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	121.8	178.8	-173.8	178.5	-178.6	-179.9	0	109.1	Y104 T133 L134 E144	Y104-K147 VanDerWaalsContact OH-CE 3.25Å; Y104-K147 WeakPolarHBondContact OH-CE 3.5Å; Y104-K147 PolarHBondContact OH-NZ 3.33Å; T133-K147 HydrophobicContact CG2-CD 4.17Å; T133-K147 HydrophobicContact CG2-CG 3.73Å; L134-K147 CarbonylContact O-C 3.54Å; L134-K147 VanDerWaalsContact O-CA 3.32Å; L134-K147 WeakPolarHBondContact O-CA 3.38Å; E144-K147 WeakPolarHBondContact OE1-CB 3.43Å
148	V	90.9	Very high	86.6	Confident	22 Å²	22	55.5 Å²	55.5	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.6	-177.3	-178.7	0	0	0	0	108.4	T133 L134 F150 L160 C173	T133-V148 CarbonylContact C-O 3.6Å; T133-V148 WeakPolarHBondContact CA-O 3.43Å; L134-V148 PolarHBondContact N-O 2.92Å; L134-V148 PolarHBondContact O-N 3.5Å; V148-F150 HydrophobicContact CG1-CB 4.48Å; V148-L160 HydrophobicContact CG2-CD1 4.18Å; V148-C173 HydrophobicContact CG2-CB 3.94Å
149	Q	92.5	Very high	87	Confident	108 Å²	108	54.9 Å²	54.9	51%	0.505	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.9	173.1	-166.7	179.9	-24.1	0	0	107.9	E131	E131-Q149 HydrophobicContact CG-CG 3.88Å; E131-Q149 WeakPolarHBondContact OE1-CG 3.44Å; E131-Q149 PolarHBondContact OE1-NE2 3.08Å; E131-Q149 PolarHBondContact OE2-NE2 2.99Å
150	F	92.1	Very high	87.5	Confident	64 Å²	64	52.8 Å²	52.8	28%	0.281	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	146.3	-176.3	-166	-99.9	0	0	0	112.2	I132 V148 F152 Y158 L175	I132-F150 PolarHBondContact N-O 2.94Å; I132-F150 PolarHBondContact O-N 2.76Å; V148-F150 HydrophobicContact CG1-CB 4.48Å; F150-F152 HydrophobicContact CB-CE2 4.45Å; F150-F152 HydrophobicContact CB-CZ 4.39Å; F150-F152 AromaticContact CD1-CD1 3.8Å; F150-F152 HydrophobicContact CD1-CD1 3.8Å; F150-F152 HydrophobicContact CD1-CD2 4.39Å; F150-F152 AromaticContact CD1-CE1 3.81Å; F150-F152 HydrophobicContact CD1-CE1 3.81Å; F150-F152 HydrophobicContact CD1-CE2 4.38Å; F150-F152 HydrophobicContact CD1-CG 4.11Å; F150-F152 HydrophobicContact CD1-CZ 4.1Å; F150-F152 HydrophobicContact CE1-CD1 4.15Å; F150-F152 HydrophobicContact CE1-CE1 4.39Å; F150-Y158 AromaticContact CE1-CD1 3.93Å; F150-Y158 HydrophobicContact CE1-CD1 3.93Å; F150-Y158 AromaticContact CE1-CE1 3.59Å; F150-Y158 HydrophobicContact CE1-CE1 3.59Å; F150-Y158 HydrophobicContact CZ-CD1 4.41Å; F150-Y158 HydrophobicContact CZ-CE1 4.02Å; F150-L175 HydrophobicContact CB-CD2 3.71Å; F150-L175 HydrophobicContact CD1-CD2 3.33Å; F150-L175 HydrophobicContact CD2-CD2 3.37Å; F150-L175 HydrophobicContact CE1-CD2 3.67Å; F150-L175 HydrophobicContact CE2-CD2 3.7Å; F150-L175 HydrophobicContact CG-CD2 3.16Å; F150-L175 HydrophobicContact CZ-CD2 3.84Å
151	H	92.8	Very high	88.3	Confident	101 Å²	101	52 Å²	52	47%	0.468	26%	0.257	S	S	.	.			trans	-101.7	104.2	175	-176.4	-78.1	0	0	0	110.2	E131	E131-H151 HydrophobicContact CB-CB 4.47Å; E131-H151 HydrophobicContact CG-CB 4.3Å
152	F	91.6	Very high	89	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-74.1	139.5	178.5	-61.6	-80.6	0	0	0	111.2	A78 L80 V126 T128 I132 L134 F150 Y158 L175	A78-F152 HydrophobicContact CB-CB 4.02Å; L80-F152 HydrophobicContact CD1-CE1 4.07Å; L80-F152 HydrophobicContact CD1-CZ 4.28Å; L80-F152 HydrophobicContact CD2-CZ 4.35Å; V126-F152 HydrophobicContact CB-CD2 4.44Å; V126-F152 HydrophobicContact CG2-CB 4.25Å; V126-F152 HydrophobicContact CG2-CD1 3.96Å; V126-F152 HydrophobicContact CG2-CD2 3.78Å; V126-F152 HydrophobicContact CG2-CE1 4.26Å; V126-F152 HydrophobicContact CG2-CE2 4.1Å; V126-F152 HydrophobicContact CG2-CG 3.71Å; V126-F152 HydrophobicContact CG2-CZ 4.33Å; T128-F152 WeakPolarHBondContact CA-O 3.33Å; T128-F152 WeakPolarHBondContact CB-O 3.45Å; T128-F152 HydrophobicContact CG2-CB 3.97Å; I132-F152 HydrophobicContact CB-CD2 4.48Å; I132-F152 HydrophobicContact CB-CE2 4.3Å; I132-F152 HydrophobicContact CD1-CD2 4.39Å; L134-F152 HydrophobicContact CD1-CE2 4.42Å; L134-F152 HydrophobicContact CD1-CZ 3.99Å; F150-F152 HydrophobicContact CB-CE2 4.45Å; F150-F152 HydrophobicContact CB-CZ 4.39Å; F150-F152 AromaticContact CD1-CD1 3.8Å; F150-F152 HydrophobicContact CD1-CD1 3.8Å; F150-F152 HydrophobicContact CD1-CD2 4.39Å; F150-F152 AromaticContact CD1-CE1 3.81Å; F150-F152 HydrophobicContact CD1-CE1 3.81Å; F150-F152 HydrophobicContact CD1-CE2 4.38Å; F150-F152 HydrophobicContact CD1-CG 4.11Å; F150-F152 HydrophobicContact CD1-CZ 4.1Å; F150-F152 HydrophobicContact CE1-CD1 4.15Å; F150-F152 HydrophobicContact CE1-CE1 4.39Å; F152-Y158 HydrophobicContact CB-CE2 4.21Å; F152-Y158 HydrophobicContact CD1-CD1 4.3Å; F152-Y158 AromaticContact CD1-CD2 3.5Å; F152-Y158 HydrophobicContact CD1-CD2 3.5Å; F152-Y158 AromaticContact CD1-CE2 3.76Å; F152-Y158 HydrophobicContact CD1-CE2 3.76Å; F152-Y158 AromaticContact CD1-CG 3.78Å; F152-Y158 HydrophobicContact CD1-CG 3.78Å; F152-Y158 HydrophobicContact CE1-CD2 4.12Å; F152-Y158 AromaticContact CE1-CG 3.99Å; F152-Y158 HydrophobicContact CE1-CG 3.99Å; F152-L175 HydrophobicContact CE1-CD1 4.46Å; F152-L175 HydrophobicContact CE1-CD2 4.32Å
153	G	89.7	Confident	89.2	Confident	14 Å²	14	46.6 Å²	46.6	14%	0.144	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-97.2	150.3	173.7	0	0	0	0	0	112	A78 T128 H155 G156 Y158 P181	A78-G153 WeakPolarHBondContact CB-O 3.4Å; T128-G153 WeakPolarHBondContact CG2-O 3.03Å; G153-H155 PolarHBondContact O-N 3.43Å; G153-G156 PolarHBondContact O-N 3.37Å; G153-Y158 PolarHBondContact N-OH 3.48Å; G153-P181 VanDerWaalsContact C-CB 3.48Å
154	E	89.9	Confident	88.6	Confident	13 Å²	13	45.9 Å²	45.9	6%	0.061	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	131.7	-175.1	-170	173.5	179.5	0	0	112.3	M75 D76 G156 V182 S184 H624	M75-E154 WeakPolarHBondContact CA-OE1 3.44Å; D76-E154 PolarHBondContact N-OE1 3.13Å; E154-G156 PolarHBondContact O-N 2.69Å; E154-V182 PolarHBondContact O-N 3.42Å; E154-S184 WeakPolarHBondContact OE2-CB 3.19Å; E154-H624 IonicContact OE1-CD2 3.1Å; E154-H624 IonicContact OE2-CD2 3.49Å; E154-H624 PolarHBondContact OE2-CD2 2.72Å; E154-H624 VanDerWaalsContact OE2-CD2 3.32Å; E154-H624 IonicContact OE2-NE2 3.7Å
155	H	90.1	Very high	87.6	Confident	60 Å²	60	45.2 Å²	45.2	28%	0.278	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	16.6	-175.3	-57.9	158.1	0	0	0	114.9	E77 G153 V182	E77-H155 PolarHBondContact O-N 3.01Å; G153-H155 PolarHBondContact O-N 3.43Å; H155-V182 HydrophobicContact CB-CG2 4.3Å
156	G	89.9	Confident	86.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.			trans	-69.2	148.9	170.7	0	0	0	0	0	111.3	L79 G153 E154	L79-G156 PolarHBondContact N-O 3.47Å; G153-G156 PolarHBondContact O-N 3.37Å; E154-G156 PolarHBondContact O-N 2.69Å
157	N	93.4	Very high	84.6	Confident	30 Å²	30	57.2 Å²	57.2	16%	0.16	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.8	174.2	-177.6	-15.9	0	0	0	108.9	N178 S179	N157-N178 HydrophobicContact CB-CB 4.27Å; N157-N178 WeakPolarHBondContact O-CA 3.48Å; N157-N178 WeakPolarHBondContact O-CB 3.24Å; N157-N178 PolarHBondContact O-N 3.34Å; N157-N178 PolarHBondContact OD1-ND2 3.39Å; N157-S179 PolarHBondContact N-O 3.15Å; N157-S179 PolarHBondContact O-N 3.41Å
158	Y	93.7	Very high	83	Confident	7 Å²	7	59 Å²	59	3%	0.027	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.6	-174.4	-57.7	-87.2	0	0	0	110.5	A78 L79 L80 T81 F150 F152 G153 V176 T177	A78-Y158 HydrophobicContact CB-CD2 4.16Å; A78-Y158 HydrophobicContact CB-CE2 3.93Å; L79-Y158 PolarHBondContact O-N 2.83Å; L80-Y158 WeakPolarHBondContact CA-O 3.36Å; T81-Y158 PolarHBondContact N-O 2.95Å; F150-Y158 AromaticContact CE1-CD1 3.93Å; F150-Y158 HydrophobicContact CE1-CD1 3.93Å; F150-Y158 AromaticContact CE1-CE1 3.59Å; F150-Y158 HydrophobicContact CE1-CE1 3.59Å; F150-Y158 HydrophobicContact CZ-CD1 4.41Å; F150-Y158 HydrophobicContact CZ-CE1 4.02Å; F152-Y158 HydrophobicContact CB-CE2 4.21Å; F152-Y158 HydrophobicContact CD1-CD1 4.3Å; F152-Y158 AromaticContact CD1-CD2 3.5Å; F152-Y158 HydrophobicContact CD1-CD2 3.5Å; F152-Y158 AromaticContact CD1-CE2 3.76Å; F152-Y158 HydrophobicContact CD1-CE2 3.76Å; F152-Y158 AromaticContact CD1-CG 3.78Å; F152-Y158 HydrophobicContact CD1-CG 3.78Å; F152-Y158 HydrophobicContact CE1-CD2 4.12Å; F152-Y158 AromaticContact CE1-CG 3.99Å; F152-Y158 HydrophobicContact CE1-CG 3.99Å; G153-Y158 PolarHBondContact N-OH 3.48Å; Y158-V176 CarbonylContact C-O 3.49Å; Y158-V176 WeakPolarHBondContact CA-O 3.38Å; Y158-T177 HydrophobicContact CD1-CG2 4.11Å; Y158-T177 HydrophobicContact CE1-CG2 3.78Å; Y158-T177 WeakPolarHBondContact CE1-OG1 3.43Å
159	S	93	Very high	81.3	Confident	4 Å²	4	63.4 Å²	63.4	3%	0.028	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.7	171	55.2	0	0	0	0	111.2	T81 W161 V176 N178	T81-S159 CarbonylContact O-C 3.58Å; T81-S159 VanDerWaalsContact O-CA 3.3Å; T81-S159 WeakPolarHBondContact O-CA 3.44Å; S159-W161 PolarHBondContact OG-NE1 3.06Å; S159-W161 VanDerWaalsContact OG-NE1 3.1Å; S159-V176 PolarHBondContact N-O 3.3Å; S159-V176 PolarHBondContact O-N 3.15Å; S159-N178 WeakPolarHBondContact CB-ND2 3.29Å; S159-N178 PolarHBondContact N-ND2 3.02Å; S159-N178 PolarHBondContact OG-ND2 3.32Å; S159-N178 PolarHBondContact OG-OD1 2.94Å
160	L	92.3	Very high	79.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112.5	173.5	-179.5	63.9	0	0	0	109.2	L80 T81 V82 I83 L134 L136 V148 C173 L175	L80-L160 HydrophobicContact CD1-CB 4.12Å; T81-L160 PolarHBondContact O-N 3.18Å; V82-L160 HydrophobicContact CG1-CD2 4.41Å; V82-L160 HydrophobicContact CG2-CB 4.37Å; V82-L160 HydrophobicContact CG2-CD2 4.39Å; I83-L160 PolarHBondContact N-O 3.47Å; L134-L160 HydrophobicContact CD1-CD2 4.33Å; L136-L160 HydrophobicContact CD1-CD2 3.81Å; L136-L160 HydrophobicContact CD2-CD2 3.85Å; L136-L160 HydrophobicContact CG-CD2 4.49Å; V148-L160 HydrophobicContact CG2-CD1 4.18Å; L160-C173 HydrophobicContact CD1-CB 4.31Å; L160-L175 HydrophobicContact CB-CD1 3.9Å; L160-L175 HydrophobicContact CD1-CB 4.19Å; L160-L175 HydrophobicContact CD1-CD1 4.02Å
161	W	88.6	Confident	78.2	Confident	76 Å²	76	63 Å²	63	29%	0.288	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.4	-178.4	-68.3	78.3	0	0	0	111	I83 S159 C173 S174	I83-W161 HydrophobicContact CB-CD2 4.34Å; I83-W161 HydrophobicContact CB-CE3 4.3Å; I83-W161 HydrophobicContact CD1-CD2 3.99Å; I83-W161 VanDerWaalsContact CD1-CE2 3.5Å; I83-W161 HydrophobicContact CD1-CE3 4.36Å; I83-W161 HydrophobicContact CD1-CH2 3.9Å; I83-W161 HydrophobicContact CD1-CZ2 3.46Å; I83-W161 VanDerWaalsContact CD1-CZ2 3.46Å; I83-W161 HydrophobicContact CD1-CZ3 4.33Å; I83-W161 HydrophobicContact CG2-CD2 4.38Å; I83-W161 HydrophobicContact CG2-CE3 3.86Å; I83-W161 HydrophobicContact CG2-CH2 4.34Å; I83-W161 HydrophobicContact CG2-CZ3 3.84Å; S159-W161 PolarHBondContact OG-NE1 3.06Å; S159-W161 VanDerWaalsContact OG-NE1 3.1Å; W161-C173 WeakPolarHBondContact O-CA 3.41Å; W161-S174 PolarHBondContact N-O 2.99Å; W161-S174 PolarHBondContact O-N 3.35Å
162	M	86.1	Confident	77.5	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.9	170.4	-65.6	179.6	-72.8	0	0	109.1	V82 I83 N84 E85 I90 L136	V82-M162 HydrophobicContact CG1-CE 3.75Å; I83-M162 PolarHBondContact O-N 3.26Å; N84-M162 HydrophobicContact CB-CE 3.47Å; N84-M162 VanDerWaalsContact CB-CE 3.47Å; E85-M162 WeakPolarHBondContact CB-O 3.3Å; I90-M162 HydrophobicContact CB-CE 4.2Å; I90-M162 HydrophobicContact CB-SD 4.48Å; I90-M162 HydrophobicContact CG1-CE 3.95Å; I90-M162 HydrophobicContact CG1-SD 4.09Å; I90-M162 HydrophobicContact CG2-CE 4.22Å; I90-M162 HydrophobicContact CG2-SD 4.01Å; L136-M162 HydrophobicContact CD2-CE 4.14Å; L136-M162 HydrophobicContact CD2-CG 4.18Å; L136-M162 HydrophobicContact CD2-SD 3.33Å; L136-M162 WeakPolarHBondContact CD2-SD 3.45Å
163	K	78.8	Confident	77.1	Confident	96 Å²	96	63.4 Å²	63.4	42%	0.417	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.1	-179.7	-63.5	-171	175	-179.8	0	111.6	N172	K163-N172 PolarHBondContact N-O 3.42Å; K163-N172 VanDerWaalsContact N-O 3.12Å; K163-N172 PolarHBondContact O-N 3.47Å; K163-N172 VanDerWaalsContact O-N 3.16Å
164	N	70.2	Confident	77	Confident	108 Å²	108	64.9 Å²	64.9	58%	0.578	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	116	170.3	-164.7	2.4	0	0	0	109	L86	L86-N164 HydrophobicContact CD2-CB 4.17Å
165	L	63.3	Low	76.9	Confident	85 Å²	85	66.2 Å²	66.2	45%	0.445	36%	0.36	S	S	.	.			trans	-83.3	140	171	-78.8	141.7	0	0	0	109.2	N167 L170 N172	L165-N167 CarbonylContact O-C 3.57Å; L165-N167 PolarHBondContact O-N 2.94Å; L165-L170 WeakPolarHBondContact CB-O 3.46Å; L165-N172 HydrophobicContact CD1-CB 3.64Å
166	N	56.2	Low	77	Confident	167 Å²	167	66.4 Å²	66.4	89%	0.893	37%	0.366	S	S	*	.	S	Bend	trans	-59.8	3.6	-173.2	-69.8	-16.8	0	0	0	116.2
167	N	51.8	Low	77	Confident	138 Å²	138	69.7 Å²	69.7	74%	0.738	39%	0.386	S	S	*	.	S	Bend	trans	-113.7	116.5	169	-89.3	-13.5	0	0	0	110	L165 S169	L165-N167 CarbonylContact O-C 3.57Å; L165-N167 PolarHBondContact O-N 2.94Å; N167-S169 PolarHBondContact O-N 3.2Å
168	V	57.1	Low	76.8	Confident	144 Å²	144	72.1 Å²	72.1	87%	0.873	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.3	116.9	179.8	-174.7	0	0	0	0	111.2
169	S	53.9	Low	76.6	Confident	114 Å²	114	74.6 Å²	74.6	80%	0.797	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.4	-7.8	169.4	74.4	0	0	0	0	120.1	N167	N167-S169 PolarHBondContact O-N 3.2Å
170	L	55	Low	76.3	Confident	122 Å²	122	82.8 Å²	82.8	64%	0.639	46%	0.455	S	S	*	.			trans	-107.6	96	174.5	-135.9	96.5	0	0	0	111.8	L165	L165-L170 WeakPolarHBondContact CB-O 3.46Å
171	T	65.7	Low	76.1	Confident	42 Å²	42	85.4 Å²	85.4	26%	0.258	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.8	165.6	44.9	0	0	0	0	108.5	L86 I145	L86-T171 HydrophobicContact CD1-CG2 4.46Å; L86-T171 HydrophobicContact CD2-CG2 4.18Å; I145-T171 HydrophobicContact CG2-CG2 4.21Å; I145-T171 WeakPolarHBondContact CG2-OG1 3.33Å
172	N	76.5	Confident	76	Confident	91 Å²	91	85.3 Å²	85.3	49%	0.487	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.7	176.5	-168.2	10.6	0	0	0	109.6	K163 L165	K163-N172 PolarHBondContact N-O 3.42Å; K163-N172 VanDerWaalsContact N-O 3.12Å; K163-N172 PolarHBondContact O-N 3.47Å; K163-N172 VanDerWaalsContact O-N 3.16Å; L165-N172 HydrophobicContact CD1-CB 3.64Å
173	C	84.7	Confident	75.9	Confident	20 Å²	20	89.7 Å²	89.7	14%	0.135	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	106.9	175.4	-72	0	0	0	0	108.7	C146 V148 L160 W161	C146-C173 HydrophobicContact CB-CB 3.64Å; C146-C173 WeakPolarHBondContact CB-SG 3.39Å; C146-C173 WeakPolarHBondContact SG-CB 3.41Å; C146-C173 CovalentContact SG-SG 2.02Å; C146-C173 PolarHBondContact SG-SG 3.46Å; V148-C173 HydrophobicContact CG2-CB 3.94Å; L160-C173 HydrophobicContact CD1-CB 4.31Å; W161-C173 WeakPolarHBondContact O-CA 3.41Å
174	S	86.4	Confident	76.2	Confident	44 Å²	44	86.7 Å²	86.7	31%	0.308	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.9	177.4	61.3	0	0	0	0	110.2	W161	W161-S174 PolarHBondContact N-O 2.99Å; W161-S174 PolarHBondContact O-N 3.35Å
175	L	89.2	Confident	77	Confident	41 Å²	41	84.9 Å²	84.9	22%	0.215	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	127	172.1	-169.4	76.7	0	0	0	109.7	L80 F150 F152 L160	L80-L175 HydrophobicContact CD1-CD1 4.01Å; F150-L175 HydrophobicContact CB-CD2 3.71Å; F150-L175 HydrophobicContact CD1-CD2 3.33Å; F150-L175 HydrophobicContact CD2-CD2 3.37Å; F150-L175 HydrophobicContact CE1-CD2 3.67Å; F150-L175 HydrophobicContact CE2-CD2 3.7Å; F150-L175 HydrophobicContact CG-CD2 3.16Å; F150-L175 HydrophobicContact CZ-CD2 3.84Å; F152-L175 HydrophobicContact CE1-CD1 4.46Å; F152-L175 HydrophobicContact CE1-CD2 4.32Å; L160-L175 HydrophobicContact CB-CD1 3.9Å; L160-L175 HydrophobicContact CD1-CB 4.19Å; L160-L175 HydrophobicContact CD1-CD1 4.02Å
176	V	90.6	Very high	78.1	Confident	65 Å²	65	85.3 Å²	85.3	39%	0.394	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.5	-179.7	-178.6	0	0	0	0	109	Y158 S159	Y158-V176 CarbonylContact C-O 3.49Å; Y158-V176 WeakPolarHBondContact CA-O 3.38Å; S159-V176 PolarHBondContact N-O 3.3Å; S159-V176 PolarHBondContact O-N 3.15Å
177	T	91.1	Very high	79.6	Confident	68 Å²	68	78.8 Å²	78.8	42%	0.417	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.5	173.8	-55.1	0	0	0	0	108.3	Y158 S179	Y158-T177 HydrophobicContact CD1-CG2 4.11Å; Y158-T177 HydrophobicContact CE1-CG2 3.78Å; Y158-T177 WeakPolarHBondContact CE1-OG1 3.43Å; T177-S179 WeakPolarHBondContact CG2-O 3.41Å
178	N	89.3	Confident	81.3	Confident	82 Å²	82	74 Å²	74	44%	0.439	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-40.3	-179.9	-57.8	-37.1	0	0	0	111.4	N157 S159	N157-N178 HydrophobicContact CB-CB 4.27Å; N157-N178 WeakPolarHBondContact O-CA 3.48Å; N157-N178 WeakPolarHBondContact O-CB 3.24Å; N157-N178 PolarHBondContact O-N 3.34Å; N157-N178 PolarHBondContact OD1-ND2 3.39Å; S159-N178 WeakPolarHBondContact CB-ND2 3.29Å; S159-N178 PolarHBondContact N-ND2 3.02Å; S159-N178 PolarHBondContact OG-ND2 3.32Å; S159-N178 PolarHBondContact OG-OD1 2.94Å
179	S	88.2	Confident	82.8	Confident	59 Å²	59	71.1 Å²	71.1	41%	0.413	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.5	176.7	-53.9	0	0	0	0	109.2	N157 T177	N157-S179 PolarHBondContact N-O 3.15Å; N157-S179 PolarHBondContact O-N 3.41Å; T177-S179 WeakPolarHBondContact CG2-O 3.41Å
180	E	87.5	Confident	84.4	Confident	176 Å²	176	67.9 Å²	67.9	82%	0.822	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-63.2	140.6	178.1	-66	-169.6	168	0	0	111.4
181	P	88.7	Confident	85.9	Confident	55 Å²	55	63.1 Å²	63.1	36%	0.357	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-73.6	156.5	179.8	31.2	-35.8	0	0	0	112.2	G153	G153-P181 VanDerWaalsContact C-CB 3.48Å
182	V	85.9	Confident	86.9	Confident	74 Å²	74	66.9 Å²	66.9	45%	0.448	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-75.9	138	173.2	-177.5	0	0	0	0	109.4	E154 H155 S184	E154-V182 PolarHBondContact O-N 3.42Å; H155-V182 HydrophobicContact CB-CG2 4.3Å; V182-S184 PolarHBondContact O-N 3.13Å
183	N	84.6	Confident	87.5	Confident	92 Å²	92	68.6 Å²	68.6	49%	0.492	38%	0.375	S	S	.	.			trans	-80	92.4	175.9	-169.8	-15.4	0	0	0	111.1	N185 M186	N183-N185 PolarHBondContact O-N 3.37Å; N183-N185 PolarHBondContact OD1-N 3.4Å; N183-M186 HydrophobicContact CB-CG 3.79Å; N183-M186 PolarHBondContact O-N 3.44Å
184	S	83.6	Confident	87.5	Confident	33 Å²	33	70 Å²	70	23%	0.231	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.1	-178.9	64.4	0	0	0	0	114.1	E154 V182 M186 P187 Y283	E154-S184 WeakPolarHBondContact OE2-CB 3.19Å; V182-S184 PolarHBondContact O-N 3.13Å; S184-M186 PolarHBondContact O-N 3.03Å; S184-P187 VanDerWaalsContact O-CD 3.25Å; S184-P187 WeakPolarHBondContact O-CD 3.11Å; S184-Y283 VanDerWaalsContact O-CE1 3.29Å; S184-Y283 WeakPolarHBondContact O-CE1 3.5Å; S184-Y283 PolarHBondContact O-OH 2.91Å
185	N	87.3	Confident	87.4	Confident	71 Å²	71	71.9 Å²	71.9	38%	0.38	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6	-178.6	-64.9	-51.4	0	0	0	114.1	N183 I188 L189	N183-N185 PolarHBondContact O-N 3.37Å; N183-N185 PolarHBondContact OD1-N 3.4Å; N185-I188 HydrophobicContact CB-CG2 4.44Å; N185-I188 WeakPolarHBondContact O-CG2 3.33Å; N185-L189 PolarHBondContact O-N 3.33Å
186	M	87	Confident	87.1	Confident	94 Å²	94	72.6 Å²	72.6	46%	0.463	39%	0.392	S	S	.	.	H	α-helix	trans	-59.3	-46.6	-179.5	-75.7	-66.6	-71.1	0	0	113.8	N183 S184 I188 L189 V190	N183-M186 HydrophobicContact CB-CG 3.79Å; N183-M186 PolarHBondContact O-N 3.44Å; S184-M186 PolarHBondContact O-N 3.03Å; M186-I188 VanDerWaalsContact C-N 3.34Å; M186-I188 PolarHBondContact O-N 2.94Å; M186-L189 PolarHBondContact O-N 3.43Å; M186-V190 WeakPolarHBondContact O-CG2 3.14Å; M186-V190 PolarHBondContact O-N 2.75Å
187	P	87.3	Confident	86.7	Confident	29 Å²	29	70.9 Å²	70.9	19%	0.188	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-39.5	-176.9	-22.8	34.5	0	0	0	113.1	S184 V190 A191 A625 L628	S184-P187 VanDerWaalsContact O-CD 3.25Å; S184-P187 WeakPolarHBondContact O-CD 3.11Å; P187-V190 PolarHBondContact O-N 2.74Å; P187-A191 WeakPolarHBondContact O-CB 3.45Å; P187-A191 PolarHBondContact O-N 3.38Å; P187-A625 HydrophobicContact CB-CB 3.92Å; P187-A625 HydrophobicContact CG-CB 3.8Å; P187-L628 HydrophobicContact CB-CD2 4.12Å
188	I	87.7	Confident	86.2	Confident	38 Å²	38	68.8 Å²	68.8	20%	0.195	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-37.5	178.1	-170.5	173	0	0	0	112.3	N185 M186 A191 F192 Y283 F285 F286 L628	N185-I188 HydrophobicContact CB-CG2 4.44Å; N185-I188 WeakPolarHBondContact O-CG2 3.33Å; M186-I188 VanDerWaalsContact C-N 3.34Å; M186-I188 PolarHBondContact O-N 2.94Å; I188-A191 PolarHBondContact O-N 3.1Å; I188-F192 WeakPolarHBondContact O-CB 3.11Å; I188-F192 PolarHBondContact O-N 3.5Å; I188-Y283 HydrophobicContact CB-CE2 4.1Å; I188-Y283 HydrophobicContact CG2-CE1 4.09Å; I188-Y283 HydrophobicContact CG2-CE2 4.49Å; I188-F285 HydrophobicContact CD1-CE2 3.56Å; I188-F285 HydrophobicContact CD1-CZ 3.57Å; I188-F285 HydrophobicContact CG2-CZ 4.47Å; I188-F286 HydrophobicContact CD1-CE2 3.53Å; I188-F286 HydrophobicContact CD1-CZ 4.04Å; I188-L628 HydrophobicContact CB-CD2 3.99Å
189	L	88.6	Confident	85.6	Confident	84 Å²	84	67.7 Å²	67.7	44%	0.44	38%	0.376	S	S	.	.	H	α-helix	trans	-64.1	-43.6	176.5	-174.8	66.3	0	0	0	111	N185 M186 F192 F193	N185-L189 PolarHBondContact O-N 3.33Å; M186-L189 PolarHBondContact O-N 3.43Å; L189-F192 WeakPolarHBondContact O-CB 3.22Å; L189-F192 PolarHBondContact O-N 3.15Å; L189-F193 HydrophobicContact CD1-CD2 4.11Å; L189-F193 HydrophobicContact CD1-CE2 3.46Å; L189-F193 VanDerWaalsContact CD1-CE2 3.46Å; L189-F193 HydrophobicContact CD1-CZ 4.05Å; L189-F193 HydrophobicContact CD2-CE2 4.06Å; L189-F193 HydrophobicContact CG-CD2 3.91Å; L189-F193 HydrophobicContact CG-CE2 3.51Å; L189-F193 WeakPolarHBondContact O-CD2 3.13Å; L189-F193 PolarHBondContact O-N 2.75Å
190	V	87.6	Confident	85.3	Confident	46 Å²	46	70 Å²	70	28%	0.279	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-47.5	175.4	175.7	0	0	0	0	110.8	M57 M186 P187 F192 F193 V194	M57-V190 HydrophobicContact CE-CG1 3.57Å; M57-V190 HydrophobicContact SD-CB 4.42Å; M57-V190 HydrophobicContact SD-CG1 3.59Å; M57-V190 VanDerWaalsContact SD-CG1 3.59Å; M186-V190 WeakPolarHBondContact O-CG2 3.14Å; M186-V190 PolarHBondContact O-N 2.75Å; P187-V190 PolarHBondContact O-N 2.74Å; V190-F192 VanDerWaalsContact C-N 3.29Å; V190-F192 PolarHBondContact O-N 2.9Å; V190-F193 PolarHBondContact O-N 2.83Å; V190-V194 HydrophobicContact CG1-CG2 4.35Å; V190-V194 WeakPolarHBondContact O-CG2 3.29Å; V190-V194 PolarHBondContact O-N 3.35Å
191	A	86.2	Confident	84.9	Confident	21 Å²	21	67.4 Å²	67.4	17%	0.174	37%	0.373	C	S	.	.	H	α-helix	trans	-56.3	-44.4	176.2	0	0	0	0	0	111.6	P187 I188 V194 F195 L628 I632	P187-A191 WeakPolarHBondContact O-CB 3.45Å; P187-A191 PolarHBondContact O-N 3.38Å; I188-A191 PolarHBondContact O-N 3.1Å; A191-V194 PolarHBondContact O-N 3.42Å; A191-F195 WeakPolarHBondContact O-CD2 3.39Å; A191-F195 PolarHBondContact O-N 3.4Å; A191-L628 HydrophobicContact CB-CD2 4.2Å; A191-I632 HydrophobicContact CB-CD1 4Å
192	F	87.5	Confident	84.3	Confident	122 Å²	122	68 Å²	68	54%	0.535	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-50.2	176.9	176.3	-98.8	0	0	0	112.2	I188 L189 V190 V194 F195 V196	I188-F192 WeakPolarHBondContact O-CB 3.11Å; I188-F192 PolarHBondContact O-N 3.5Å; L189-F192 WeakPolarHBondContact O-CB 3.22Å; L189-F192 PolarHBondContact O-N 3.15Å; V190-F192 VanDerWaalsContact C-N 3.29Å; V190-F192 PolarHBondContact O-N 2.9Å; F192-V194 VanDerWaalsContact C-N 3.32Å; F192-V194 PolarHBondContact O-N 2.74Å; F192-F195 PolarHBondContact O-N 3.34Å; F192-V196 HydrophobicContact CD1-CG2 4.25Å; F192-V196 HydrophobicContact CD2-CG2 4.35Å; F192-V196 HydrophobicContact CE1-CG2 3.86Å; F192-V196 HydrophobicContact CE2-CG2 3.96Å; F192-V196 HydrophobicContact CG-CG2 4.49Å; F192-V196 HydrophobicContact CZ-CG2 3.7Å; F192-V196 WeakPolarHBondContact O-CG2 3.16Å; F192-V196 PolarHBondContact O-N 2.89Å
193	F	87.9	Confident	83.6	Confident	126 Å²	126	66.7 Å²	66.7	55%	0.553	37%	0.367	S	S	*	.	H	α-helix	trans	-64.1	-36.2	179	-74.2	-57.5	0	0	0	112.9	L189 V190 V196 G197	L189-F193 HydrophobicContact CD1-CD2 4.11Å; L189-F193 HydrophobicContact CD1-CE2 3.46Å; L189-F193 VanDerWaalsContact CD1-CE2 3.46Å; L189-F193 HydrophobicContact CD1-CZ 4.05Å; L189-F193 HydrophobicContact CD2-CE2 4.06Å; L189-F193 HydrophobicContact CG-CD2 3.91Å; L189-F193 HydrophobicContact CG-CE2 3.51Å; L189-F193 WeakPolarHBondContact O-CD2 3.13Å; L189-F193 PolarHBondContact O-N 2.75Å; V190-F193 PolarHBondContact O-N 2.83Å; F193-V196 PolarHBondContact O-N 3.29Å; F193-G197 PolarHBondContact O-N 2.75Å
194	V	86.1	Confident	83.3	Confident	49 Å²	49	66.5 Å²	66.5	30%	0.297	37%	0.369	S	S	.	.	H	α-helix	trans	-61.4	-49.1	173.7	170.8	0	0	0	0	110.7	I49 V190 A191 F192 V196 G197 L198	I49-V194 HydrophobicContact CG2-CG1 4.11Å; V190-V194 HydrophobicContact CG1-CG2 4.35Å; V190-V194 WeakPolarHBondContact O-CG2 3.29Å; V190-V194 PolarHBondContact O-N 3.35Å; A191-V194 PolarHBondContact O-N 3.42Å; F192-V194 VanDerWaalsContact C-N 3.32Å; F192-V194 PolarHBondContact O-N 2.74Å; V194-V196 PolarHBondContact O-N 2.9Å; V194-G197 PolarHBondContact O-N 3.01Å; V194-L198 HydrophobicContact CG1-CD1 4.06Å; V194-L198 VanDerWaalsContact O-CG 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.39Å; V194-L198 PolarHBondContact O-N 3.08Å
195	F	83.1	Confident	82.8	Confident	85 Å²	85	66.3 Å²	66.3	37%	0.373	37%	0.372	S	S	.	.	H	α-helix	trans	-64.9	-40.5	178.9	-81.2	-67.2	0	0	0	113.1	V46 A191 F192 L198 A199 I632	V46-F195 HydrophobicContact CG1-CE1 4Å; V46-F195 HydrophobicContact CG1-CZ 4.5Å; A191-F195 WeakPolarHBondContact O-CD2 3.39Å; A191-F195 PolarHBondContact O-N 3.4Å; F192-F195 PolarHBondContact O-N 3.34Å; F195-L198 PolarHBondContact O-N 3.11Å; F195-A199 WeakPolarHBondContact O-CB 3.33Å; F195-A199 PolarHBondContact O-N 2.9Å; F195-I632 HydrophobicContact CE2-CD1 4.22Å; F195-I632 HydrophobicContact CE2-CG2 3.84Å; F195-I632 HydrophobicContact CZ-CG2 3.6Å
196	V	83.2	Confident	81.8	Confident	56 Å²	56	65.5 Å²	65.5	34%	0.339	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-45.4	174.9	171.5	0	0	0	0	110.5	F192 F193 V194 L198 A199 L200	F192-V196 HydrophobicContact CD1-CG2 4.25Å; F192-V196 HydrophobicContact CD2-CG2 4.35Å; F192-V196 HydrophobicContact CE1-CG2 3.86Å; F192-V196 HydrophobicContact CE2-CG2 3.96Å; F192-V196 HydrophobicContact CG-CG2 4.49Å; F192-V196 HydrophobicContact CZ-CG2 3.7Å; F192-V196 WeakPolarHBondContact O-CG2 3.16Å; F192-V196 PolarHBondContact O-N 2.89Å; F193-V196 PolarHBondContact O-N 3.29Å; V194-V196 PolarHBondContact O-N 2.9Å; V196-L198 PolarHBondContact O-N 2.95Å; V196-A199 PolarHBondContact O-N 3.41Å; V196-L200 HydrophobicContact CG1-CD1 3.95Å; V196-L200 HydrophobicContact CG1-CG 4.35Å; V196-L200 WeakPolarHBondContact O-CB 3.35Å; V196-L200 VanDerWaalsContact O-CG 3.32Å; V196-L200 WeakPolarHBondContact O-CG 3.48Å; V196-L200 PolarHBondContact O-N 3.16Å
197	G	82	Confident	81	Confident	28 Å²	28	69.8 Å²	69.8	29%	0.289	38%	0.383	S	S	.	.	H	α-helix	trans	-56.9	-47.8	175.4	0	0	0	0	0	111.9	F193 V194 A199 L200 I201	F193-G197 PolarHBondContact O-N 2.75Å; V194-G197 PolarHBondContact O-N 3.01Å; G197-A199 PolarHBondContact O-N 3.38Å; G197-L200 PolarHBondContact O-N 2.89Å; G197-I201 WeakPolarHBondContact O-CB 3.44Å; G197-I201 VanDerWaalsContact O-CG1 3.23Å; G197-I201 WeakPolarHBondContact O-CG1 3.3Å; G197-I201 PolarHBondContact O-N 2.97Å
198	L	80.3	Confident	80.2	Confident	24 Å²	24	71.4 Å²	71.4	13%	0.126	39%	0.392	C	S	.	.	H	α-helix	trans	-62	-41.8	176.3	-70.9	173.3	0	0	0	112.6	I45 V46 I49 V194 F195 V196 I201 F202	I45-L198 HydrophobicContact CG2-CD2 4.21Å; V46-L198 HydrophobicContact CG2-CD1 4.19Å; I49-L198 HydrophobicContact CD1-CD1 4.1Å; I49-L198 HydrophobicContact CD1-CD2 3.66Å; I49-L198 HydrophobicContact CD1-CG 4.43Å; V194-L198 HydrophobicContact CG1-CD1 4.06Å; V194-L198 VanDerWaalsContact O-CG 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.39Å; V194-L198 PolarHBondContact O-N 3.08Å; F195-L198 PolarHBondContact O-N 3.11Å; V196-L198 PolarHBondContact O-N 2.95Å; L198-I201 PolarHBondContact O-N 2.94Å; L198-F202 VanDerWaalsContact O-CB 3.3Å; L198-F202 WeakPolarHBondContact O-CB 3.43Å; L198-F202 PolarHBondContact O-N 2.96Å
199	A	77.9	Confident	78.9	Confident	60 Å²	60	72.3 Å²	72.3	50%	0.496	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-40.6	177.1	0	0	0	0	0	112	F195 V196 G197 F202 A203	F195-A199 WeakPolarHBondContact O-CB 3.33Å; F195-A199 PolarHBondContact O-N 2.9Å; V196-A199 PolarHBondContact O-N 3.41Å; G197-A199 PolarHBondContact O-N 3.38Å; A199-F202 PolarHBondContact O-N 3.41Å; A199-A203 WeakPolarHBondContact O-CB 3.17Å; A199-A203 PolarHBondContact O-N 3.23Å
200	L	81.1	Confident	77.5	Confident	108 Å²	108	77.8 Å²	77.8	57%	0.565	41%	0.412	S	S	*	.	H	α-helix	trans	-66.7	-47.3	175.9	-71.4	174.1	0	0	0	111.5	V196 G197 F202 A203 V204	V196-L200 HydrophobicContact CG1-CD1 3.95Å; V196-L200 HydrophobicContact CG1-CG 4.35Å; V196-L200 WeakPolarHBondContact O-CB 3.35Å; V196-L200 VanDerWaalsContact O-CG 3.32Å; V196-L200 WeakPolarHBondContact O-CG 3.48Å; V196-L200 PolarHBondContact O-N 3.16Å; G197-L200 PolarHBondContact O-N 2.89Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.28Å; L200-A203 PolarHBondContact O-N 3.36Å; L200-A203 VanDerWaalsContact O-N 3.16Å; L200-V204 WeakPolarHBondContact O-CB 3.46Å; L200-V204 VanDerWaalsContact O-CG2 3.31Å; L200-V204 WeakPolarHBondContact O-CG2 3.49Å; L200-V204 PolarHBondContact O-N 2.94Å
201	I	80.5	Confident	76.5	Confident	121 Å²	121	82.6 Å²	82.6	62%	0.621	43%	0.429	S	S	*	.	H	α-helix	trans	-57.4	-44.6	175.4	-69.6	165.3	0	0	0	110.1	G197 L198 V204 G205	G197-I201 WeakPolarHBondContact O-CB 3.44Å; G197-I201 VanDerWaalsContact O-CG1 3.23Å; G197-I201 WeakPolarHBondContact O-CG1 3.3Å; G197-I201 PolarHBondContact O-N 2.97Å; L198-I201 PolarHBondContact O-N 2.94Å; I201-V204 PolarHBondContact O-N 3.26Å; I201-G205 PolarHBondContact O-N 3Å
202	F	74.3	Confident	75	Confident	67 Å²	67	84.4 Å²	84.4	29%	0.294	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-43.4	176.7	-178.7	-103.1	0	0	0	112.3	L42 L198 A199 L200 G205 C206	L42-F202 HydrophobicContact CB-CD2 4.37Å; L42-F202 HydrophobicContact CB-CE2 4.49Å; L42-F202 HydrophobicContact CD1-CB 4.02Å; L42-F202 HydrophobicContact CD1-CD2 3.9Å; L42-F202 HydrophobicContact CD1-CG 4.23Å; L42-F202 HydrophobicContact CD2-CB 4.22Å; L42-F202 HydrophobicContact CD2-CD1 4.29Å; L42-F202 HydrophobicContact CD2-CD2 3.7Å; L42-F202 HydrophobicContact CD2-CE2 4.06Å; L42-F202 HydrophobicContact CD2-CG 3.81Å; L42-F202 HydrophobicContact CG-CD2 4.21Å; L198-F202 VanDerWaalsContact O-CB 3.3Å; L198-F202 WeakPolarHBondContact O-CB 3.43Å; L198-F202 PolarHBondContact O-N 2.96Å; A199-F202 PolarHBondContact O-N 3.41Å; L200-F202 VanDerWaalsContact C-N 3.28Å; L200-F202 PolarHBondContact O-N 3.28Å; F202-G205 PolarHBondContact O-N 3.26Å; F202-C206 VanDerWaalsContact CZ-SG 3.57Å; F202-C206 VanDerWaalsContact O-CB 3.29Å; F202-C206 WeakPolarHBondContact O-CB 3.33Å; F202-C206 PolarHBondContact O-N 3.28Å; F202-C206 PolarHBondContact O-SG 3.32Å
203	A	72.1	Confident	73.7	Confident	46 Å²	46	84.8 Å²	84.8	38%	0.38	46%	0.462	S	S	.	.	H	α-helix	trans	-64	-44	178.3	0	0	0	0	0	112	A199 L200 C206 R207	A199-A203 WeakPolarHBondContact O-CB 3.17Å; A199-A203 PolarHBondContact O-N 3.23Å; L200-A203 PolarHBondContact O-N 3.36Å; L200-A203 VanDerWaalsContact O-N 3.16Å; A203-C206 PolarHBondContact O-N 3.4Å; A203-R207 WeakPolarHBondContact O-CG 3.17Å; A203-R207 PolarHBondContact O-N 3.04Å; A203-R207 VanDerWaalsContact O-N 3.07Å
204	V	78.4	Confident	72.1	Confident	88 Å²	88	81.2 Å²	81.2	53%	0.533	45%	0.45	S	S	.	.	H	α-helix	trans	-64.9	-49.8	175.5	173.8	0	0	0	0	110	L200 I201 C206 R207 V208	L200-V204 WeakPolarHBondContact O-CB 3.46Å; L200-V204 VanDerWaalsContact O-CG2 3.31Å; L200-V204 WeakPolarHBondContact O-CG2 3.49Å; L200-V204 PolarHBondContact O-N 2.94Å; I201-V204 PolarHBondContact O-N 3.26Å; V204-C206 VanDerWaalsContact C-N 3.29Å; V204-C206 PolarHBondContact O-N 3.34Å; V204-R207 CarbonylContact O-C 3.22Å; V204-R207 WeakPolarHBondContact O-CA 3.35Å; V204-R207 WeakPolarHBondContact O-CB 3.34Å; V204-R207 PolarHBondContact O-N 3.33Å; V204-V208 HydrophobicContact CG1-CG2 4Å; V204-V208 WeakPolarHBondContact O-CB 3.48Å; V204-V208 VanDerWaalsContact O-CG2 3.3Å; V204-V208 WeakPolarHBondContact O-CG2 3.4Å; V204-V208 PolarHBondContact O-N 3.25Å
205	G	72.9	Confident	70.3	Confident	29 Å²	29	85.6 Å²	85.6	30%	0.299	46%	0.461	S	S	.	.	H	α-helix	trans	-56.1	-42	176.7	0	0	0	0	0	112.5	I201 F202 R207 V208 L209	I201-G205 PolarHBondContact O-N 3Å; F202-G205 PolarHBondContact O-N 3.26Å; G205-R207 PolarHBondContact O-N 2.89Å; G205-V208 PolarHBondContact O-N 3.11Å; G205-L209 VanDerWaalsContact O-CB 3.32Å; G205-L209 WeakPolarHBondContact O-CB 3.12Å; G205-L209 VanDerWaalsContact O-CG 3.24Å; G205-L209 WeakPolarHBondContact O-CG 3.36Å; G205-L209 PolarHBondContact O-N 3.05Å
206	C	66.6	Low	68.9	Low	54 Å²	54	83.6 Å²	83.6	37%	0.365	47%	0.465	S	S	.	.	H	α-helix	trans	-65.4	-34	174.7	-75.5	0	0	0	0	113.5	F202 A203 V204	F202-C206 VanDerWaalsContact CZ-SG 3.57Å; F202-C206 VanDerWaalsContact O-CB 3.29Å; F202-C206 WeakPolarHBondContact O-CB 3.33Å; F202-C206 PolarHBondContact O-N 3.28Å; F202-C206 PolarHBondContact O-SG 3.32Å; A203-C206 PolarHBondContact O-N 3.4Å; V204-C206 VanDerWaalsContact C-N 3.29Å; V204-C206 PolarHBondContact O-N 3.34Å
207	R	69.8	Low	67.5	Low	185 Å²	185	87.2 Å²	87.2	70%	0.698	48%	0.476	S	S	*	.	H	α-helix	trans	-73.7	-41.9	173.6	-73.9	-167.3	-166.4	171.4	5.7	111.7	A203 V204 G205 R210	A203-R207 WeakPolarHBondContact O-CG 3.17Å; A203-R207 PolarHBondContact O-N 3.04Å; A203-R207 VanDerWaalsContact O-N 3.07Å; V204-R207 CarbonylContact O-C 3.22Å; V204-R207 WeakPolarHBondContact O-CA 3.35Å; V204-R207 WeakPolarHBondContact O-CB 3.34Å; V204-R207 PolarHBondContact O-N 3.33Å; G205-R207 PolarHBondContact O-N 2.89Å; R207-R210 WeakPolarHBondContact O-CB 3.47Å; R207-R210 PolarHBondContact O-N 3.28Å; R207-R210 VanDerWaalsContact O-N 3.1Å
208	V	70.5	Confident	66.2	Low	63 Å²	63	89 Å²	89	38%	0.382	48%	0.482	S	S	.	.	H	α-helix	trans	-64.7	-44.1	179.5	171.6	0	0	0	0	110.9	V204 G205 R210 F211 V214	V204-V208 HydrophobicContact CG1-CG2 4Å; V204-V208 WeakPolarHBondContact O-CB 3.48Å; V204-V208 VanDerWaalsContact O-CG2 3.3Å; V204-V208 WeakPolarHBondContact O-CG2 3.4Å; V204-V208 PolarHBondContact O-N 3.25Å; G205-V208 PolarHBondContact O-N 3.11Å; V208-R210 PolarHBondContact O-N 3.15Å; V208-R210 VanDerWaalsContact O-N 3.1Å; V208-F211 WeakPolarHBondContact O-CB 3.25Å; V208-F211 PolarHBondContact O-N 3.18Å; V208-V214 HydrophobicContact CG1-CB 4.39Å; V208-V214 HydrophobicContact CG1-CG1 4.04Å; V208-V214 HydrophobicContact CG1-CG2 4.11Å
209	L	61	Low	64.8	Low	57 Å²	57	93.4 Å²	93.4	30%	0.298	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.2	174.4	-72.2	168.3	0	0	0	114	N38 G205 V218	N38-L209 WeakPolarHBondContact ND2-CD1 3.22Å; G205-L209 VanDerWaalsContact O-CB 3.32Å; G205-L209 WeakPolarHBondContact O-CB 3.12Å; G205-L209 VanDerWaalsContact O-CG 3.24Å; G205-L209 WeakPolarHBondContact O-CG 3.36Å; G205-L209 PolarHBondContact O-N 3.05Å; L209-V218 HydrophobicContact CD2-CB 4.46Å; L209-V218 HydrophobicContact CD2-CG1 4.46Å; L209-V218 HydrophobicContact CD2-CG2 4.1Å
210	R	59	Low	63.3	Low	198 Å²	198	100.6 Å²	100.6	75%	0.747	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-19.1	173.7	-143.4	179.9	-156.9	165	2.2	112.2	R207 V208 G212	R207-R210 WeakPolarHBondContact O-CB 3.47Å; R207-R210 PolarHBondContact O-N 3.28Å; R207-R210 VanDerWaalsContact O-N 3.1Å; V208-R210 PolarHBondContact O-N 3.15Å; V208-R210 VanDerWaalsContact O-N 3.1Å; R210-G212 PolarHBondContact O-N 3.32Å
211	F	65.1	Low	61.9	Low	147 Å²	147	100.4 Å²	100.4	65%	0.645	52%	0.517	S	S	*	.	S	Bend	trans	-75	120.4	171.1	-79	-87.6	0	0	0	109.5	V208 V213 V214 R215	V208-F211 WeakPolarHBondContact O-CB 3.25Å; V208-F211 PolarHBondContact O-N 3.18Å; F211-V213 PolarHBondContact O-N 3.47Å; F211-V213 VanDerWaalsContact O-N 3.09Å; F211-V214 PolarHBondContact O-N 3.47Å; F211-V214 VanDerWaalsContact O-N 3.11Å; F211-R215 PolarHBondContact O-N 3.22Å
212	G	55.4	Low	59.9	Low	60 Å²	60	98.5 Å²	98.5	62%	0.619	52%	0.515	S	S	*	.	H	α-helix	trans	-57.1	-28.4	-172.6	0	0	0	0	0	114.7	R210 G216	R210-G212 PolarHBondContact O-N 3.32Å; G212-G216 PolarHBondContact O-N 3.34Å
213	V	59.7	Low	58.1	Low	130 Å²	130	97.6 Å²	97.6	79%	0.788	52%	0.524	S	S	*	.	H	α-helix	trans	-67.2	-41.3	179	-174.9	0	0	0	0	111.6	F211 F217	F211-V213 PolarHBondContact O-N 3.47Å; F211-V213 VanDerWaalsContact O-N 3.09Å; V213-F217 PolarHBondContact O-N 2.85Å
214	V	54.1	Low	56.3	Low	50 Å²	50	101.5 Å²	101.5	30%	0.303	54%	0.543	S	S	.	.	H	α-helix	trans	-77.1	-35.2	-179.4	-176.5	0	0	0	0	111.2	V208 F211 G216 F217 V218	V208-V214 HydrophobicContact CG1-CB 4.39Å; V208-V214 HydrophobicContact CG1-CG1 4.04Å; V208-V214 HydrophobicContact CG1-CG2 4.11Å; F211-V214 PolarHBondContact O-N 3.47Å; F211-V214 VanDerWaalsContact O-N 3.11Å; V214-G216 VanDerWaalsContact C-N 3.29Å; V214-G216 PolarHBondContact O-N 2.74Å; V214-F217 PolarHBondContact O-N 3.42Å; V214-V218 HydrophobicContact CG1-CG2 3.96Å; V214-V218 WeakPolarHBondContact O-CB 3.34Å; V214-V218 WeakPolarHBondContact O-CG2 3.27Å; V214-V218 PolarHBondContact O-N 2.84Å
215	R	50	Low	54.3	Low	141 Å²	141	105.5 Å²	105.5	53%	0.532	56%	0.558	S	S	.	*	H	α-helix	trans	-58.4	-42.5	173.7	-174	-178.5	124.3	177.3	1.3	111.7	F211 L219	F211-R215 PolarHBondContact O-N 3.22Å; R215-L219 HydrophobicContact CG-CD1 4.07Å; R215-L219 WeakPolarHBondContact O-CB 3.26Å; R215-L219 WeakPolarHBondContact O-CD1 3.33Å; R215-L219 WeakPolarHBondContact O-CG 3.37Å; R215-L219 PolarHBondContact O-N 3.18Å; R215-L219 VanDerWaalsContact O-N 3.13Å
216	G	52.2	Low	52.6	Low	43 Å²	43	109.3 Å²	109.3	44%	0.443	57%	0.569	S	S	.	*	H	α-helix	trans	-64.4	-40.8	175.4	0	0	0	0	0	112.6	G212 V214 R220	G212-G216 PolarHBondContact O-N 3.34Å; V214-G216 VanDerWaalsContact C-N 3.29Å; V214-G216 PolarHBondContact O-N 2.74Å; G216-R220 WeakPolarHBondContact O-CB 3.25Å; G216-R220 PolarHBondContact O-N 3.38Å; G216-R220 VanDerWaalsContact O-N 3.12Å
217	F	55	Low	51.1	Low	132 Å²	132	113.2 Å²	113.2	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-70.9	-42.2	-179.8	-160.1	-103.6	0	0	0	113.2	V213 V214 R220 I221	V213-F217 PolarHBondContact O-N 2.85Å; V214-F217 PolarHBondContact O-N 3.42Å; F217-R220 WeakPolarHBondContact O-CB 3.43Å; F217-R220 PolarHBondContact O-N 3.25Å; F217-I221 HydrophobicContact CD1-CD1 3.6Å; F217-I221 HydrophobicContact CE1-CD1 3.34Å; F217-I221 HydrophobicContact CE1-CG1 4.41Å; F217-I221 HydrophobicContact CZ-CD1 4.1Å; F217-I221 PolarHBondContact O-N 2.96Å
218	V	54.5	Low	49.4	Very low	66 Å²	66	112.8 Å²	112.8	40%	0.4	60%	0.597	S	S	.	*	H	α-helix	trans	-68.3	-39.4	177.9	172.9	0	0	0	0	111.6	L209 V214 R220 I221 S222	L209-V218 HydrophobicContact CD2-CB 4.46Å; L209-V218 HydrophobicContact CD2-CG1 4.46Å; L209-V218 HydrophobicContact CD2-CG2 4.1Å; V214-V218 HydrophobicContact CG1-CG2 3.96Å; V214-V218 WeakPolarHBondContact O-CB 3.34Å; V214-V218 WeakPolarHBondContact O-CG2 3.27Å; V214-V218 PolarHBondContact O-N 2.84Å; V218-R220 VanDerWaalsContact C-N 3.25Å; V218-R220 PolarHBondContact O-N 2.95Å; V218-I221 PolarHBondContact O-N 3.2Å; V218-S222 VanDerWaalsContact O-CB 3.24Å; V218-S222 WeakPolarHBondContact O-CB 3.21Å; V218-S222 PolarHBondContact O-N 3.09Å
219	L	50.3	Low	47.6	Very low	116 Å²	116	118.5 Å²	118.5	61%	0.607	61%	0.612	S	S	*	*	H	α-helix	trans	-65	-31.2	172.2	-77.3	166.1	0	0	0	112.1	R215 G223	R215-L219 HydrophobicContact CG-CD1 4.07Å; R215-L219 WeakPolarHBondContact O-CB 3.26Å; R215-L219 WeakPolarHBondContact O-CD1 3.33Å; R215-L219 WeakPolarHBondContact O-CG 3.37Å; R215-L219 PolarHBondContact O-N 3.18Å; R215-L219 VanDerWaalsContact O-N 3.13Å; L219-G223 PolarHBondContact O-N 3.02Å
220	R	47.3	Very low	46.2	Very low	212 Å²	212	123.1 Å²	123.1	80%	0.8	64%	0.636	S	S	*	*	H	α-helix	trans	-73.1	-33.4	176.9	-148.1	176.6	-167.4	-176.2	2.4	112.8	G216 F217 V218	G216-R220 WeakPolarHBondContact O-CB 3.25Å; G216-R220 PolarHBondContact O-N 3.38Å; G216-R220 VanDerWaalsContact O-N 3.12Å; F217-R220 WeakPolarHBondContact O-CB 3.43Å; F217-R220 PolarHBondContact O-N 3.25Å; V218-R220 VanDerWaalsContact C-N 3.25Å; V218-R220 PolarHBondContact O-N 2.95Å
221	I	50.7	Low	45.1	Very low	103 Å²	103	120.4 Å²	120.4	53%	0.528	63%	0.634	S	S	.	*	H	α-helix	trans	-79.7	-34.7	174.7	-70.6	171.1	0	0	0	111.5	F217 V218 G223 T224	F217-I221 HydrophobicContact CD1-CD1 3.6Å; F217-I221 HydrophobicContact CE1-CD1 3.34Å; F217-I221 HydrophobicContact CE1-CG1 4.41Å; F217-I221 HydrophobicContact CZ-CD1 4.1Å; F217-I221 PolarHBondContact O-N 2.96Å; V218-I221 PolarHBondContact O-N 3.2Å; I221-G223 PolarHBondContact O-N 3.03Å; I221-T224 PolarHBondContact O-OG1 3.13Å; I221-T224 VanDerWaalsContact O-OG1 3.14Å
222	S	38.9	Very low	43.4	Very low	81 Å²	81	120.5 Å²	120.5	57%	0.566	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-77.3	-3	178.7	-159.5	0	0	0	0	113.8	V218 T224	V218-S222 VanDerWaalsContact O-CB 3.24Å; V218-S222 WeakPolarHBondContact O-CB 3.21Å; V218-S222 PolarHBondContact O-N 3.09Å; S222-T224 PolarHBondContact O-N 3.41Å
223	G	35.9	Very low	42.2	Very low	48 Å²	48	122.2 Å²	122.2	50%	0.495	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-73.7	5.5	175.2	0	0	0	0	0	115.1	L219 I221	L219-G223 PolarHBondContact O-N 3.02Å; I221-G223 PolarHBondContact O-N 3.03Å
224	T	34.9	Very low	40.9	Very low	128 Å²	128	123.8 Å²	123.8	79%	0.785	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-95.6	1.5	174.1	43.5	0	0	0	0	114.2	I221 S222	I221-T224 PolarHBondContact O-OG1 3.13Å; I221-T224 VanDerWaalsContact O-OG1 3.14Å; S222-T224 PolarHBondContact O-N 3.41Å
225	M	35.5	Very low	39.6	Very low	172 Å²	172	129.9 Å²	129.9	85%	0.847	67%	0.673	S	S	*	*	S	Bend	trans	-125.7	45.4	176.5	-74.7	-164.7	74.5	0	0	113.4
226	E	38.6	Very low	38.3	Very low	110 Å²	110	126.7 Å²	126.7	51%	0.514	68%	0.684	S	S	.	*			trans	-120.4	69.8	177.5	-157.5	159.4	-154.9	0	0	111.7	R229	E226-R229 HydrophobicContact CG-CB 4.37Å; E226-R229 HydrophobicContact CG-CG 4.46Å; E226-R229 VanDerWaalsContact OE1-CD 3.23Å; E226-R229 WeakPolarHBondContact OE1-CD 3.39Å; E226-R229 IonicContact OE1-CZ 2.7Å; E226-R229 IonicContact OE1-NE 2.65Å; E226-R229 IonicContact OE1-NH1 3.45Å; E226-R229 PolarHBondContact OE1-NH1 3.41Å
227	T	34.3	Very low	37	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	70%	0.704	S	S	*	*			trans	-105.7	8.6	167.3	34.4	0	0	0	0	114
228	E	35.5	Very low	36	Very low	177 Å²	177	129.7 Å²	129.7	83%	0.827	71%	0.712	S	S	*	*	S	Bend	trans	-106.4	4.2	178	-80.8	-169.4	154.8	0	0	115.3
229	R	32.3	Very low	34.7	Very low	183 Å²	183	137 Å²	137	69%	0.691	73%	0.732	S	S	*	*	S	Bend	trans	-95.3	-5.7	178.2	-85.8	-159.9	174.7	137.3	-8.1	116.1	E226	E226-R229 HydrophobicContact CG-CB 4.37Å; E226-R229 HydrophobicContact CG-CG 4.46Å; E226-R229 VanDerWaalsContact OE1-CD 3.23Å; E226-R229 WeakPolarHBondContact OE1-CD 3.39Å; E226-R229 IonicContact OE1-CZ 2.7Å; E226-R229 IonicContact OE1-NE 2.65Å; E226-R229 IonicContact OE1-NH1 3.45Å; E226-R229 PolarHBondContact OE1-NH1 3.41Å
230	L	32	Very low	33.7	Very low	153 Å²	153	138.5 Å²	138.5	80%	0.801	75%	0.746	S	S	*	*	S	Bend	trans	-92.6	0.9	-177	-83	163.6	0	0	0	115.5
231	I	34.3	Very low	32.8	Very low	141 Å²	141	135.5 Å²	135.5	72%	0.723	75%	0.746	S	S	*	*	S	Bend	trans	-97.4	-11.6	-177.9	-63.6	176.4	0	0	0	113.3
232	N	30.5	Very low	31.6	Very low	150 Å²	150	134.2 Å²	134.2	80%	0.802	76%	0.758	S	S	*	*	S	Bend	trans	-105.7	16.2	-175.4	-70.1	-42.7	0	0	0	115.2
233	S	30.2	Very low	31.1	Very low	95 Å²	95	138.2 Å²	138.2	66%	0.664	77%	0.772	S	S	*	*	S	Bend	trans	-99.6	2.4	176	81.9	0	0	0	0	115.3
234	E	31.4	Very low	30.8	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.762	78%	0.783	S	S	*	*	S	Bend	trans	-124.2	83.2	178.9	-76.3	-77.7	167.6	0	0	108.5
235	L	27	Very low	30.6	Very low	179 Å²	179	141.2 Å²	141.2	94%	0.937	78%	0.78	S	S	*	*			trans	-176.6	116	143.6	-117.2	80.6	0	0	0	109.1
236	G	24	Very low	30.5	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	78%	0.777	S	S	*	*			trans	-88.2	158.4	-178.5	0	0	0	0	0	115.4
237	S	23.9	Very low	30.1	Very low	122 Å²	122	141.7 Å²	141.7	85%	0.853	79%	0.79	S	S	*	*			trans	71.8	158	146.6	-133.8	0	0	0	0	119.4
238	P	33.8	Very low	30.4	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	79%	0.794	S	S	*	*			cis	-126.9	167.3	-1.9	23.5	0.3	0	0	0	116.2
239	R	28.3	Very low	30.2	Very low	220 Å²	220	142.1 Å²	142.1	83%	0.83	79%	0.79	S	S	*	*			trans	-63.4	149.1	168	-68	172.9	173.1	166.3	-2.6	112
240	T	27.8	Very low	30	Very low	146 Å²	146	138.8 Å²	138.8	90%	0.896	79%	0.793	S	S	*	*			trans	-122.7	110.6	149.6	-13.2	0	0	0	0	107.7
241	D	28.2	Very low	29.7	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	79%	0.79	S	S	*	*			trans	-68.5	137.9	171	-78.1	-43.6	0	0	0	110.1
242	G	27.1	Very low	29.5	Very low	75 Å²	75	135.4 Å²	135.4	77%	0.773	79%	0.791	S	S	*	*			trans	-148.9	92	174.6	0	0	0	0	0	110
243	L	26.5	Very low	29.7	Very low	165 Å²	165	132.9 Å²	132.9	86%	0.864	79%	0.791	S	S	*	*			trans	2.2	120.5	168.1	-135.1	80.4	0	0	0	118.8
244	V	31.5	Very low	29.8	Very low	119 Å²	119	135.4 Å²	135.4	72%	0.721	80%	0.797	S	S	*	*			trans	-75.4	121.6	164.9	174.9	0	0	0	0	109.1
245	T	29.5	Very low	30	Very low	120 Å²	120	132.4 Å²	132.4	74%	0.736	80%	0.8	S	S	*	*			trans	-112.3	111.2	151.7	34.6	0	0	0	0	108.2	N247	T245-N247 PolarHBondContact O-N 3.11Å
246	D	33.2	Very low	30.8	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	79%	0.786	S	S	*	*			trans	-62.1	114.6	169.7	-76.4	-41.6	0	0	0	109.4
247	N	31.4	Very low	32.4	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	78%	0.778	S	S	*	*			trans	-123.9	113.4	158.3	-84.2	-35.7	0	0	0	108.5	T245 L249	T245-N247 PolarHBondContact O-N 3.11Å; N247-L249 VanDerWaalsContact C-N 3.31Å; N247-L249 PolarHBondContact O-N 3.42Å
248	I	39.7	Very low	34.8	Very low	178 Å²	178	133 Å²	133	91%	0.913	76%	0.757	S	S	*	*			trans	-64	91.6	168.8	-60.5	166	0	0	0	106.9
249	L	30.9	Very low	37.2	Very low	144 Å²	144	129.7 Å²	129.7	75%	0.754	73%	0.733	S	S	*	*			trans	-122.3	132.9	163.5	-149.6	79.6	0	0	0	106.4	N247 S251	N247-L249 VanDerWaalsContact C-N 3.31Å; N247-L249 PolarHBondContact O-N 3.42Å; L249-S251 PolarHBondContact O-N 3.03Å; L249-S251 VanDerWaalsContact O-N 3.08Å
250	P	29.8	Very low	40	Very low	113 Å²	113	125.2 Å²	125.2	73%	0.734	72%	0.716	S	S	*	*			trans	-54.6	124	171.7	22.4	-31.7	0	0	0	108.2
251	S	24.7	Very low	43.1	Very low	108 Å²	108	118.3 Å²	118.3	76%	0.755	67%	0.674	S	S	*	*			trans	-44.7	126.5	174.9	176.5	0	0	0	0	108.6	L249 A253	L249-S251 PolarHBondContact O-N 3.03Å; L249-S251 VanDerWaalsContact O-N 3.08Å; S251-A253 PolarHBondContact O-N 3.33Å
252	P	29.8	Very low	46.1	Very low	115 Å²	115	111.8 Å²	111.8	75%	0.747	64%	0.639	S	S	*	*			trans	-55.3	131.3	179.9	21	-30.5	0	0	0	108.7	N254	P252-N254 PolarHBondContact O-N 2.86Å; P252-N254 VanDerWaalsContact O-N 3.14Å
253	A	34.2	Very low	49.2	Very low	96 Å²	96	108.6 Å²	108.6	79%	0.793	60%	0.604	S	S	*	*	S	Bend	trans	-49.7	119.8	-178.4	0	0	0	0	0	110.5	S251	S251-A253 PolarHBondContact O-N 3.33Å
254	N	33.5	Very low	52.4	Low	149 Å²	149	100.8 Å²	100.8	80%	0.797	56%	0.563	S	S	*	*			trans	37.6	101.4	162	-65	-44.1	0	0	0	117.3	P252 N256	P252-N254 PolarHBondContact O-N 2.86Å; P252-N254 VanDerWaalsContact O-N 3.14Å; N254-N256 PolarHBondContact O-N 3.42Å; N254-N256 VanDerWaalsContact O-N 3.13Å
255	A	35.4	Very low	55.5	Low	99 Å²	99	95.1 Å²	95.1	82%	0.818	53%	0.529	S	S	*	.			trans	-39.2	121.8	159.6	0	0	0	0	0	111.1	R257	A255-R257 PolarHBondContact O-N 3.49Å
256	N	43.6	Very low	58.6	Low	120 Å²	120	91.2 Å²	91.2	64%	0.642	50%	0.501	S	S	*	.			trans	-40.2	98.2	-175.4	-83.2	-41.4	0	0	0	113	N254 R258	N254-N256 PolarHBondContact O-N 3.42Å; N254-N256 VanDerWaalsContact O-N 3.13Å; N256-R258 PolarHBondContact O-N 3.3Å
257	R	57.8	Low	61.5	Low	156 Å²	156	84.4 Å²	84.4	59%	0.589	46%	0.464	S	S	*	.			trans	-71	103	179.4	-173.6	172.2	160.3	-154.5	-15.5	109.4	A255 L259	A255-R257 PolarHBondContact O-N 3.49Å; R257-L259 PolarHBondContact O-N 2.84Å
258	R	74.4	Confident	64.6	Low	112 Å²	112	78.8 Å²	78.8	42%	0.423	43%	0.434	S	S	.	.			trans	-52.8	129.2	172.1	-175.3	172	177.9	166.5	1.7	110.3	N256 R260 D263 M596	N256-R258 PolarHBondContact O-N 3.3Å; R258-R260 PolarHBondContact O-N 3.07Å; R258-D263 IonicContact CZ-OD1 2.69Å; R258-D263 IonicContact CZ-OD2 3.72Å; R258-D263 VanDerWaalsContact CZ-OD2 3.26Å; R258-D263 IonicContact NE-OD1 3.84Å; R258-D263 IonicContact NE-OD2 3.59Å; R258-D263 PolarHBondContact NE-OD2 3.44Å; R258-D263 VanDerWaalsContact NH2-CG 3.32Å; R258-D263 IonicContact NH2-OD1 2.83Å; R258-D263 PolarHBondContact NH2-OD1 3.36Å; R258-D263 IonicContact NH2-OD2 3.54Å; R258-D263 PolarHBondContact NH2-OD2 3.45Å; R258-M596 VanDerWaalsContact NH1-CE 3.27Å
259	L	83.6	Confident	67.3	Low	47 Å²	47	70.3 Å²	70.3	25%	0.246	39%	0.39	C	S	.	.			trans	-71.9	121.6	178.5	-72.1	169.1	0	0	0	110	R257 L262 L314 L512	R257-L259 PolarHBondContact O-N 2.84Å; L259-L262 HydrophobicContact CB-CB 4.41Å; L259-L314 HydrophobicContact CD1-CD1 4.12Å; L259-L512 HydrophobicContact CD1-CD1 4.23Å
260	R	87.9	Confident	70.3	Confident	126 Å²	126	63.5 Å²	63.5	48%	0.475	35%	0.354	S	S	.	.	H	α-helix	trans	-78.5	-30.8	-178	-73.4	-172.5	178.4	-173.8	-1.4	112.3	R258 L262 D263 T264 I580	R258-R260 PolarHBondContact O-N 3.07Å; R260-L262 VanDerWaalsContact C-N 3.26Å; R260-L262 PolarHBondContact O-N 3.29Å; R260-D263 PolarHBondContact O-N 3.25Å; R260-T264 WeakPolarHBondContact O-CB 3.47Å; R260-T264 PolarHBondContact O-N 3.37Å; R260-T264 PolarHBondContact O-OG1 3.13Å; R260-I580 HydrophobicContact CB-CG2 3.7Å
261	S	91.8	Very high	73.4	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	33%	0.326	C	S	.	.	H	α-helix	trans	-55.5	-42.1	175.4	50.2	0	0	0	0	112.4	T264 F265 I576 D581	S261-T264 WeakPolarHBondContact O-CB 3.41Å; S261-T264 PolarHBondContact O-N 2.89Å; S261-F265 PolarHBondContact O-N 2.92Å; S261-I576 WeakPolarHBondContact O-CG2 3.19Å; S261-D581 WeakPolarHBondContact CB-OD2 2.93Å; S261-D581 PolarHBondContact N-OD2 3.38Å; S261-D581 PolarHBondContact OG-OD2 2.96Å
262	L	92.1	Very high	76.8	Confident	13 Å²	13	56.4 Å²	56.4	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-48.6	-178.9	-175	153.6	0	0	0	112.6	L259 R260 T264 F265 R266 I307 T310 L314	L259-L262 HydrophobicContact CB-CB 4.41Å; R260-L262 VanDerWaalsContact C-N 3.26Å; R260-L262 PolarHBondContact O-N 3.29Å; L262-T264 PolarHBondContact O-N 3.06Å; L262-F265 PolarHBondContact O-N 3.31Å; L262-R266 PolarHBondContact O-N 3.37Å; L262-I307 HydrophobicContact CB-CD1 4.49Å; L262-I307 HydrophobicContact CD1-CD1 4.42Å; L262-I307 HydrophobicContact CD2-CG1 4.46Å; L262-I307 HydrophobicContact CG-CD1 3.83Å; L262-I307 HydrophobicContact CG-CG1 4Å; L262-T310 HydrophobicContact CD1-CG2 3.78Å; L262-L314 HydrophobicContact CD1-CD1 3.5Å
263	D	91.8	Very high	79.9	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.043	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-33.8	176.5	-68.9	-43.8	0	0	0	111	R258 R260 R266 G267 G595 M596	R258-D263 IonicContact CZ-OD1 2.69Å; R258-D263 IonicContact CZ-OD2 3.72Å; R258-D263 VanDerWaalsContact CZ-OD2 3.26Å; R258-D263 IonicContact NE-OD1 3.84Å; R258-D263 IonicContact NE-OD2 3.59Å; R258-D263 PolarHBondContact NE-OD2 3.44Å; R258-D263 VanDerWaalsContact NH2-CG 3.32Å; R258-D263 IonicContact NH2-OD1 2.83Å; R258-D263 PolarHBondContact NH2-OD1 3.36Å; R258-D263 IonicContact NH2-OD2 3.54Å; R258-D263 PolarHBondContact NH2-OD2 3.45Å; R260-D263 PolarHBondContact O-N 3.25Å; D263-R266 IonicContact OD1-NH1 2.7Å; D263-G267 PolarHBondContact O-N 2.99Å; D263-G595 WeakPolarHBondContact O-CA 3.16Å; D263-M596 HydrophobicContact CB-CG 4.26Å
264	T	94.1	Very high	82.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.6	-47.1	177.7	-52.9	0	0	0	0	111.7	R260 S261 L262 G267 I268 I576 I580 W586 G588 F591	R260-T264 WeakPolarHBondContact O-CB 3.47Å; R260-T264 PolarHBondContact O-N 3.37Å; R260-T264 PolarHBondContact O-OG1 3.13Å; S261-T264 WeakPolarHBondContact O-CB 3.41Å; S261-T264 PolarHBondContact O-N 2.89Å; L262-T264 PolarHBondContact O-N 3.06Å; T264-G267 CarbonylContact O-C 3.57Å; T264-G267 PolarHBondContact O-N 3.47Å; T264-I268 HydrophobicContact CG2-CD1 4.03Å; T264-I268 HydrophobicContact CG2-CG1 4.45Å; T264-I268 WeakPolarHBondContact O-CG1 3.5Å; T264-I268 PolarHBondContact O-N 2.97Å; T264-I576 HydrophobicContact CG2-CG2 4.41Å; T264-I580 HydrophobicContact CG2-CD1 3.67Å; T264-I580 WeakPolarHBondContact OG1-CD1 3.31Å; T264-W586 HydrophobicContact CG2-CH2 3.49Å; T264-W586 VanDerWaalsContact CG2-CH2 3.49Å; T264-W586 HydrophobicContact CG2-CZ2 4.34Å; T264-W586 HydrophobicContact CG2-CZ3 3.61Å; T264-G588 WeakPolarHBondContact OG1-CA 3.06Å; T264-F591 HydrophobicContact CG2-CB 4.13Å
265	F	96.3	Very high	85.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-50.3	176.6	-174.2	177.5	0	0	0	110	S261 L262 G267 I268 S269 W303 F306 I307 A569 L572 L573 I576	S261-F265 PolarHBondContact O-N 2.92Å; L262-F265 PolarHBondContact O-N 3.31Å; F265-G267 PolarHBondContact O-N 3.15Å; F265-I268 PolarHBondContact O-N 3.35Å; F265-I268 VanDerWaalsContact O-N 3.09Å; F265-S269 WeakPolarHBondContact CE2-OG 3.23Å; F265-S269 PolarHBondContact O-N 3.5Å; F265-S269 PolarHBondContact O-OG 2.98Å; F265-W303 HydrophobicContact CE2-CB 3.81Å; F265-W303 HydrophobicContact CE2-CD2 4.23Å; F265-W303 HydrophobicContact CE2-CE3 4.27Å; F265-W303 HydrophobicContact CE2-CG 4.07Å; F265-W303 HydrophobicContact CZ-CB 4.02Å; F265-W303 HydrophobicContact CZ-CD2 4.47Å; F265-W303 HydrophobicContact CZ-CG 4.08Å; F265-F306 HydrophobicContact CE1-CD1 4.4Å; F265-I307 HydrophobicContact CB-CD1 4.22Å; F265-I307 HydrophobicContact CB-CG1 4.33Å; F265-I307 HydrophobicContact CD1-CD1 3.7Å; F265-I307 HydrophobicContact CD1-CG1 4.29Å; F265-I307 HydrophobicContact CE1-CD1 4.38Å; F265-I307 HydrophobicContact CG-CD1 4.19Å; F265-I307 HydrophobicContact CG-CG1 4.36Å; F265-A569 HydrophobicContact CE1-CB 4.45Å; F265-A569 HydrophobicContact CZ-CB 4.13Å; F265-L572 HydrophobicContact CD2-CD2 3.86Å; F265-L572 HydrophobicContact CD2-CG 4.34Å; F265-L572 HydrophobicContact CE1-CG 4.48Å; F265-L572 HydrophobicContact CE2-CD2 3.35Å; F265-L572 HydrophobicContact CE2-CG 4.08Å; F265-L572 HydrophobicContact CZ-CB 4.37Å; F265-L572 HydrophobicContact CZ-CD2 3.74Å; F265-L572 HydrophobicContact CZ-CG 4.17Å; F265-L573 HydrophobicContact CD1-CB 4.25Å; F265-L573 HydrophobicContact CD1-CD1 4.01Å; F265-L573 HydrophobicContact CE1-CB 4.15Å; F265-I576 HydrophobicContact CB-CD1 3.7Å; F265-I576 HydrophobicContact CD2-CD1 4.27Å; F265-I576 HydrophobicContact CG-CD1 3.94Å
266	R	94.7	Very high	88.5	Confident	39 Å²	39	37.1 Å²	37.1	15%	0.147	17%	0.165	C	C	.	.	H	α-helix	trans	-54.5	-41.8	175.8	-168.6	-169.7	-60.4	154.2	-3.6	112.2	L262 D263 L270 F304 I307 S311 G595	L262-R266 PolarHBondContact O-N 3.37Å; D263-R266 IonicContact OD1-NH1 2.7Å; R266-L270 WeakPolarHBondContact O-CB 3.38Å; R266-L270 PolarHBondContact O-N 2.86Å; R266-F304 HydrophobicContact CG-CD2 3.98Å; R266-F304 HydrophobicContact CG-CE2 3.47Å; R266-F304 VanDerWaalsContact CG-CE2 3.47Å; R266-F304 HydrophobicContact CG-CZ 4.15Å; R266-I307 HydrophobicContact CB-CG1 4.34Å; R266-I307 HydrophobicContact CB-CG2 3.87Å; R266-I307 HydrophobicContact CG-CG2 3.95Å; R266-S311 PolarHBondContact NH2-OG 3.08Å; R266-G595 WeakPolarHBondContact CD-O 3.22Å; R266-G595 PolarHBondContact NH1-O 3.34Å
267	G	94.5	Very high	90.8	Very high	0 Å²	0	34 Å²	34	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.3	-40.6	177.3	0	0	0	0	0	114.6	D263 T264 F265 L270 V271 F591	D263-G267 PolarHBondContact O-N 2.99Å; T264-G267 CarbonylContact O-C 3.57Å; T264-G267 PolarHBondContact O-N 3.47Å; F265-G267 PolarHBondContact O-N 3.15Å; G267-L270 PolarHBondContact O-N 2.86Å; G267-V271 WeakPolarHBondContact O-CB 3.48Å; G267-V271 VanDerWaalsContact O-CG2 3.28Å; G267-V271 WeakPolarHBondContact O-CG2 3.3Å; G267-V271 PolarHBondContact O-N 2.89Å; G267-F591 VanDerWaalsContact CA-O 3.25Å; G267-F591 WeakPolarHBondContact CA-O 3.31Å
268	I	95.6	Very high	92.4	Very high	30 Å²	30	27.8 Å²	27.8	15%	0.154	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-50.4	174.9	-70.9	166.8	0	0	0	109.5	T264 F265 L270 V271 I272 I576 W586 F591	T264-I268 HydrophobicContact CG2-CD1 4.03Å; T264-I268 HydrophobicContact CG2-CG1 4.45Å; T264-I268 WeakPolarHBondContact O-CG1 3.5Å; T264-I268 PolarHBondContact O-N 2.97Å; F265-I268 PolarHBondContact O-N 3.35Å; F265-I268 VanDerWaalsContact O-N 3.09Å; I268-L270 VanDerWaalsContact C-N 3.25Å; I268-L270 PolarHBondContact O-N 3.31Å; I268-V271 PolarHBondContact O-N 3.25Å; I268-I272 HydrophobicContact CG2-CD1 3.76Å; I268-I272 HydrophobicContact CG2-CG1 4.48Å; I268-I272 WeakPolarHBondContact O-CG1 3.36Å; I268-I272 PolarHBondContact O-N 3.19Å; I268-I576 HydrophobicContact CD1-CD1 3.8Å; I268-W586 HydrophobicContact CD1-CH2 4.28Å; I268-F591 HydrophobicContact CG1-CB 3.76Å; I268-F591 HydrophobicContact CG1-CD1 3.87Å; I268-F591 HydrophobicContact CG1-CD2 3.95Å; I268-F591 HydrophobicContact CG1-CE1 4.47Å; I268-F591 HydrophobicContact CG1-CG 3.58Å
269	S	95.8	Very high	93.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.5	-41.3	178.4	-54.6	0	0	0	0	111.6	F265 M273	F265-S269 WeakPolarHBondContact CE2-OG 3.23Å; F265-S269 PolarHBondContact O-N 3.5Å; F265-S269 PolarHBondContact O-OG 2.98Å; S269-M273 WeakPolarHBondContact O-CB 3.37Å; S269-M273 PolarHBondContact O-N 3.3Å
270	L	94.8	Very high	93.4	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-70.9	-40.9	179.5	-175.1	60.8	0	0	0	113.3	R266 G267 I268 M273 V274 P594 S598 V601 Y602	R266-L270 WeakPolarHBondContact O-CB 3.38Å; R266-L270 PolarHBondContact O-N 2.86Å; G267-L270 PolarHBondContact O-N 2.86Å; I268-L270 VanDerWaalsContact C-N 3.25Å; I268-L270 PolarHBondContact O-N 3.31Å; L270-M273 HydrophobicContact CD1-SD 4.33Å; L270-M273 WeakPolarHBondContact O-CB 3.47Å; L270-M273 PolarHBondContact O-N 2.89Å; L270-V274 HydrophobicContact CD1-CG2 4.35Å; L270-V274 VanDerWaalsContact O-CG2 3.31Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 2.98Å; L270-P594 HydrophobicContact CD2-CB 4.29Å; L270-S598 VanDerWaalsContact CD2-CA 3.46Å; L270-S598 WeakPolarHBondContact CD2-O 3.37Å; L270-V601 HydrophobicContact CD2-CB 3.8Å; L270-V601 HydrophobicContact CD2-CG1 3.85Å; L270-V601 HydrophobicContact CG-CG1 4.09Å; L270-Y602 HydrophobicContact CD1-CD2 4.31Å
271	V	95.4	Very high	93.4	Very high	24 Å²	24	15.5 Å²	15.5	15%	0.145	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-42.5	177.9	167.6	0	0	0	0	110.8	G267 I268 F275 F591 P594 T635 V639	G267-V271 WeakPolarHBondContact O-CB 3.48Å; G267-V271 VanDerWaalsContact O-CG2 3.28Å; G267-V271 WeakPolarHBondContact O-CG2 3.3Å; G267-V271 PolarHBondContact O-N 2.89Å; I268-V271 PolarHBondContact O-N 3.25Å; V271-F275 WeakPolarHBondContact O-CB 3.05Å; V271-F275 PolarHBondContact O-N 3.21Å; V271-F275 VanDerWaalsContact O-N 3.11Å; V271-F591 HydrophobicContact CB-CD1 4.16Å; V271-F591 HydrophobicContact CB-CE1 4.35Å; V271-F591 HydrophobicContact CG1-CD1 4.38Å; V271-F591 HydrophobicContact CG1-CE1 4.09Å; V271-F591 HydrophobicContact CG2-CD1 4Å; V271-F591 HydrophobicContact CG2-CE1 4.5Å; V271-P594 HydrophobicContact CG2-CB 4.35Å; V271-P594 HydrophobicContact CG2-CG 3.7Å; V271-T635 HydrophobicContact CG1-CG2 3.8Å; V271-V639 HydrophobicContact CG1-CG2 4.49Å; V271-V639 HydrophobicContact CG2-CG2 3.73Å
272	I	95.4	Very high	93.3	Very high	48 Å²	48	19.5 Å²	19.5	25%	0.246	10%	0.099	C	C	.	.	H	α-helix	trans	-66.2	-42.4	175.5	-58.4	168.1	0	0	0	110	I268 V274 F275 V276 V296 V300	I268-I272 HydrophobicContact CG2-CD1 3.76Å; I268-I272 HydrophobicContact CG2-CG1 4.48Å; I268-I272 WeakPolarHBondContact O-CG1 3.36Å; I268-I272 PolarHBondContact O-N 3.19Å; I272-V274 PolarHBondContact O-N 2.98Å; I272-F275 PolarHBondContact O-N 2.95Å; I272-V276 HydrophobicContact CG2-CG1 4.31Å; I272-V276 WeakPolarHBondContact O-CG2 3.44Å; I272-V276 PolarHBondContact O-N 3.41Å; I272-V296 HydrophobicContact CG2-CG1 4.14Å; I272-V300 HydrophobicContact CB-CG1 3.59Å; I272-V300 HydrophobicContact CG2-CG1 3.36Å
273	M	94.5	Very high	93.2	Very high	10 Å²	10	19 Å²	19	5%	0.049	10%	0.096	C	C	.	.	H	α-helix	trans	-56.2	-49.3	176.4	-178.9	-178.6	-72.4	0	0	112.3	S269 L270 F275 V276 N277 V300 F301 F304 Y602	S269-M273 WeakPolarHBondContact O-CB 3.37Å; S269-M273 PolarHBondContact O-N 3.3Å; L270-M273 HydrophobicContact CD1-SD 4.33Å; L270-M273 WeakPolarHBondContact O-CB 3.47Å; L270-M273 PolarHBondContact O-N 2.89Å; M273-F275 VanDerWaalsContact C-N 3.32Å; M273-F275 PolarHBondContact O-N 3.35Å; M273-V276 VanDerWaalsContact O-CG2 3.27Å; M273-V276 WeakPolarHBondContact O-CG2 3.26Å; M273-V276 PolarHBondContact O-N 2.92Å; M273-N277 VanDerWaalsContact O-CB 3.31Å; M273-N277 WeakPolarHBondContact O-CB 3.25Å; M273-N277 VanDerWaalsContact O-CG 3.26Å; M273-N277 PolarHBondContact O-N 3.17Å; M273-N277 PolarHBondContact O-OD1 3.25Å; M273-V300 HydrophobicContact CB-CB 4.22Å; M273-V300 HydrophobicContact CB-CG2 3.95Å; M273-V300 HydrophobicContact CE-CG2 4.24Å; M273-V300 HydrophobicContact CG-CG2 4.33Å; M273-F301 HydrophobicContact CE-CB 4.15Å; M273-F301 HydrophobicContact CE-CD2 4.39Å; M273-F304 HydrophobicContact CE-CB 4.33Å; M273-Y602 HydrophobicContact SD-CD2 3.7Å; M273-Y602 HydrophobicContact SD-CE2 3.67Å
274	V	94.6	Very high	93	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.012	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-43.3	177.4	171.9	0	0	0	0	111	L270 I272 V276 N277 Y278 V601 H605 T635	L270-V274 HydrophobicContact CD1-CG2 4.35Å; L270-V274 VanDerWaalsContact O-CG2 3.31Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 2.98Å; I272-V274 PolarHBondContact O-N 2.98Å; V274-V276 PolarHBondContact O-N 3.19Å; V274-N277 PolarHBondContact O-N 3.42Å; V274-Y278 HydrophobicContact CG1-CD2 3.78Å; V274-Y278 HydrophobicContact CG1-CE2 3.4Å; V274-Y278 VanDerWaalsContact O-CD2 3.23Å; V274-Y278 WeakPolarHBondContact O-CD2 3.18Å; V274-Y278 PolarHBondContact O-N 2.82Å; V274-Y278 VanDerWaalsContact O-N 3.09Å; V274-V601 HydrophobicContact CG2-CG1 4.11Å; V274-H605 HydrophobicContact CG1-CB 4Å; V274-H605 HydrophobicContact CG2-CB 4.12Å; V274-T635 HydrophobicContact CG1-CG2 4.42Å
275	F	94.8	Very high	92.7	Very high	30 Å²	30	26.5 Å²	26.5	13%	0.132	13%	0.125	C	C	.	.	H	α-helix	trans	-63.2	-42.5	179.5	176.7	-106	0	0	0	113.4	V271 I272 M273 G280 F286 L628 N631 I632 T635	V271-F275 WeakPolarHBondContact O-CB 3.05Å; V271-F275 PolarHBondContact O-N 3.21Å; V271-F275 VanDerWaalsContact O-N 3.11Å; I272-F275 PolarHBondContact O-N 2.95Å; M273-F275 VanDerWaalsContact C-N 3.32Å; M273-F275 PolarHBondContact O-N 3.35Å; F275-G280 WeakPolarHBondContact O-CA 3.37Å; F275-G280 PolarHBondContact O-N 3.21Å; F275-F286 HydrophobicContact CE1-CD1 4.28Å; F275-F286 HydrophobicContact CE1-CD2 4.02Å; F275-F286 HydrophobicContact CE1-CE1 4.03Å; F275-F286 AromaticContact CE1-CE2 3.67Å; F275-F286 HydrophobicContact CE1-CE2 3.67Å; F275-F286 HydrophobicContact CE1-CG 4.29Å; F275-F286 AromaticContact CE1-CZ 3.72Å; F275-F286 HydrophobicContact CE1-CZ 3.72Å; F275-F286 HydrophobicContact CZ-CE2 4.18Å; F275-L628 HydrophobicContact CE2-CD1 4.2Å; F275-L628 HydrophobicContact CZ-CD1 3.82Å; F275-N631 HydrophobicContact CD2-CB 3.98Å; F275-N631 HydrophobicContact CE2-CB 3.77Å; F275-I632 HydrophobicContact CE2-CG1 3.81Å; F275-T635 WeakPolarHBondContact CA-OG1 3.32Å; F275-T635 HydrophobicContact CB-CG2 4.16Å
276	V	93.9	Very high	92.5	Very high	12 Å²	12	28 Å²	28	7%	0.073	13%	0.132	C	C	.	.	H	α-helix	trans	-75.3	-32.5	178.1	-59.2	0	0	0	0	112.3	I272 M273 V274 Y278 G279 F286 A297 V300	I272-V276 HydrophobicContact CG2-CG1 4.31Å; I272-V276 WeakPolarHBondContact O-CG2 3.44Å; I272-V276 PolarHBondContact O-N 3.41Å; M273-V276 VanDerWaalsContact O-CG2 3.27Å; M273-V276 WeakPolarHBondContact O-CG2 3.26Å; M273-V276 PolarHBondContact O-N 2.92Å; V274-V276 PolarHBondContact O-N 3.19Å; V276-Y278 VanDerWaalsContact C-N 3.34Å; V276-Y278 PolarHBondContact O-N 3.3Å; V276-G279 VanDerWaalsContact O-CA 3.29Å; V276-G279 WeakPolarHBondContact O-CA 3.48Å; V276-G279 PolarHBondContact O-N 3.28Å; V276-F286 HydrophobicContact CG1-CB 4.43Å; V276-F286 HydrophobicContact CG1-CD1 4.08Å; V276-A297 HydrophobicContact CB-CB 3.93Å; V276-A297 HydrophobicContact CG1-CB 4.02Å; V276-A297 HydrophobicContact CG2-CB 3.99Å; V276-V300 HydrophobicContact CG2-CG2 4.49Å
277	N	92.3	Very high	92.2	Very high	56 Å²	56	30.4 Å²	30.4	30%	0.299	14%	0.141	S	C	.	.	H	α-helix	trans	-63.8	-39.1	174.9	-79.1	11.4	0	0	0	111.4	M273 V274 G279 H605 E606	M273-N277 VanDerWaalsContact O-CB 3.31Å; M273-N277 WeakPolarHBondContact O-CB 3.25Å; M273-N277 VanDerWaalsContact O-CG 3.26Å; M273-N277 PolarHBondContact O-N 3.17Å; M273-N277 PolarHBondContact O-OD1 3.25Å; V274-N277 PolarHBondContact O-N 3.42Å; N277-G279 PolarHBondContact O-N 2.94Å; N277-G279 VanDerWaalsContact O-N 3.08Å; N277-H605 PolarHBondContact ND2-NE2 3.27Å; N277-E606 PolarHBondContact ND2-OE1 3.46Å
278	Y	91.2	Very high	92.1	Very high	24 Å²	24	33.9 Å²	33.9	9%	0.094	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.9	169.7	-70	-46.3	0	0	0	114	V274 V276 H605 E609 N631 A634 W638	V274-Y278 HydrophobicContact CG1-CD2 3.78Å; V274-Y278 HydrophobicContact CG1-CE2 3.4Å; V274-Y278 VanDerWaalsContact O-CD2 3.23Å; V274-Y278 WeakPolarHBondContact O-CD2 3.18Å; V274-Y278 PolarHBondContact O-N 2.82Å; V274-Y278 VanDerWaalsContact O-N 3.09Å; V276-Y278 VanDerWaalsContact C-N 3.34Å; V276-Y278 PolarHBondContact O-N 3.3Å; Y278-H605 HydrophobicContact CE2-CB 4.49Å; Y278-H605 WeakPolarHBondContact OH-CB 3.21Å; Y278-H605 PolarHBondContact OH-O 3.44Å; Y278-E609 HydrophobicContact CD1-CG 4.1Å; Y278-E609 HydrophobicContact CE1-CB 4.18Å; Y278-E609 HydrophobicContact CE1-CG 3.91Å; Y278-N631 VanDerWaalsContact O-CG 3.32Å; Y278-N631 PolarHBondContact O-ND2 3.23Å; Y278-N631 PolarHBondContact O-OD1 3.2Å; Y278-A634 HydrophobicContact CD2-CB 3.82Å; Y278-A634 HydrophobicContact CE2-CB 3.59Å; Y278-W638 PolarHBondContact OH-NE1 3.23Å
279	G	89.3	Confident	91.8	Very high	27 Å²	27	32.8 Å²	32.8	28%	0.278	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	2	174.5	0	0	0	0	0	114.9	V276 N277 G281 R282 N631	V276-G279 VanDerWaalsContact O-CA 3.29Å; V276-G279 WeakPolarHBondContact O-CA 3.48Å; V276-G279 PolarHBondContact O-N 3.28Å; N277-G279 PolarHBondContact O-N 2.94Å; N277-G279 VanDerWaalsContact O-N 3.08Å; G279-G281 VanDerWaalsContact C-N 3.3Å; G279-G281 PolarHBondContact O-N 2.89Å; G279-G281 VanDerWaalsContact O-N 3.12Å; G279-R282 WeakPolarHBondContact O-CA 3.39Å; G279-R282 PolarHBondContact O-N 3.37Å; G279-N631 VanDerWaalsContact C-ND2 3.35Å
280	G	90.1	Very high	91.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	48.7	38.8	175.5	0	0	0	0	0	116.1	F275 R282 Y283 F286 N631	F275-G280 WeakPolarHBondContact O-CA 3.37Å; F275-G280 PolarHBondContact O-N 3.21Å; G280-R282 PolarHBondContact O-N 3.45Å; G280-Y283 WeakPolarHBondContact O-CD2 3.3Å; G280-F286 WeakPolarHBondContact O-CD2 3.24Å; G280-N631 PolarHBondContact N-ND2 3.12Å
281	G	87.9	Confident	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	71.2	13.1	-175.8	0	0	0	0	0	114.4	G279 Y283 H624 N631	G279-G281 VanDerWaalsContact C-N 3.3Å; G279-G281 PolarHBondContact O-N 2.89Å; G279-G281 VanDerWaalsContact O-N 3.12Å; G281-Y283 WeakPolarHBondContact O-CD2 3.43Å; G281-Y283 PolarHBondContact O-N 3.35Å; G281-H624 PolarHBondContact O-ND1 3.32Å; G281-N631 PolarHBondContact N-ND2 2.85Å
282	R	89.2	Confident	91.3	Very high	86 Å²	86	33.8 Å²	33.8	33%	0.325	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	61.8	13.1	-178.9	-68	-174.7	173.8	-172.8	0.4	115.9	M75 G279 G280 R287 H624 H627	M75-R282 HydrophobicContact CE-CB 4.35Å; M75-R282 HydrophobicContact SD-CB 4.15Å; G279-R282 WeakPolarHBondContact O-CA 3.39Å; G279-R282 PolarHBondContact O-N 3.37Å; G280-R282 PolarHBondContact O-N 3.45Å; R282-R287 PolarHBondContact O-NE 3.13Å; R282-R287 PolarHBondContact O-NH2 3.44Å; R282-H624 PolarHBondContact O-CE1 2.97Å; R282-H627 PolarHBondContact NE-CE1 3.01Å; R282-H627 VanDerWaalsContact NE-CE1 3.27Å
283	Y	90.5	Very high	91.1	Very high	3 Å²	3	32 Å²	32	1%	0.012	15%	0.151	C	C	.	.			trans	-65.9	143.9	174.4	-65.4	-83.9	0	0	0	112.3	S184 I188 G280 G281 F285 F286 R287 H624 L628	S184-Y283 VanDerWaalsContact O-CE1 3.29Å; S184-Y283 WeakPolarHBondContact O-CE1 3.5Å; S184-Y283 PolarHBondContact O-OH 2.91Å; I188-Y283 HydrophobicContact CB-CE2 4.1Å; I188-Y283 HydrophobicContact CG2-CE1 4.09Å; I188-Y283 HydrophobicContact CG2-CE2 4.49Å; G280-Y283 WeakPolarHBondContact O-CD2 3.3Å; G281-Y283 WeakPolarHBondContact O-CD2 3.43Å; G281-Y283 PolarHBondContact O-N 3.35Å; Y283-F285 VanDerWaalsContact C-N 3.27Å; Y283-F285 AromaticContact CD1-CE1 3.85Å; Y283-F285 HydrophobicContact CD1-CE1 3.85Å; Y283-F285 AromaticContact CD1-CZ 3.8Å; Y283-F285 HydrophobicContact CD1-CZ 3.8Å; Y283-F285 HydrophobicContact CD2-CZ 4.3Å; Y283-F285 AromaticContact CG-CE1 3.95Å; Y283-F285 HydrophobicContact CG-CE1 3.95Å; Y283-F285 HydrophobicContact CG-CE2 4.29Å; Y283-F285 AromaticContact CG-CZ 3.61Å; Y283-F285 HydrophobicContact CG-CZ 3.61Å; Y283-F285 PolarHBondContact O-N 3.17Å; Y283-F286 HydrophobicContact CD2-CD2 4.35Å; Y283-F286 PolarHBondContact O-N 3.23Å; Y283-F286 VanDerWaalsContact O-N 3.14Å; Y283-R287 PolarHBondContact O-N 3.37Å; Y283-H624 HydrophobicContact CE1-CB 4.29Å; Y283-H624 HydrophobicContact CE2-CB 4.39Å; Y283-L628 HydrophobicContact CE2-CB 4.45Å; Y283-L628 HydrophobicContact CE2-CD1 4.32Å; Y283-L628 HydrophobicContact CE2-CD2 4.27Å
284	W	87	Confident	91.1	Very high	118 Å²	118	34.4 Å²	34.4	45%	0.447	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-57.7	-35.2	-178.4	70.1	-96.7	0	0	0	113.3	Q129 H130 F286 R287	Q129-W284 HydrophobicContact CB-CB 4.36Å; Q129-W284 HydrophobicContact CG-CB 4.48Å; H130-W284 AromaticContact CE1-CE3 3.74Å; W284-F286 VanDerWaalsContact C-N 3.33Å; W284-F286 PolarHBondContact O-N 3.25Å; W284-R287 PolarHBondContact O-N 2.95Å
285	F	89.7	Confident	91	Very high	46 Å²	46	35.1 Å²	35.1	20%	0.202	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-78	-12.3	-178	51.2	-98.1	0	0	0	114.6	I188 Y283 V296	I188-F285 HydrophobicContact CD1-CE2 3.56Å; I188-F285 HydrophobicContact CD1-CZ 3.57Å; I188-F285 HydrophobicContact CG2-CZ 4.47Å; Y283-F285 VanDerWaalsContact C-N 3.27Å; Y283-F285 AromaticContact CD1-CE1 3.85Å; Y283-F285 HydrophobicContact CD1-CE1 3.85Å; Y283-F285 AromaticContact CD1-CZ 3.8Å; Y283-F285 HydrophobicContact CD1-CZ 3.8Å; Y283-F285 HydrophobicContact CD2-CZ 4.3Å; Y283-F285 AromaticContact CG-CE1 3.95Å; Y283-F285 HydrophobicContact CG-CE1 3.95Å; Y283-F285 HydrophobicContact CG-CE2 4.29Å; Y283-F285 AromaticContact CG-CZ 3.61Å; Y283-F285 HydrophobicContact CG-CZ 3.61Å; Y283-F285 PolarHBondContact O-N 3.17Å; F285-V296 PolarHBondContact O-N 2.8Å
286	F	91.3	Very high	90.8	Very high	33 Å²	33	36.3 Å²	36.3	15%	0.145	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-99.1	-2.8	169.6	-68.6	-54.2	0	0	0	113	I188 F275 V276 G280 Y283 W284 V296 A297	I188-F286 HydrophobicContact CD1-CE2 3.53Å; I188-F286 HydrophobicContact CD1-CZ 4.04Å; F275-F286 HydrophobicContact CE1-CD1 4.28Å; F275-F286 HydrophobicContact CE1-CD2 4.02Å; F275-F286 HydrophobicContact CE1-CE1 4.03Å; F275-F286 AromaticContact CE1-CE2 3.67Å; F275-F286 HydrophobicContact CE1-CE2 3.67Å; F275-F286 HydrophobicContact CE1-CG 4.29Å; F275-F286 AromaticContact CE1-CZ 3.72Å; F275-F286 HydrophobicContact CE1-CZ 3.72Å; F275-F286 HydrophobicContact CZ-CE2 4.18Å; V276-F286 HydrophobicContact CG1-CB 4.43Å; V276-F286 HydrophobicContact CG1-CD1 4.08Å; G280-F286 WeakPolarHBondContact O-CD2 3.24Å; Y283-F286 HydrophobicContact CD2-CD2 4.35Å; Y283-F286 PolarHBondContact O-N 3.23Å; Y283-F286 VanDerWaalsContact O-N 3.14Å; W284-F286 VanDerWaalsContact C-N 3.33Å; W284-F286 PolarHBondContact O-N 3.25Å; F286-V296 HydrophobicContact CD1-CB 3.99Å; F286-V296 HydrophobicContact CD1-CG1 4.1Å; F286-V296 HydrophobicContact CD1-CG2 4.46Å; F286-V296 HydrophobicContact CE1-CB 4.22Å; F286-V296 HydrophobicContact CE1-CG1 4.02Å; F286-V296 HydrophobicContact CE1-CG2 4.39Å; F286-A297 VanDerWaalsContact O-CB 3.3Å; F286-A297 WeakPolarHBondContact O-CB 3.23Å
287	R	89.1	Confident	90.7	Very high	89 Å²	89	35.8 Å²	35.8	34%	0.336	18%	0.175	S	C	.	.	S	Bend	trans	-88	151	169.4	-66.3	-175.7	-169.8	163.8	13.3	109.7	D76 R282 Y283 W284 T295	D76-R287 IonicContact OD2-CZ 2.68Å; D76-R287 IonicContact OD2-NH1 2.95Å; D76-R287 IonicContact OD2-NH2 3.03Å; D76-R287 PolarHBondContact OD2-NH2 3.15Å; R282-R287 PolarHBondContact O-NE 3.13Å; R282-R287 PolarHBondContact O-NH2 3.44Å; Y283-R287 PolarHBondContact O-N 3.37Å; W284-R287 PolarHBondContact O-N 2.95Å; R287-T295 VanDerWaalsContact O-CB 3.24Å; R287-T295 WeakPolarHBondContact O-CB 3.28Å; R287-T295 VanDerWaalsContact O-CG2 3.26Å; R287-T295 WeakPolarHBondContact O-CG2 3.4Å; R287-T295 PolarHBondContact O-OG1 3.39Å
288	H	90.8	Very high	90.8	Very high	72 Å²	72	33.2 Å²	33.2	33%	0.333	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-63.1	146.2	176.1	-65	-51.1	0	0	0	111.7	S290 A297 D298 K554	H288-S290 PolarHBondContact O-N 2.72Å; H288-A297 WeakPolarHBondContact CE1-CB 3.07Å; H288-A297 PolarHBondContact CE1-O 3.34Å; H288-A297 WeakPolarHBondContact ND1-CB 3.38Å; H288-D298 IonicContact CE1-OD1 3.52Å; H288-D298 IonicContact CG-OD1 2.96Å; H288-D298 IonicContact ND1-OD1 3.47Å; H288-D298 PolarHBondContact ND1-OD1 3.02Å; H288-K554 PolarHBondContact CE1-NZ 3Å; H288-K554 PolarHBondContact ND1-NZ 3.22Å; H288-K554 PolarHBondContact NE2-NZ 2.96Å; H288-K554 VanDerWaalsContact NE2-NZ 3.19Å
289	S	89.9	Confident	91	Very high	8 Å²	8	33.5 Å²	33.5	6%	0.056	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-60	139.2	168.9	-172.7	0	0	0	0	110.6	R98 W291 N292 D298	R98-S289 PolarHBondContact NH2-OG 3.5Å; R98-S289 VanDerWaalsContact NH2-OG 3.09Å; S289-W291 VanDerWaalsContact C-N 3.3Å; S289-W291 PolarHBondContact O-N 3.38Å; S289-N292 PolarHBondContact OG-O 2.75Å; S289-D298 PolarHBondContact N-OD2 2.87Å
290	S	90.3	Very high	91.2	Very high	23 Å²	23	32.4 Å²	32.4	16%	0.161	15%	0.152	C	C	.	.	S	Bend	trans	-63.3	-34.5	-179.8	-58.9	0	0	0	0	113.1	H288 S477 I480 N555	H288-S290 PolarHBondContact O-N 2.72Å; S290-S477 PolarHBondContact O-N 3.01Å; S290-I480 WeakPolarHBondContact OG-CD1 3.3Å; S290-I480 WeakPolarHBondContact OG-CG1 3.42Å; S290-N555 PolarHBondContact O-ND2 2.87Å
291	W	92.6	Very high	91.4	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.008	15%	0.154	C	C	.	.	S	Bend	trans	-148.2	-80.1	174.4	-158.2	-109.7	0	0	0	113	S289 L439 G440 P441 T454 Y481 F487 N553 N555 L556	S289-W291 VanDerWaalsContact C-N 3.3Å; S289-W291 PolarHBondContact O-N 3.38Å; W291-L439 PolarHBondContact NE1-O 2.87Å; W291-G440 VanDerWaalsContact CZ2-O 3.24Å; W291-G440 WeakPolarHBondContact CZ2-O 3.38Å; W291-P441 HydrophobicContact CB-CB 4.26Å; W291-P441 HydrophobicContact CB-CG 4.44Å; W291-P441 HydrophobicContact CD2-CB 3.6Å; W291-P441 HydrophobicContact CD2-CG 4.38Å; W291-P441 HydrophobicContact CE3-CB 3.99Å; W291-P441 HydrophobicContact CG-CB 3.74Å; W291-P441 HydrophobicContact CG-CG 4.04Å; W291-P441 HydrophobicContact CZ2-CB 4.46Å; W291-T454 HydrophobicContact CH2-CG2 4.14Å; W291-T454 HydrophobicContact CZ3-CG2 4.35Å; W291-Y481 HydrophobicContact CB-CE2 3.86Å; W291-F487 HydrophobicContact CH2-CD1 4.33Å; W291-F487 HydrophobicContact CH2-CD2 4.49Å; W291-F487 HydrophobicContact CH2-CE1 4.19Å; W291-F487 HydrophobicContact CH2-CE2 4.35Å; W291-F487 HydrophobicContact CH2-CG 4.5Å; W291-F487 HydrophobicContact CH2-CZ 4.2Å; W291-F487 HydrophobicContact CZ3-CD1 4.21Å; W291-F487 HydrophobicContact CZ3-CE1 4.26Å; W291-N553 PolarHBondContact NE1-ND2 3.45Å; W291-N553 PolarHBondContact O-ND2 2.88Å; W291-N555 HydrophobicContact CE3-CB 4Å; W291-N555 HydrophobicContact CH2-CB 4.35Å; W291-N555 HydrophobicContact CZ3-CB 3.85Å; W291-L556 HydrophobicContact CZ2-CD1 4.39Å; W291-L556 HydrophobicContact CZ2-CD2 4.42Å; W291-L556 HydrophobicContact CZ2-CG 4.29Å
292	N	93.2	Very high	91.8	Very high	21 Å²	21	32.9 Å²	32.9	11%	0.112	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-92.5	150.6	179.1	-64.7	-28.3	0	0	0	111.7	R98 S289 D546 P551 N553	R98-N292 PolarHBondContact NH2-O 3.21Å; S289-N292 PolarHBondContact OG-O 2.75Å; N292-D546 WeakPolarHBondContact CB-OD1 3.36Å; N292-D546 PolarHBondContact ND2-OD1 3.02Å; N292-P551 HydrophobicContact CB-CB 4.45Å; N292-N553 PolarHBondContact OD1-ND2 3.18Å
293	G	91.6	Very high	92.2	Very high	9 Å²	9	30.2 Å²	30.2	9%	0.093	14%	0.144	C	C	.	.	S	Bend	trans	102.5	-177.4	178.4	0	0	0	0	0	113.9	V552	G293-V552 PolarHBondContact N-O 3.29Å
294	L	92.7	Very high	92.4	Very high	61 Å²	61	31.3 Å²	31.3	32%	0.319	15%	0.149	S	C	.	.			trans	-131.2	134.2	-173.4	-69.9	175.3	0	0	0	111.3	D298 V552 Y561 T564 L565 F568	L294-D298 HydrophobicContact CD2-CB 4.28Å; L294-V552 HydrophobicContact CD1-CG1 3.85Å; L294-V552 HydrophobicContact CD2-CG1 3.52Å; L294-V552 HydrophobicContact CG-CG1 3.51Å; L294-Y561 HydrophobicContact CD2-CD2 3.7Å; L294-Y561 HydrophobicContact CD2-CE2 3.63Å; L294-T564 HydrophobicContact CD1-CG2 3.83Å; L294-L565 HydrophobicContact CD1-CD2 4.2Å; L294-L565 HydrophobicContact CD2-CD2 3.77Å; L294-F568 HydrophobicContact CD1-CE2 4.28Å
295	T	92.7	Very high	92.9	Very high	18 Å²	18	25.7 Å²	25.7	11%	0.11	13%	0.128	C	C	.	.			trans	-121	172.5	168.3	67.5	0	0	0	0	110	R287 A297 D298	R287-T295 VanDerWaalsContact O-CB 3.24Å; R287-T295 WeakPolarHBondContact O-CB 3.28Å; R287-T295 VanDerWaalsContact O-CG2 3.26Å; R287-T295 WeakPolarHBondContact O-CG2 3.4Å; R287-T295 PolarHBondContact O-OG1 3.39Å; T295-A297 PolarHBondContact O-N 3.17Å; T295-D298 WeakPolarHBondContact CB-OD2 3.28Å; T295-D298 PolarHBondContact N-OD2 3.27Å; T295-D298 PolarHBondContact O-N 3.25Å; T295-D298 VanDerWaalsContact O-N 3.09Å; T295-D298 PolarHBondContact OG1-OD2 3.36Å
296	V	92.2	Very high	93.3	Very high	54 Å²	54	23.5 Å²	23.5	33%	0.327	12%	0.118	S	C	.	.	H	α-helix	trans	-60.6	-37.3	-179.4	178.1	0	0	0	0	111.5	I272 F285 F286 D298 L299	I272-V296 HydrophobicContact CG2-CG1 4.14Å; F285-V296 PolarHBondContact O-N 2.8Å; F286-V296 HydrophobicContact CD1-CB 3.99Å; F286-V296 HydrophobicContact CD1-CG1 4.1Å; F286-V296 HydrophobicContact CD1-CG2 4.46Å; F286-V296 HydrophobicContact CE1-CB 4.22Å; F286-V296 HydrophobicContact CE1-CG1 4.02Å; F286-V296 HydrophobicContact CE1-CG2 4.39Å; V296-D298 PolarHBondContact O-N 3.21Å; V296-L299 PolarHBondContact O-N 3.35Å
297	A	91.6	Very high	93.6	Very high	2 Å²	2	22 Å²	22	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-69.1	-19.4	-179.5	0	0	0	0	0	113	V276 F286 H288 T295	V276-A297 HydrophobicContact CB-CB 3.93Å; V276-A297 HydrophobicContact CG1-CB 4.02Å; V276-A297 HydrophobicContact CG2-CB 3.99Å; F286-A297 VanDerWaalsContact O-CB 3.3Å; F286-A297 WeakPolarHBondContact O-CB 3.23Å; H288-A297 WeakPolarHBondContact CE1-CB 3.07Å; H288-A297 PolarHBondContact CE1-O 3.34Å; H288-A297 WeakPolarHBondContact ND1-CB 3.38Å; T295-A297 PolarHBondContact O-N 3.17Å
298	D	93.8	Very high	93.8	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-80.7	-19	178	-54.7	-37.5	0	0	0	111.9	H288 S289 L294 T295 V296 P302 K554 Y561	H288-D298 IonicContact CE1-OD1 3.52Å; H288-D298 IonicContact CG-OD1 2.96Å; H288-D298 IonicContact ND1-OD1 3.47Å; H288-D298 PolarHBondContact ND1-OD1 3.02Å; S289-D298 PolarHBondContact N-OD2 2.87Å; L294-D298 HydrophobicContact CD2-CB 4.28Å; T295-D298 WeakPolarHBondContact CB-OD2 3.28Å; T295-D298 PolarHBondContact N-OD2 3.27Å; T295-D298 PolarHBondContact O-N 3.25Å; T295-D298 VanDerWaalsContact O-N 3.09Å; T295-D298 PolarHBondContact OG1-OD2 3.36Å; V296-D298 PolarHBondContact O-N 3.21Å; D298-P302 VanDerWaalsContact O-CD 3.31Å; D298-P302 WeakPolarHBondContact O-CD 3.29Å; D298-K554 HydrophobicContact CB-CD 4.04Å; D298-K554 WeakPolarHBondContact OD1-CD 3.44Å; D298-K554 IonicContact OD1-NZ 3.85Å; D298-Y561 HydrophobicContact CB-CE2 4.37Å; D298-Y561 PolarHBondContact O-OH 3.22Å
299	L	94.8	Very high	94.1	Very high	30 Å²	30	15.2 Å²	15.2	16%	0.157	8%	0.084	C	C	.	.	H	α-helix	trans	-76.6	-36.7	-175.4	-51.4	-179.5	0	0	0	113.8	V296 F301 P302 W303 L565 F568	V296-L299 PolarHBondContact O-N 3.35Å; L299-F301 PolarHBondContact O-N 3Å; L299-P302 WeakPolarHBondContact O-CD 3.37Å; L299-W303 HydrophobicContact CB-CD2 4.26Å; L299-W303 HydrophobicContact CB-CE3 4.29Å; L299-W303 HydrophobicContact CB-CH2 3.93Å; L299-W303 HydrophobicContact CB-CZ2 3.89Å; L299-W303 HydrophobicContact CB-CZ3 4.13Å; L299-W303 HydrophobicContact CD1-CH2 3.78Å; L299-W303 HydrophobicContact CD1-CZ2 4Å; L299-W303 HydrophobicContact CG-CH2 4.47Å; L299-W303 HydrophobicContact CG-CZ2 4.41Å; L299-W303 WeakPolarHBondContact O-CB 3.42Å; L299-W303 PolarHBondContact O-N 3.02Å; L299-L565 HydrophobicContact CB-CD1 4.16Å; L299-L565 HydrophobicContact CD2-CD1 3.44Å; L299-L565 VanDerWaalsContact CD2-CD1 3.44Å; L299-L565 HydrophobicContact CG-CD1 4.4Å; L299-F568 HydrophobicContact CD2-CD2 4.25Å; L299-F568 HydrophobicContact CD2-CE2 4.49Å
300	V	93.9	Very high	94.3	Very high	4 Å²	4	14.8 Å²	14.8	2%	0.024	8%	0.081	C	C	.	.	H	α-helix	trans	-69.9	-39.9	-162.6	-64.4	0	0	0	0	114	I272 M273 V276 W303 F304	I272-V300 HydrophobicContact CB-CG1 3.59Å; I272-V300 HydrophobicContact CG2-CG1 3.36Å; M273-V300 HydrophobicContact CB-CB 4.22Å; M273-V300 HydrophobicContact CB-CG2 3.95Å; M273-V300 HydrophobicContact CE-CG2 4.24Å; M273-V300 HydrophobicContact CG-CG2 4.33Å; V276-V300 HydrophobicContact CG2-CG2 4.49Å; V300-W303 PolarHBondContact O-N 3.03Å; V300-F304 PolarHBondContact O-N 2.77Å
301	F	94.4	Very high	94.4	Very high	11 Å²	11	14.7 Å²	14.7	5%	0.048	8%	0.08	C	C	.	.	H	α-helix	trans	-69.1	-50.1	-175.3	176.1	-141.4	0	0	0	111.7	M273 L299 W303 F304 V305 V367 R370 L371 W557	M273-F301 HydrophobicContact CE-CB 4.15Å; M273-F301 HydrophobicContact CE-CD2 4.39Å; L299-F301 PolarHBondContact O-N 3Å; F301-W303 VanDerWaalsContact C-N 3.34Å; F301-W303 PolarHBondContact O-N 2.99Å; F301-F304 WeakPolarHBondContact O-CB 3.24Å; F301-F304 PolarHBondContact O-N 3.48Å; F301-F304 VanDerWaalsContact O-N 3.12Å; F301-V305 HydrophobicContact CD2-CG2 4.15Å; F301-V305 HydrophobicContact CE2-CG2 3.78Å; F301-V305 HydrophobicContact CZ-CG2 4.29Å; F301-V305 WeakPolarHBondContact O-CG2 3.4Å; F301-V305 PolarHBondContact O-N 3.09Å; F301-V367 HydrophobicContact CD2-CG1 3.76Å; F301-V367 HydrophobicContact CE1-CG1 4.44Å; F301-V367 HydrophobicContact CE2-CB 4.47Å; F301-V367 HydrophobicContact CE2-CG1 3.46Å; F301-V367 VanDerWaalsContact CE2-CG1 3.46Å; F301-V367 HydrophobicContact CG-CG1 4.41Å; F301-V367 HydrophobicContact CZ-CB 4.4Å; F301-V367 HydrophobicContact CZ-CG1 3.84Å; F301-R370 HydrophobicContact CZ-CB 4.3Å; F301-R370 HydrophobicContact CZ-CG 4.24Å; F301-L371 HydrophobicContact CE2-CD1 4.22Å; F301-L371 HydrophobicContact CE2-CD2 4.04Å; F301-L371 HydrophobicContact CE2-CG 3.88Å; F301-W557 HydrophobicContact CD1-CH2 4.45Å; F301-W557 AromaticContact CD1-CZ2 3.44Å; F301-W557 HydrophobicContact CD1-CZ2 3.44Å; F301-W557 VanDerWaalsContact CD1-CZ2 3.44Å; F301-W557 AromaticContact CE1-CE2 3.99Å; F301-W557 HydrophobicContact CE1-CH2 4.34Å; F301-W557 AromaticContact CE1-CZ2 3.4Å; F301-W557 HydrophobicContact CE1-CZ2 3.4Å; F301-W557 VanDerWaalsContact CE1-CZ2 3.4Å; F301-W557 HydrophobicContact CG-CZ2 4.2Å; F301-W557 HydrophobicContact CZ-CZ2 4.15Å
302	P	96.5	Very high	94.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.2	-42.5	171.7	-25.1	34.1	0	0	0	113.5	D298 L299 F304 V305 F306 M501 W557 Y561 L565	D298-P302 VanDerWaalsContact O-CD 3.31Å; D298-P302 WeakPolarHBondContact O-CD 3.29Å; L299-P302 WeakPolarHBondContact O-CD 3.37Å; P302-F304 VanDerWaalsContact C-N 3.26Å; P302-F304 PolarHBondContact O-N 3.01Å; P302-V305 WeakPolarHBondContact O-CB 3.34Å; P302-V305 PolarHBondContact O-N 2.97Å; P302-V305 VanDerWaalsContact O-N 3.13Å; P302-F306 PolarHBondContact O-N 3.29Å; P302-M501 HydrophobicContact CB-CE 3.64Å; P302-M501 HydrophobicContact CB-CG 4.26Å; P302-M501 VanDerWaalsContact O-CE 3.32Å; P302-M501 WeakPolarHBondContact O-CE 3.43Å; P302-W557 HydrophobicContact CB-CH2 4.13Å; P302-W557 HydrophobicContact CG-CH2 3.97Å; P302-W557 HydrophobicContact CG-CZ2 4Å; P302-Y561 HydrophobicContact CG-CE1 3.59Å; P302-Y561 WeakPolarHBondContact CG-OH 3.43Å; P302-L565 HydrophobicContact CB-CB 3.91Å; P302-L565 HydrophobicContact CB-CG 4.09Å; P302-L565 HydrophobicContact CG-CB 4.43Å; P302-L565 HydrophobicContact CG-CG 4.08Å
303	W	96.9	Very high	94.3	Very high	29 Å²	29	13.7 Å²	13.7	11%	0.11	8%	0.075	C	C	.	.	H	α-helix	trans	-60.3	-36.6	176.3	-72.3	-5.3	0	0	0	112.8	F265 L299 V300 F301 F306 I307 L565 F568 L572	F265-W303 HydrophobicContact CE2-CB 3.81Å; F265-W303 HydrophobicContact CE2-CD2 4.23Å; F265-W303 HydrophobicContact CE2-CE3 4.27Å; F265-W303 HydrophobicContact CE2-CG 4.07Å; F265-W303 HydrophobicContact CZ-CB 4.02Å; F265-W303 HydrophobicContact CZ-CD2 4.47Å; F265-W303 HydrophobicContact CZ-CG 4.08Å; L299-W303 HydrophobicContact CB-CD2 4.26Å; L299-W303 HydrophobicContact CB-CE3 4.29Å; L299-W303 HydrophobicContact CB-CH2 3.93Å; L299-W303 HydrophobicContact CB-CZ2 3.89Å; L299-W303 HydrophobicContact CB-CZ3 4.13Å; L299-W303 HydrophobicContact CD1-CH2 3.78Å; L299-W303 HydrophobicContact CD1-CZ2 4Å; L299-W303 HydrophobicContact CG-CH2 4.47Å; L299-W303 HydrophobicContact CG-CZ2 4.41Å; L299-W303 WeakPolarHBondContact O-CB 3.42Å; L299-W303 PolarHBondContact O-N 3.02Å; V300-W303 PolarHBondContact O-N 3.03Å; F301-W303 VanDerWaalsContact C-N 3.34Å; F301-W303 PolarHBondContact O-N 2.99Å; W303-F306 PolarHBondContact O-N 3.09Å; W303-I307 PolarHBondContact O-N 3.18Å; W303-L565 PolarHBondContact NE1-O 3.24Å; W303-F568 HydrophobicContact CZ2-CB 3.98Å; W303-L572 HydrophobicContact CD2-CD2 4.17Å; W303-L572 HydrophobicContact CE3-CD2 3.84Å; W303-L572 HydrophobicContact CH2-CD2 4.03Å; W303-L572 HydrophobicContact CZ2-CD2 4.34Å; W303-L572 HydrophobicContact CZ3-CD2 3.76Å
304	F	95.8	Very high	94.1	Very high	27 Å²	27	15.2 Å²	15.2	12%	0.118	8%	0.081	C	C	.	.	H	α-helix	trans	-67	-41.1	174.5	-164.3	-87.4	0	0	0	112	R266 M273 V300 F301 P302 I307 M308 L371	R266-F304 HydrophobicContact CG-CD2 3.98Å; R266-F304 HydrophobicContact CG-CE2 3.47Å; R266-F304 VanDerWaalsContact CG-CE2 3.47Å; R266-F304 HydrophobicContact CG-CZ 4.15Å; M273-F304 HydrophobicContact CE-CB 4.33Å; V300-F304 PolarHBondContact O-N 2.77Å; F301-F304 WeakPolarHBondContact O-CB 3.24Å; F301-F304 PolarHBondContact O-N 3.48Å; F301-F304 VanDerWaalsContact O-N 3.12Å; P302-F304 VanDerWaalsContact C-N 3.26Å; P302-F304 PolarHBondContact O-N 3.01Å; F304-I307 WeakPolarHBondContact O-CG2 3.4Å; F304-M308 VanDerWaalsContact O-CB 3.29Å; F304-M308 WeakPolarHBondContact O-CB 3.49Å; F304-M308 PolarHBondContact O-N 3.04Å; F304-L371 HydrophobicContact CD1-CD1 4.21Å; F304-L371 HydrophobicContact CD1-CD2 3.99Å; F304-L371 HydrophobicContact CE1-CD1 4.23Å; F304-L371 HydrophobicContact CE1-CD2 4.44Å
305	V	97.3	Very high	93.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.9	-43.2	174.5	177.2	0	0	0	0	111.1	F301 P302 M308 G309 L371 S498 M501 A502 W557	F301-V305 HydrophobicContact CD2-CG2 4.15Å; F301-V305 HydrophobicContact CE2-CG2 3.78Å; F301-V305 HydrophobicContact CZ-CG2 4.29Å; F301-V305 WeakPolarHBondContact O-CG2 3.4Å; F301-V305 PolarHBondContact O-N 3.09Å; P302-V305 WeakPolarHBondContact O-CB 3.34Å; P302-V305 PolarHBondContact O-N 2.97Å; P302-V305 VanDerWaalsContact O-N 3.13Å; V305-M308 HydrophobicContact CG1-CE 4.35Å; V305-M308 WeakPolarHBondContact O-CB 3.25Å; V305-M308 PolarHBondContact O-N 3.06Å; V305-G309 PolarHBondContact O-N 3.43Å; V305-L371 HydrophobicContact CB-CD2 4.49Å; V305-L371 HydrophobicContact CG2-CD2 3.61Å; V305-S498 WeakPolarHBondContact CG1-O 3.5Å; V305-M501 HydrophobicContact CB-CG 4.27Å; V305-M501 HydrophobicContact CG1-CB 4.13Å; V305-M501 HydrophobicContact CG1-CG 4.17Å; V305-A502 HydrophobicContact CG1-CB 3.67Å; V305-W557 HydrophobicContact CG2-CH2 4.1Å
306	F	98.3	Very high	93.7	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.2	-51.2	177.1	-180	-85.3	0	0	0	112.1	F265 P302 W303 M308 G309 T310 M501 L504 G505 A508 A569 F570 L573	F265-F306 HydrophobicContact CE1-CD1 4.4Å; P302-F306 PolarHBondContact O-N 3.29Å; W303-F306 PolarHBondContact O-N 3.09Å; F306-M308 PolarHBondContact O-N 3.24Å; F306-G309 WeakPolarHBondContact O-CA 3.41Å; F306-G309 PolarHBondContact O-N 3.41Å; F306-T310 PolarHBondContact O-N 3.31Å; F306-T310 PolarHBondContact O-OG1 3.11Å; F306-M501 HydrophobicContact CB-CE 3.75Å; F306-M501 HydrophobicContact CB-CG 4.41Å; F306-M501 HydrophobicContact CB-SD 4.2Å; F306-M501 HydrophobicContact CD2-CE 4.26Å; F306-M501 HydrophobicContact CD2-SD 4.17Å; F306-M501 HydrophobicContact CG-CE 4.36Å; F306-L504 HydrophobicContact CD2-CB 4.26Å; F306-L504 HydrophobicContact CE2-CB 4.11Å; F306-G505 VanDerWaalsContact CD2-CA 3.48Å; F306-G505 WeakPolarHBondContact O-CA 3.28Å; F306-A508 HydrophobicContact CE1-CB 4.07Å; F306-A508 HydrophobicContact CZ-CB 3.67Å; F306-A569 HydrophobicContact CB-CB 4.36Å; F306-A569 HydrophobicContact CD1-CB 3.78Å; F306-A569 HydrophobicContact CD2-CB 4.06Å; F306-A569 HydrophobicContact CE1-CB 4Å; F306-A569 HydrophobicContact CE2-CB 4.26Å; F306-A569 HydrophobicContact CG-CB 3.81Å; F306-A569 HydrophobicContact CZ-CB 4.23Å; F306-F570 HydrophobicContact CE2-CD2 4.08Å; F306-F570 HydrophobicContact CE2-CE1 4.33Å; F306-F570 AromaticContact CE2-CE2 3.67Å; F306-F570 HydrophobicContact CE2-CE2 3.67Å; F306-F570 AromaticContact CE2-CZ 3.81Å; F306-F570 HydrophobicContact CE2-CZ 3.81Å; F306-F570 AromaticContact CZ-CD1 3.97Å; F306-F570 HydrophobicContact CZ-CD1 3.97Å; F306-F570 HydrophobicContact CZ-CD2 4.12Å; F306-F570 AromaticContact CZ-CE1 3.81Å; F306-F570 HydrophobicContact CZ-CE1 3.81Å; F306-F570 AromaticContact CZ-CE2 3.92Å; F306-F570 HydrophobicContact CZ-CE2 3.92Å; F306-F570 HydrophobicContact CZ-CG 4.12Å; F306-F570 AromaticContact CZ-CZ 3.77Å; F306-F570 HydrophobicContact CZ-CZ 3.77Å; F306-L573 HydrophobicContact CE1-CD2 4.2Å
307	I	96.3	Very high	93.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-68.6	-27.3	-179	-158.1	61.7	0	0	0	112.1	L262 F265 R266 W303 F304 T310 S311 L573	L262-I307 HydrophobicContact CB-CD1 4.49Å; L262-I307 HydrophobicContact CD1-CD1 4.42Å; L262-I307 HydrophobicContact CD2-CG1 4.46Å; L262-I307 HydrophobicContact CG-CD1 3.83Å; L262-I307 HydrophobicContact CG-CG1 4Å; F265-I307 HydrophobicContact CB-CD1 4.22Å; F265-I307 HydrophobicContact CB-CG1 4.33Å; F265-I307 HydrophobicContact CD1-CD1 3.7Å; F265-I307 HydrophobicContact CD1-CG1 4.29Å; F265-I307 HydrophobicContact CE1-CD1 4.38Å; F265-I307 HydrophobicContact CG-CD1 4.19Å; F265-I307 HydrophobicContact CG-CG1 4.36Å; R266-I307 HydrophobicContact CB-CG1 4.34Å; R266-I307 HydrophobicContact CB-CG2 3.87Å; R266-I307 HydrophobicContact CG-CG2 3.95Å; W303-I307 PolarHBondContact O-N 3.18Å; F304-I307 WeakPolarHBondContact O-CG2 3.4Å; I307-T310 HydrophobicContact CD1-CG2 4.49Å; I307-T310 PolarHBondContact O-N 2.7Å; I307-S311 PolarHBondContact O-N 2.93Å; I307-S311 PolarHBondContact O-OG 3.08Å; I307-L573 HydrophobicContact CD1-CD1 4.44Å
308	M	95.1	Very high	93.1	Very high	19 Å²	19	14.8 Å²	14.8	9%	0.094	8%	0.084	C	C	.	.	H	α-helix	trans	-60.7	-47.7	167.7	176.8	-178.3	71.3	0	0	110.4	F304 V305 F306 T310 S311 I312 L371 Y375	F304-M308 VanDerWaalsContact O-CB 3.29Å; F304-M308 WeakPolarHBondContact O-CB 3.49Å; F304-M308 PolarHBondContact O-N 3.04Å; V305-M308 HydrophobicContact CG1-CE 4.35Å; V305-M308 WeakPolarHBondContact O-CB 3.25Å; V305-M308 PolarHBondContact O-N 3.06Å; F306-M308 PolarHBondContact O-N 3.24Å; M308-T310 PolarHBondContact O-N 3.42Å; M308-S311 WeakPolarHBondContact O-CA 3.2Å; M308-S311 VanDerWaalsContact O-CB 3.25Å; M308-S311 WeakPolarHBondContact O-CB 3.47Å; M308-S311 PolarHBondContact O-N 3.33Å; M308-I312 WeakPolarHBondContact O-CG1 3.45Å; M308-I312 PolarHBondContact O-N 3Å; M308-L371 HydrophobicContact CE-CD2 3.83Å; M308-L371 HydrophobicContact SD-CD2 3.96Å; M308-Y375 HydrophobicContact CG-CD2 4.16Å; M308-Y375 HydrophobicContact SD-CD2 4.12Å; M308-Y375 HydrophobicContact SD-CG 4.49Å
309	G	95.8	Very high	92.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-52.7	-48.5	171.9	0	0	0	0	0	113.7	V305 F306 S311 I312 A313 A502 G505 L506	V305-G309 PolarHBondContact O-N 3.43Å; F306-G309 WeakPolarHBondContact O-CA 3.41Å; F306-G309 PolarHBondContact O-N 3.41Å; G309-S311 PolarHBondContact O-N 3.16Å; G309-I312 WeakPolarHBondContact O-CB 3.29Å; G309-I312 PolarHBondContact O-N 3.36Å; G309-I312 VanDerWaalsContact O-N 3.11Å; G309-A313 PolarHBondContact O-N 2.98Å; G309-A502 VanDerWaalsContact CA-O 3.24Å; G309-A502 WeakPolarHBondContact CA-O 3.43Å; G309-G505 VanDerWaalsContact C-C 3.48Å; G309-L506 WeakPolarHBondContact O-CA 3.48Å
310	T	94.3	Very high	92.3	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.5	-36.8	176.3	-50.2	0	0	0	0	111.7	L262 F306 I307 M308 L314 G505 L512	L262-T310 HydrophobicContact CD1-CG2 3.78Å; F306-T310 PolarHBondContact O-N 3.31Å; F306-T310 PolarHBondContact O-OG1 3.11Å; I307-T310 HydrophobicContact CD1-CG2 4.49Å; I307-T310 PolarHBondContact O-N 2.7Å; M308-T310 PolarHBondContact O-N 3.42Å; T310-L314 WeakPolarHBondContact O-CG 3.33Å; T310-L314 PolarHBondContact O-N 3.03Å; T310-G505 WeakPolarHBondContact CA-O 3.47Å; T310-G505 WeakPolarHBondContact CB-O 3.25Å; T310-G505 VanDerWaalsContact N-C 3.26Å; T310-G505 PolarHBondContact N-O 3.04Å; T310-G505 VanDerWaalsContact N-O 3.09Å; T310-G505 PolarHBondContact OG1-O 3.46Å; T310-L512 HydrophobicContact CG2-CD1 3.88Å
311	S	92.8	Very high	91.8	Very high	21 Å²	21	23.5 Å²	23.5	15%	0.147	12%	0.119	C	C	.	.	H	α-helix	trans	-70.2	-35.9	178.5	-51.4	0	0	0	0	112.8	R266 I307 M308 G309 L314 S315	R266-S311 PolarHBondContact NH2-OG 3.08Å; I307-S311 PolarHBondContact O-N 2.93Å; I307-S311 PolarHBondContact O-OG 3.08Å; M308-S311 WeakPolarHBondContact O-CA 3.2Å; M308-S311 VanDerWaalsContact O-CB 3.25Å; M308-S311 WeakPolarHBondContact O-CB 3.47Å; M308-S311 PolarHBondContact O-N 3.33Å; G309-S311 PolarHBondContact O-N 3.16Å; S311-L314 PolarHBondContact O-N 3.27Å; S311-S315 VanDerWaalsContact O-CB 3.29Å; S311-S315 WeakPolarHBondContact O-CB 3.37Å; S311-S315 PolarHBondContact O-N 3.39Å; S311-S315 PolarHBondContact O-OG 3.02Å
312	I	92.6	Very high	91.2	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-57.2	-52.9	175.4	-68.3	169.6	0	0	0	109.1	M308 G309 L314 S315 I316 Y375 V378 A379 L506	M308-I312 WeakPolarHBondContact O-CG1 3.45Å; M308-I312 PolarHBondContact O-N 3Å; G309-I312 WeakPolarHBondContact O-CB 3.29Å; G309-I312 PolarHBondContact O-N 3.36Å; G309-I312 VanDerWaalsContact O-N 3.11Å; I312-L314 VanDerWaalsContact C-N 3.34Å; I312-L314 PolarHBondContact O-N 3.19Å; I312-S315 PolarHBondContact O-N 3.29Å; I312-S315 PolarHBondContact O-OG 3.01Å; I312-I316 HydrophobicContact CG2-CD1 3.47Å; I312-I316 VanDerWaalsContact CG2-CD1 3.47Å; I312-I316 HydrophobicContact CG2-CG1 4.29Å; I312-I316 WeakPolarHBondContact O-CB 3.37Å; I312-I316 PolarHBondContact O-N 3.09Å; I312-Y375 HydrophobicContact CD1-CD2 3.6Å; I312-Y375 HydrophobicContact CD1-CE2 4.01Å; I312-Y375 HydrophobicContact CD1-CG 4.36Å; I312-Y375 HydrophobicContact CG1-CD2 3.74Å; I312-Y375 HydrophobicContact CG1-CE2 3.63Å; I312-V378 HydrophobicContact CD1-CB 4.29Å; I312-V378 HydrophobicContact CD1-CG1 4.1Å; I312-A379 HydrophobicContact CD1-CB 4.32Å; I312-A379 HydrophobicContact CG2-CB 3.87Å; I312-L506 HydrophobicContact CB-CD1 4.08Å; I312-L506 HydrophobicContact CG2-CD1 3.65Å
313	A	90.4	Very high	90.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.2	-47.2	-179	0	0	0	0	0	112.9	G309 N317 L506 K510 L513	G309-A313 PolarHBondContact O-N 2.98Å; A313-N317 VanDerWaalsContact O-CB 3.23Å; A313-N317 WeakPolarHBondContact O-CB 3.07Å; A313-N317 PolarHBondContact O-N 2.88Å; A313-L506 HydrophobicContact CB-CD1 4.15Å; A313-L506 HydrophobicContact CB-CG 4.11Å; A313-K510 HydrophobicContact CB-CD 4.04Å; A313-K510 HydrophobicContact CB-CG 4.4Å; A313-L513 WeakPolarHBondContact O-CD1 3.4Å
314	L	88.6	Confident	90.2	Very high	40 Å²	40	29.8 Å²	29.8	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-43.2	-179.8	-63.6	173	0	0	0	112.3	L259 L262 T310 S311 I312 S318 L513	L259-L314 HydrophobicContact CD1-CD1 4.12Å; L262-L314 HydrophobicContact CD1-CD1 3.5Å; T310-L314 WeakPolarHBondContact O-CG 3.33Å; T310-L314 PolarHBondContact O-N 3.03Å; S311-L314 PolarHBondContact O-N 3.27Å; I312-L314 VanDerWaalsContact C-N 3.34Å; I312-L314 PolarHBondContact O-N 3.19Å; L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.42Å; L314-S318 VanDerWaalsContact O-N 3.09Å; L314-L513 HydrophobicContact CD2-CD1 4.26Å; L314-L513 HydrophobicContact CD2-CD2 3.56Å; L314-L513 HydrophobicContact CD2-CG 3.63Å
315	S	88.6	Confident	89.9	Confident	46 Å²	46	31.9 Å²	31.9	32%	0.322	21%	0.21	S	C	.	.	H	α-helix	trans	-71.4	-45	-175.8	66.1	0	0	0	0	112.5	S311 I312 S318 M319	S311-S315 VanDerWaalsContact O-CB 3.29Å; S311-S315 WeakPolarHBondContact O-CB 3.37Å; S311-S315 PolarHBondContact O-N 3.39Å; S311-S315 PolarHBondContact O-OG 3.02Å; I312-S315 PolarHBondContact O-N 3.29Å; I312-S315 PolarHBondContact O-OG 3.01Å; S315-S318 PolarHBondContact O-N 2.8Å; S315-M319 WeakPolarHBondContact O-CG 3.49Å; S315-M319 PolarHBondContact O-N 2.96Å
316	I	88.1	Confident	89.5	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-47.3	178.5	-70.9	174.8	0	0	0	110.3	I312 S318 M319 L320 A379 D382 L383	I312-I316 HydrophobicContact CG2-CD1 3.47Å; I312-I316 VanDerWaalsContact CG2-CD1 3.47Å; I312-I316 HydrophobicContact CG2-CG1 4.29Å; I312-I316 WeakPolarHBondContact O-CB 3.37Å; I312-I316 PolarHBondContact O-N 3.09Å; I316-S318 VanDerWaalsContact C-N 3.31Å; I316-S318 PolarHBondContact O-N 3.03Å; I316-M319 HydrophobicContact CG1-CE 4.41Å; I316-M319 PolarHBondContact O-N 3.08Å; I316-M319 VanDerWaalsContact O-N 3.13Å; I316-L320 HydrophobicContact CG2-CD1 3.69Å; I316-L320 HydrophobicContact CG2-CG 4.16Å; I316-L320 WeakPolarHBondContact O-CG 3.37Å; I316-L320 PolarHBondContact O-N 3.08Å; I316-A379 HydrophobicContact CD1-CB 4.08Å; I316-D382 HydrophobicContact CD1-CB 4.08Å; I316-L383 HydrophobicContact CD1-CD2 4.3Å; I316-L383 HydrophobicContact CD1-CG 4.06Å; I316-L383 HydrophobicContact CG1-CD2 4.39Å; I316-L383 HydrophobicContact CG2-CD2 3.64Å; I316-L383 HydrophobicContact CG2-CG 4.39Å
317	N	85.4	Confident	89.1	Confident	23 Å²	23	41.6 Å²	41.6	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-44.1	178.2	-174.8	-76.4	0	0	0	111.4	A313 M319 L320 R321 L513	A313-N317 VanDerWaalsContact O-CB 3.23Å; A313-N317 WeakPolarHBondContact O-CB 3.07Å; A313-N317 PolarHBondContact O-N 2.88Å; N317-M319 VanDerWaalsContact C-N 3.34Å; N317-M319 PolarHBondContact O-N 3.48Å; N317-L320 PolarHBondContact O-N 3.21Å; N317-R321 WeakPolarHBondContact O-CB 3.33Å; N317-R321 WeakPolarHBondContact O-CG 3.48Å; N317-R321 PolarHBondContact O-N 3.31Å; N317-R321 WeakPolarHBondContact OD1-CD 3.18Å; N317-R321 PolarHBondContact OD1-NE 2.91Å; N317-L513 HydrophobicContact CB-CD1 3.7Å
318	S	85	Confident	88.9	Confident	55 Å²	55	44.9 Å²	44.9	39%	0.385	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-37.4	176.6	-176.4	0	0	0	0	113.1	L314 S315 I316 G322	L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.42Å; L314-S318 VanDerWaalsContact O-N 3.09Å; S315-S318 PolarHBondContact O-N 2.8Å; I316-S318 VanDerWaalsContact C-N 3.31Å; I316-S318 PolarHBondContact O-N 3.03Å; S318-G322 PolarHBondContact O-N 3.23Å
319	M	87.2	Confident	88.7	Confident	53 Å²	53	44.4 Å²	44.4	26%	0.261	28%	0.279	S	S	.	.	H	α-helix	trans	-75.9	-38.3	179.7	-69.9	-175.8	-64.3	0	0	112.2	S315 I316 N317 G322 G323 A324 L329	S315-M319 WeakPolarHBondContact O-CG 3.49Å; S315-M319 PolarHBondContact O-N 2.96Å; I316-M319 HydrophobicContact CG1-CE 4.41Å; I316-M319 PolarHBondContact O-N 3.08Å; I316-M319 VanDerWaalsContact O-N 3.13Å; N317-M319 VanDerWaalsContact C-N 3.34Å; N317-M319 PolarHBondContact O-N 3.48Å; M319-G322 CarbonylContact O-C 3.55Å; M319-G322 WeakPolarHBondContact O-CA 3.47Å; M319-G322 PolarHBondContact O-N 3.02Å; M319-G322 VanDerWaalsContact O-N 3.15Å; M319-G323 PolarHBondContact O-N 3.17Å; M319-A324 HydrophobicContact CB-CB 4.28Å; M319-A324 VanDerWaalsContact O-CB 3.27Å; M319-A324 WeakPolarHBondContact O-CB 3.24Å; M319-A324 PolarHBondContact O-N 3.23Å; M319-A324 VanDerWaalsContact O-N 3.11Å; M319-L329 HydrophobicContact CB-CD1 4.06Å; M319-L329 HydrophobicContact CB-CD2 3.87Å; M319-L329 HydrophobicContact CE-CD2 3.68Å; M319-L329 HydrophobicContact CG-CD2 4.31Å; M319-L329 HydrophobicContact SD-CD2 3.57Å; M319-L329 VanDerWaalsContact SD-CD2 3.57Å
320	L	85.4	Confident	88.6	Confident	26 Å²	26	47.6 Å²	47.6	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-42.2	175.1	-70.7	173.9	0	0	0	111.5	I316 N317 G322 G323 R326 L329 A386	I316-L320 HydrophobicContact CG2-CD1 3.69Å; I316-L320 HydrophobicContact CG2-CG 4.16Å; I316-L320 WeakPolarHBondContact O-CG 3.37Å; I316-L320 PolarHBondContact O-N 3.08Å; N317-L320 PolarHBondContact O-N 3.21Å; L320-G322 PolarHBondContact O-N 3.36Å; L320-G323 PolarHBondContact O-N 3.35Å; L320-R326 HydrophobicContact CD2-CG 4.14Å; L320-L329 HydrophobicContact CD2-CD1 3.68Å; L320-L329 HydrophobicContact CG-CD1 3.97Å; L320-A386 HydrophobicContact CD1-CB 3.59Å
321	R	83.3	Confident	88.7	Confident	140 Å²	140	54.6 Å²	54.6	53%	0.528	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-28.9	171.9	-76	-178.1	167.3	-176	-5.4	112.8	N317 G323 D391	N317-R321 WeakPolarHBondContact O-CB 3.33Å; N317-R321 WeakPolarHBondContact O-CG 3.48Å; N317-R321 PolarHBondContact O-N 3.31Å; N317-R321 WeakPolarHBondContact OD1-CD 3.18Å; N317-R321 PolarHBondContact OD1-NE 2.91Å; R321-G323 PolarHBondContact O-N 2.87Å; R321-D391 IonicContact NH2-OD1 3.73Å; R321-D391 PolarHBondContact NH2-OD1 3.27Å
322	G	82.3	Confident	88.6	Confident	67 Å²	67	59.4 Å²	59.4	69%	0.691	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	5.8	172.4	0	0	0	0	0	114.7	S318 M319 L320	S318-G322 PolarHBondContact O-N 3.23Å; M319-G322 CarbonylContact O-C 3.55Å; M319-G322 WeakPolarHBondContact O-CA 3.47Å; M319-G322 PolarHBondContact O-N 3.02Å; M319-G322 VanDerWaalsContact O-N 3.15Å; L320-G322 PolarHBondContact O-N 3.36Å
323	G	84.8	Confident	88.7	Confident	69 Å²	69	59.6 Å²	59.6	71%	0.711	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	10.4	177.5	0	0	0	0	0	115.2	M319 L320 R321	M319-G323 PolarHBondContact O-N 3.17Å; L320-G323 PolarHBondContact O-N 3.35Å; R321-G323 PolarHBondContact O-N 2.87Å
324	A	86.5	Confident	89	Confident	35 Å²	35	63.8 Å²	63.8	29%	0.289	37%	0.367	S	S	.	.			trans	-67.5	136.6	178.1	0	0	0	0	0	111.6	M319 L329	M319-A324 HydrophobicContact CB-CB 4.28Å; M319-A324 VanDerWaalsContact O-CB 3.27Å; M319-A324 WeakPolarHBondContact O-CB 3.24Å; M319-A324 PolarHBondContact O-N 3.23Å; M319-A324 VanDerWaalsContact O-N 3.11Å; A324-L329 HydrophobicContact CB-CD1 4.16Å; A324-L329 HydrophobicContact CB-CD2 3.91Å; A324-L329 HydrophobicContact CB-CG 4.02Å
325	S	89.6	Confident	89.3	Confident	72 Å²	72	69.7 Å²	69.7	50%	0.503	39%	0.387	S	S	.	.			trans	-72.8	143.8	177.4	73.4	0	0	0	0	111.6	S327 S328 L329	S325-S327 VanDerWaalsContact C-N 3.27Å; S325-S327 PolarHBondContact O-N 3.03Å; S325-S328 PolarHBondContact O-N 2.68Å; S325-S328 VanDerWaalsContact O-N 3.16Å; S325-S328 VanDerWaalsContact OG-CB 3.25Å; S325-S328 WeakPolarHBondContact OG-CB 3.29Å; S325-S328 PolarHBondContact OG-N 3.39Å; S325-L329 WeakPolarHBondContact O-CG 2.96Å; S325-L329 PolarHBondContact O-N 2.74Å; S325-L329 VanDerWaalsContact O-N 3.08Å
326	R	89.1	Confident	89.6	Confident	131 Å²	131	71.8 Å²	71.8	49%	0.494	39%	0.387	S	S	.	.	H	α-helix	trans	-56.9	-39.4	179.3	-67.8	-175.1	176.9	102.8	-3.3	112.7	L320 L329 L330 A386	L320-R326 HydrophobicContact CD2-CG 4.14Å; R326-L329 PolarHBondContact O-N 2.85Å; R326-L330 WeakPolarHBondContact O-CB 3.43Å; R326-L330 PolarHBondContact O-N 3.39Å; R326-A386 PolarHBondContact NH2-O 3.12Å
327	S	89.9	Confident	90	Very high	73 Å²	73	72 Å²	72	51%	0.51	39%	0.39	S	S	.	.	H	α-helix	trans	-65.8	-41.6	178.2	-177.4	0	0	0	0	112.4	S325 L329 L330 K331	S325-S327 VanDerWaalsContact C-N 3.27Å; S325-S327 PolarHBondContact O-N 3.03Å; S327-L329 VanDerWaalsContact C-N 3.32Å; S327-L329 PolarHBondContact O-N 2.86Å; S327-L330 PolarHBondContact O-N 2.96Å; S327-K331 WeakPolarHBondContact O-CG 3.1Å; S327-K331 PolarHBondContact O-N 3.43Å
328	S	92.4	Very high	90.5	Very high	69 Å²	69	73 Å²	73	48%	0.483	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-42.2	175.5	178.8	0	0	0	0	111.3	S325 K331 K332	S325-S328 PolarHBondContact O-N 2.68Å; S325-S328 VanDerWaalsContact O-N 3.16Å; S325-S328 VanDerWaalsContact OG-CB 3.25Å; S325-S328 WeakPolarHBondContact OG-CB 3.29Å; S325-S328 PolarHBondContact OG-N 3.39Å; S328-K331 PolarHBondContact O-N 3.03Å; S328-K332 PolarHBondContact O-N 3.25Å; S328-K332 VanDerWaalsContact O-N 3.12Å
329	L	91.3	Very high	90.9	Very high	8 Å²	8	73.2 Å²	73.2	4%	0.042	40%	0.395	C	S	.	.	H	α-helix	trans	-65.6	-41.4	176.3	-64.3	-177.2	0	0	0	112.6	M319 L320 A324 S325 R326 S327 K332 V333 L383	M319-L329 HydrophobicContact CB-CD1 4.06Å; M319-L329 HydrophobicContact CB-CD2 3.87Å; M319-L329 HydrophobicContact CE-CD2 3.68Å; M319-L329 HydrophobicContact CG-CD2 4.31Å; M319-L329 HydrophobicContact SD-CD2 3.57Å; M319-L329 VanDerWaalsContact SD-CD2 3.57Å; L320-L329 HydrophobicContact CD2-CD1 3.68Å; L320-L329 HydrophobicContact CG-CD1 3.97Å; A324-L329 HydrophobicContact CB-CD1 4.16Å; A324-L329 HydrophobicContact CB-CD2 3.91Å; A324-L329 HydrophobicContact CB-CG 4.02Å; S325-L329 WeakPolarHBondContact O-CG 2.96Å; S325-L329 PolarHBondContact O-N 2.74Å; S325-L329 VanDerWaalsContact O-N 3.08Å; R326-L329 PolarHBondContact O-N 2.85Å; S327-L329 VanDerWaalsContact C-N 3.32Å; S327-L329 PolarHBondContact O-N 2.86Å; L329-K332 WeakPolarHBondContact O-CB 3.38Å; L329-K332 PolarHBondContact O-N 3.06Å; L329-V333 WeakPolarHBondContact O-CG2 3.49Å; L329-V333 PolarHBondContact O-N 2.99Å; L329-L383 HydrophobicContact CB-CD1 3.99Å; L329-L383 HydrophobicContact CB-CD2 3.74Å; L329-L383 HydrophobicContact CD1-CD2 3.74Å; L329-L383 HydrophobicContact CG-CD2 4.41Å
330	L	94.3	Very high	91.2	Very high	68 Å²	68	71.7 Å²	71.7	36%	0.356	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-45.1	177.3	-176.1	64.3	0	0	0	111.5	R326 S327 K332 V333 I334 L383	R326-L330 WeakPolarHBondContact O-CB 3.43Å; R326-L330 PolarHBondContact O-N 3.39Å; S327-L330 PolarHBondContact O-N 2.96Å; L330-K332 VanDerWaalsContact C-N 3.27Å; L330-K332 PolarHBondContact O-N 3.29Å; L330-V333 PolarHBondContact O-N 3.47Å; L330-V333 VanDerWaalsContact O-N 3.15Å; L330-I334 HydrophobicContact CD1-CD1 4.42Å; L330-I334 HydrophobicContact CG-CD1 4.03Å; L330-I334 WeakPolarHBondContact O-CG1 3.27Å; L330-I334 PolarHBondContact O-N 2.99Å; L330-L383 HydrophobicContact CB-CD1 4.2Å; L330-L383 HydrophobicContact CD1-CD1 4.37Å
331	K	94.5	Very high	91.7	Very high	146 Å²	146	74.4 Å²	74.4	64%	0.635	40%	0.399	S	S	*	.	H	α-helix	trans	-57.4	-41.8	174.4	-70.6	179	-174.7	-176	0	111.6	S327 S328 I334 W335	S327-K331 WeakPolarHBondContact O-CG 3.1Å; S327-K331 PolarHBondContact O-N 3.43Å; S328-K331 PolarHBondContact O-N 3.03Å; K331-I334 PolarHBondContact O-N 3.44Å; K331-W335 WeakPolarHBondContact O-CB 3.37Å; K331-W335 PolarHBondContact O-N 3.1Å
332	K	92.4	Very high	92.2	Very high	122 Å²	122	72.4 Å²	72.4	53%	0.53	40%	0.399	S	S	.	.	H	α-helix	trans	-65.2	-40.4	176.6	-171.3	174.6	-175.3	173.7	0	112.4	S328 L329 L330 R336	S328-K332 PolarHBondContact O-N 3.25Å; S328-K332 VanDerWaalsContact O-N 3.12Å; L329-K332 WeakPolarHBondContact O-CB 3.38Å; L329-K332 PolarHBondContact O-N 3.06Å; L330-K332 VanDerWaalsContact C-N 3.27Å; L330-K332 PolarHBondContact O-N 3.29Å; K332-R336 VanDerWaalsContact O-CB 3.29Å; K332-R336 WeakPolarHBondContact O-CB 3.37Å; K332-R336 PolarHBondContact O-N 2.85Å
333	V	94.8	Very high	92.6	Very high	6 Å²	6	71.5 Å²	71.5	4%	0.036	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-47.7	175.5	167.7	0	0	0	0	110.6	L329 L330 R336 S337 Y375 L376 A379 L383	L329-V333 WeakPolarHBondContact O-CG2 3.49Å; L329-V333 PolarHBondContact O-N 2.99Å; L330-V333 PolarHBondContact O-N 3.47Å; L330-V333 VanDerWaalsContact O-N 3.15Å; V333-R336 PolarHBondContact O-N 2.86Å; V333-S337 WeakPolarHBondContact O-CB 3.39Å; V333-S337 PolarHBondContact O-N 2.93Å; V333-S337 PolarHBondContact O-OG 3.44Å; V333-Y375 HydrophobicContact CB-CE1 4.35Å; V333-Y375 HydrophobicContact CG1-CD1 4.29Å; V333-Y375 HydrophobicContact CG1-CE1 3.88Å; V333-Y375 HydrophobicContact CG2-CE1 4.33Å; V333-L376 HydrophobicContact CG1-CD1 3.93Å; V333-A379 HydrophobicContact CG1-CB 3.73Å; V333-A379 HydrophobicContact CG2-CB 3.91Å; V333-L383 HydrophobicContact CG2-CD1 4.1Å
334	I	96.1	Very high	92.9	Very high	88 Å²	88	68.3 Å²	68.3	45%	0.451	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-50.1	178.1	-67.9	166.3	0	0	0	110.5	L330 K331 R336 S337 A338 L376	L330-I334 HydrophobicContact CD1-CD1 4.42Å; L330-I334 HydrophobicContact CG-CD1 4.03Å; L330-I334 WeakPolarHBondContact O-CG1 3.27Å; L330-I334 PolarHBondContact O-N 2.99Å; K331-I334 PolarHBondContact O-N 3.44Å; I334-R336 PolarHBondContact O-N 3.28Å; I334-S337 PolarHBondContact O-N 2.98Å; I334-A338 PolarHBondContact O-N 3.38Å; I334-L376 HydrophobicContact CG1-CD1 3.91Å
335	W	95.3	Very high	93	Very high	164 Å²	164	68.1 Å²	68.1	62%	0.621	34%	0.339	S	S	*	.	H	α-helix	trans	-60	-46.6	-179.4	-177.9	-103.5	0	0	0	112.5	K331 S337 A338 Q339	K331-W335 WeakPolarHBondContact O-CB 3.37Å; K331-W335 PolarHBondContact O-N 3.1Å; W335-S337 VanDerWaalsContact C-N 3.3Å; W335-S337 PolarHBondContact O-N 3.44Å; W335-A338 PolarHBondContact O-N 3.32Å; W335-Q339 VanDerWaalsContact CD1-OE1 3.22Å; W335-Q339 HydrophobicContact CZ2-CG 4.37Å; W335-Q339 VanDerWaalsContact NE1-OE1 3.14Å; W335-Q339 WeakPolarHBondContact O-CG 3.5Å; W335-Q339 PolarHBondContact O-N 3.43Å
336	R	93.6	Very high	92.9	Very high	90 Å²	90	72 Å²	72	34%	0.34	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-39.7	176.7	176.6	177	168.5	129	-1.8	112.1	K332 V333 I334 L340 Y375 I654	K332-R336 VanDerWaalsContact O-CB 3.29Å; K332-R336 WeakPolarHBondContact O-CB 3.37Å; K332-R336 PolarHBondContact O-N 2.85Å; V333-R336 PolarHBondContact O-N 2.86Å; I334-R336 PolarHBondContact O-N 3.28Å; R336-L340 WeakPolarHBondContact O-CB 2.96Å; R336-L340 PolarHBondContact O-N 3.47Å; R336-Y375 HydrophobicContact CB-CE1 4.47Å; R336-Y375 HydrophobicContact CG-CE1 4.25Å; R336-I654 HydrophobicContact CB-CG2 4.45Å; R336-I654 VanDerWaalsContact CD-O 3.24Å; R336-I654 WeakPolarHBondContact CD-O 3.26Å; R336-I654 HydrophobicContact CG-CB 4.35Å; R336-I654 HydrophobicContact CG-CG2 3.96Å; R336-I654 VanDerWaalsContact CZ-O 3.3Å; R336-I654 PolarHBondContact NH1-O 3.44Å
337	S	96.1	Very high	92.8	Very high	8 Å²	8	67.1 Å²	67.1	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-41.6	178	-51.5	0	0	0	0	110.9	V333 I334 W335 L340 F341 A372 Y375	V333-S337 WeakPolarHBondContact O-CB 3.39Å; V333-S337 PolarHBondContact O-N 2.93Å; V333-S337 PolarHBondContact O-OG 3.44Å; I334-S337 PolarHBondContact O-N 2.98Å; W335-S337 VanDerWaalsContact C-N 3.3Å; W335-S337 PolarHBondContact O-N 3.44Å; S337-L340 PolarHBondContact O-N 3.49Å; S337-F341 WeakPolarHBondContact O-CB 3.44Å; S337-F341 PolarHBondContact O-N 2.87Å; S337-A372 WeakPolarHBondContact O-CB 3.48Å; S337-Y375 WeakPolarHBondContact OG-CD1 3.36Å
338	A	96.3	Very high	92.6	Very high	42 Å²	42	65.7 Å²	65.7	35%	0.347	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175.9	0	0	0	0	0	111.9	I334 W335 L340 F341 L342	I334-A338 PolarHBondContact O-N 3.38Å; W335-A338 PolarHBondContact O-N 3.32Å; A338-L340 VanDerWaalsContact C-N 3.34Å; A338-L340 PolarHBondContact O-N 3.37Å; A338-F341 PolarHBondContact O-N 3.45Å; A338-L342 WeakPolarHBondContact O-CB 3.28Å; A338-L342 VanDerWaalsContact O-CG 3.29Å; A338-L342 WeakPolarHBondContact O-CG 3.31Å; A338-L342 PolarHBondContact O-N 2.95Å
339	Q	94.8	Very high	92.1	Very high	60 Å²	60	63 Å²	63	28%	0.28	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-43.4	176.2	-71.6	178.7	-57.8	0	0	112.1	W335 L342 I343 I654	W335-Q339 VanDerWaalsContact CD1-OE1 3.22Å; W335-Q339 HydrophobicContact CZ2-CG 4.37Å; W335-Q339 VanDerWaalsContact NE1-OE1 3.14Å; W335-Q339 WeakPolarHBondContact O-CG 3.5Å; W335-Q339 PolarHBondContact O-N 3.43Å; Q339-L342 PolarHBondContact O-N 3.33Å; Q339-I343 WeakPolarHBondContact O-CB 3.36Å; Q339-I343 WeakPolarHBondContact O-CD1 3.25Å; Q339-I343 VanDerWaalsContact O-CG1 3.24Å; Q339-I343 WeakPolarHBondContact O-CG1 3.25Å; Q339-I343 PolarHBondContact O-N 3.04Å; Q339-I654 HydrophobicContact CB-CG2 3.5Å; Q339-I654 VanDerWaalsContact CB-CG2 3.5Å; Q339-I654 HydrophobicContact CG-CG2 4.22Å
340	L	93.5	Very high	90.9	Very high	22 Å²	22	66.5 Å²	66.5	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-65	-40.6	178.4	-171.2	65.1	0	0	0	111.9	R336 S337 A338 G344 L368 L371 A372 I599	R336-L340 WeakPolarHBondContact O-CB 2.96Å; R336-L340 PolarHBondContact O-N 3.47Å; S337-L340 PolarHBondContact O-N 3.49Å; A338-L340 VanDerWaalsContact C-N 3.34Å; A338-L340 PolarHBondContact O-N 3.37Å; L340-G344 PolarHBondContact O-N 2.94Å; L340-L368 HydrophobicContact CD1-CD2 3.73Å; L340-L368 HydrophobicContact CG-CD2 4.45Å; L340-L371 HydrophobicContact CD2-CB 3.92Å; L340-A372 HydrophobicContact CB-CB 4.04Å; L340-A372 HydrophobicContact CD2-CB 4.09Å; L340-A372 HydrophobicContact CG-CB 4.17Å; L340-I599 HydrophobicContact CD1-CD1 3.68Å
341	F	94.9	Very high	89.1	Confident	83 Å²	83	66.4 Å²	66.4	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-48.3	175.4	-173.8	-85.6	0	0	0	111.7	S337 A338 G344 V345 I364 Q369 A372	S337-F341 WeakPolarHBondContact O-CB 3.44Å; S337-F341 PolarHBondContact O-N 2.87Å; A338-F341 PolarHBondContact O-N 3.45Å; F341-G344 WeakPolarHBondContact O-CA 3.17Å; F341-G344 PolarHBondContact O-N 2.8Å; F341-G344 VanDerWaalsContact O-N 3.14Å; F341-V345 HydrophobicContact CD1-CG2 4.07Å; F341-V345 HydrophobicContact CE1-CG2 3.7Å; F341-V345 HydrophobicContact CZ-CG2 4.25Å; F341-V345 PolarHBondContact O-N 2.96Å; F341-I364 HydrophobicContact CZ-CG2 4.41Å; F341-Q369 HydrophobicContact CD2-CB 3.74Å; F341-Q369 HydrophobicContact CD2-CG 3.69Å; F341-Q369 HydrophobicContact CE2-CB 3.73Å; F341-Q369 HydrophobicContact CE2-CG 3.62Å; F341-Q369 HydrophobicContact CG-CG 4.29Å; F341-Q369 HydrophobicContact CZ-CG 4.16Å; F341-A372 HydrophobicContact CB-CB 4.06Å
342	L	92.9	Very high	87.2	Confident	98 Å²	98	65.7 Å²	65.7	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-48.2	179.4	-70.7	173.3	0	0	0	111.6	A338 Q339 G344 V345 F346	A338-L342 WeakPolarHBondContact O-CB 3.28Å; A338-L342 VanDerWaalsContact O-CG 3.29Å; A338-L342 WeakPolarHBondContact O-CG 3.31Å; A338-L342 PolarHBondContact O-N 2.95Å; Q339-L342 PolarHBondContact O-N 3.33Å; L342-G344 PolarHBondContact O-N 2.83Å; L342-V345 PolarHBondContact O-N 2.97Å; L342-F346 WeakPolarHBondContact O-CD2 3.41Å; L342-F346 PolarHBondContact O-N 2.73Å; L342-F346 VanDerWaalsContact O-N 3.11Å
343	I	91.5	Very high	85.1	Confident	48 Å²	48	64.2 Å²	64.2	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-57.1	-40.5	175.4	-69.4	166.6	0	0	0	110.6	Q339 F346 I347 L368 V603 I654	Q339-I343 WeakPolarHBondContact O-CB 3.36Å; Q339-I343 WeakPolarHBondContact O-CD1 3.25Å; Q339-I343 VanDerWaalsContact O-CG1 3.24Å; Q339-I343 WeakPolarHBondContact O-CG1 3.25Å; Q339-I343 PolarHBondContact O-N 3.04Å; I343-F346 PolarHBondContact O-N 2.98Å; I343-I347 HydrophobicContact CG2-CD1 3.56Å; I343-I347 HydrophobicContact CG2-CG1 4.41Å; I343-I347 VanDerWaalsContact O-CG1 3.31Å; I343-I347 WeakPolarHBondContact O-CG1 3.36Å; I343-I347 PolarHBondContact O-N 3.22Å; I343-I347 VanDerWaalsContact O-N 3.08Å; I343-L368 HydrophobicContact CG2-CD1 4.12Å; I343-V603 HydrophobicContact CG2-CG2 3.7Å; I343-I654 HydrophobicContact CD1-CD1 3.51Å
344	G	91.1	Very high	83.1	Confident	2 Å²	2	71.3 Å²	71.3	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-59	-47	175.3	0	0	0	0	0	114.1	L340 F341 L342 F346 I347 I348 Q369	L340-G344 PolarHBondContact O-N 2.94Å; F341-G344 WeakPolarHBondContact O-CA 3.17Å; F341-G344 PolarHBondContact O-N 2.8Å; F341-G344 VanDerWaalsContact O-N 3.14Å; L342-G344 PolarHBondContact O-N 2.83Å; G344-F346 VanDerWaalsContact C-N 3.3Å; G344-F346 PolarHBondContact O-N 3.4Å; G344-I347 PolarHBondContact O-N 3.23Å; G344-I348 WeakPolarHBondContact O-CG2 3.24Å; G344-I348 PolarHBondContact O-N 3.19Å; G344-I348 VanDerWaalsContact O-N 3.09Å; G344-Q369 PolarHBondContact O-NE2 3.5Å
345	V	89.6	Confident	81.1	Confident	30 Å²	30	69.2 Å²	69.2	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-38.3	179.4	172.7	0	0	0	0	111.3	F341 L342 N349 L362 Q369	F341-V345 HydrophobicContact CD1-CG2 4.07Å; F341-V345 HydrophobicContact CE1-CG2 3.7Å; F341-V345 HydrophobicContact CZ-CG2 4.25Å; F341-V345 PolarHBondContact O-N 2.96Å; L342-V345 PolarHBondContact O-N 2.97Å; V345-N349 PolarHBondContact O-ND2 3.27Å; V345-L362 HydrophobicContact CG1-CD1 4.46Å; V345-L362 HydrophobicContact CG1-CD2 4.07Å; V345-Q369 HydrophobicContact CG2-CG 4.32Å
346	F	87.5	Confident	79.2	Confident	154 Å²	154	67.4 Å²	67.4	68%	0.675	37%	0.365	S	S	*	.	H	α-helix	trans	-67.8	-39.6	177.2	-76.4	-65.7	0	0	0	113.1	L342 I343 G344	L342-F346 WeakPolarHBondContact O-CD2 3.41Å; L342-F346 PolarHBondContact O-N 2.73Å; L342-F346 VanDerWaalsContact O-N 3.11Å; I343-F346 PolarHBondContact O-N 2.98Å; G344-F346 VanDerWaalsContact C-N 3.3Å; G344-F346 PolarHBondContact O-N 3.4Å
347	I	86.3	Confident	77.6	Confident	28 Å²	28	67.2 Å²	67.2	14%	0.144	37%	0.37	C	S	.	.	H	α-helix	trans	-74.4	-41.6	-176.4	-69.2	167.8	0	0	0	111.7	I343 G344 N349 L368 V603 E606 V607	I343-I347 HydrophobicContact CG2-CD1 3.56Å; I343-I347 HydrophobicContact CG2-CG1 4.41Å; I343-I347 VanDerWaalsContact O-CG1 3.31Å; I343-I347 WeakPolarHBondContact O-CG1 3.36Å; I343-I347 PolarHBondContact O-N 3.22Å; I343-I347 VanDerWaalsContact O-N 3.08Å; G344-I347 PolarHBondContact O-N 3.23Å; I347-N349 PolarHBondContact O-N 3.38Å; I347-L368 HydrophobicContact CD1-CD1 3.88Å; I347-V603 HydrophobicContact CD1-CB 3.99Å; I347-V603 HydrophobicContact CD1-CG1 3.73Å; I347-V603 HydrophobicContact CD1-CG2 3.66Å; I347-E606 HydrophobicContact CG2-CB 3.54Å; I347-E606 HydrophobicContact CG2-CG 3.85Å; I347-V607 HydrophobicContact CG1-CG2 4.48Å
348	I	84.6	Confident	76.2	Confident	43 Å²	43	69 Å²	69	22%	0.221	38%	0.382	C	S	.	.	H	α-helix	trans	-73.5	-16.3	-173.3	-159.9	169.5	0	0	0	113.9	G344 P350 R363 P365	G344-I348 WeakPolarHBondContact O-CG2 3.24Å; G344-I348 PolarHBondContact O-N 3.19Å; G344-I348 VanDerWaalsContact O-N 3.09Å; I348-P350 WeakPolarHBondContact O-CD 3.42Å; I348-R363 HydrophobicContact CD1-CG 4.11Å; I348-P365 WeakPolarHBondContact CD1-O 3.29Å
349	N	83.6	Confident	75.1	Confident	14 Å²	14	72.9 Å²	72.9	8%	0.075	40%	0.396	C	S	.	.			trans	-112.8	77.8	179.4	-64.4	-77.9	0	0	0	109.5	V345 I347 N351 L357 L362 R363	V345-N349 PolarHBondContact O-ND2 3.27Å; I347-N349 PolarHBondContact O-N 3.38Å; N349-N351 PolarHBondContact O-N 3.5Å; N349-L357 HydrophobicContact CB-CD1 4.5Å; N349-L362 HydrophobicContact CB-CD1 3.88Å; N349-L362 VanDerWaalsContact ND2-CD1 3.29Å; N349-L362 WeakPolarHBondContact ND2-CD1 3.23Å; N349-R363 PolarHBondContact ND2-O 2.95Å; N349-R363 PolarHBondContact OD1-N 3.29Å
350	P	64.8	Low	74.2	Confident	81 Å²	81	75.3 Å²	75.3	53%	0.526	41%	0.411	S	S	.	.			trans	-68.4	19.3	-174.4	27.5	-34.9	0	0	0	115.3	I348 Y352	I348-P350 WeakPolarHBondContact O-CD 3.42Å; P350-Y352 HydrophobicContact CB-CD1 4.31Å; P350-Y352 HydrophobicContact CB-CE1 3.89Å; P350-Y352 PolarHBondContact O-N 3.01Å
351	N	57.6	Low	73.5	Confident	65 Å²	65	78.6 Å²	78.6	35%	0.348	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	7.8	171.5	-73.4	-17.2	0	0	0	113.6	N349 C353 L357	N349-N351 PolarHBondContact O-N 3.5Å; N351-C353 PolarHBondContact O-N 3.22Å; N351-C353 VanDerWaalsContact O-N 3.14Å; N351-L357 HydrophobicContact CB-CD1 4.31Å
352	Y	53.7	Low	73.1	Confident	132 Å²	132	76.1 Å²	76.1	52%	0.518	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.4	179.4	61.6	-96.4	0	0	0	113.5	P350	P350-Y352 HydrophobicContact CB-CD1 4.31Å; P350-Y352 HydrophobicContact CB-CE1 3.89Å; P350-Y352 PolarHBondContact O-N 3.01Å
353	C	49.3	Very low	72.9	Confident	90 Å²	90	73.4 Å²	73.4	61%	0.608	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-11.9	-178.7	-81.9	0	0	0	0	116.2	N351	N351-C353 PolarHBondContact O-N 3.22Å; N351-C353 VanDerWaalsContact O-N 3.14Å
354	L	51.4	Low	72.8	Confident	155 Å²	155	73.8 Å²	73.8	81%	0.812	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-3.1	-167	-70.7	167.5	0	0	0	115.2
355	G	54.2	Low	72.9	Confident	44 Å²	44	74.1 Å²	74.1	45%	0.454	41%	0.406	S	S	.	.	S	Bend	trans	161.2	179.7	176.2	0	0	0	0	0	113.2	L357	G355-L357 PolarHBondContact O-N 3.11Å
356	P	55.7	Low	73	Confident	127 Å²	127	72.7 Å²	72.7	83%	0.825	40%	0.397	S	S	*	.	S	Bend	trans	-57.5	132.4	170.8	24.2	-31.3	0	0	0	109.3	S358	P356-S358 PolarHBondContact O-N 3.42Å
357	L	60.7	Low	73.2	Confident	86 Å²	86	66.9 Å²	66.9	45%	0.45	38%	0.375	S	S	.	.			trans	-54.3	105.2	175.4	-163.1	91.1	0	0	0	107.7	N349 N351 G355 I359 L362	N349-L357 HydrophobicContact CB-CD1 4.5Å; N351-L357 HydrophobicContact CB-CD1 4.31Å; G355-L357 PolarHBondContact O-N 3.11Å; L357-I359 VanDerWaalsContact C-N 3.27Å; L357-I359 PolarHBondContact O-N 3.09Å; L357-L362 HydrophobicContact CD1-CD1 4.34Å; L357-L362 HydrophobicContact CD2-CD1 3.88Å; L357-L362 HydrophobicContact CG-CD1 4.22Å
358	S	65.6	Low	73.5	Confident	44 Å²	44	65.9 Å²	65.9	31%	0.308	37%	0.369	S	S	.	.			trans	-68.1	93.9	174.6	58.8	0	0	0	0	107	P356 D360 N361	P356-S358 PolarHBondContact O-N 3.42Å; S358-D360 PolarHBondContact O-N 3.48Å; S358-D360 VanDerWaalsContact O-N 3.07Å; S358-N361 PolarHBondContact O-N 2.97Å
359	I	73.6	Confident	74	Confident	125 Å²	125	64.4 Å²	64.4	64%	0.641	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-52.1	-33.6	-178.4	-66.2	169.7	0	0	0	109.7	L357 N361 L362 H470	L357-I359 VanDerWaalsContact C-N 3.27Å; L357-I359 PolarHBondContact O-N 3.09Å; I359-N361 VanDerWaalsContact C-N 3.31Å; I359-N361 PolarHBondContact O-N 2.64Å; I359-L362 WeakPolarHBondContact O-CB 3.35Å; I359-L362 PolarHBondContact O-N 2.95Å; I359-H470 PolarHBondContact O-CE1 3.41Å; I359-H470 VanDerWaalsContact O-CE1 3.28Å
360	D	76.3	Confident	74.6	Confident	110 Å²	110	64 Å²	64	59%	0.588	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-63.2	-27.2	179.7	-52	-36.7	0	0	0	114.3	S358 Q469 H470	S358-D360 PolarHBondContact O-N 3.48Å; S358-D360 VanDerWaalsContact O-N 3.07Å; D360-Q469 VanDerWaalsContact O-CB 3.3Å; D360-Q469 WeakPolarHBondContact O-CB 3.37Å; D360-Q469 PolarHBondContact O-OE1 2.92Å; D360-H470 PolarHBondContact O-CE1 3.3Å
361	N	78.8	Confident	76	Confident	91 Å²	91	60.6 Å²	60.6	49%	0.487	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-114.2	23.3	-179	-61.3	-52	0	0	0	113	S358 I359 R363	S358-N361 PolarHBondContact O-N 2.97Å; I359-N361 VanDerWaalsContact C-N 3.31Å; I359-N361 PolarHBondContact O-N 2.64Å; N361-R363 PolarHBondContact O-N 3.22Å
362	L	86.2	Confident	77.9	Confident	32 Å²	32	57.7 Å²	57.7	17%	0.168	32%	0.321	C	S	.	.			trans	-71.2	121.2	-177.9	-172.4	79.1	0	0	0	110.9	V345 N349 L357 I359 I364 H470	V345-L362 HydrophobicContact CG1-CD1 4.46Å; V345-L362 HydrophobicContact CG1-CD2 4.07Å; N349-L362 HydrophobicContact CB-CD1 3.88Å; N349-L362 VanDerWaalsContact ND2-CD1 3.29Å; N349-L362 WeakPolarHBondContact ND2-CD1 3.23Å; L357-L362 HydrophobicContact CD1-CD1 4.34Å; L357-L362 HydrophobicContact CD2-CD1 3.88Å; L357-L362 HydrophobicContact CG-CD1 4.22Å; I359-L362 WeakPolarHBondContact O-CB 3.35Å; I359-L362 PolarHBondContact O-N 2.95Å; L362-I364 PolarHBondContact O-N 3Å; L362-H470 WeakPolarHBondContact O-CA 3.24Å; L362-H470 WeakPolarHBondContact O-CB 3.11Å; L362-H470 PolarHBondContact O-ND1 3Å
363	R	88.9	Confident	80	Confident	41 Å²	41	57.2 Å²	57.2	16%	0.155	32%	0.319	C	S	.	.			trans	-72.1	118.7	170.2	-173.7	176	179.8	-157.3	-5.9	109.9	I348 N349 N361 P365 H470 D488 E490	I348-R363 HydrophobicContact CD1-CG 4.11Å; N349-R363 PolarHBondContact ND2-O 2.95Å; N349-R363 PolarHBondContact OD1-N 3.29Å; N361-R363 PolarHBondContact O-N 3.22Å; R363-P365 PolarHBondContact NE-O 3.09Å; R363-H470 WeakPolarHBondContact CA-O 3.46Å; R363-D488 IonicContact CZ-OD2 2.68Å; R363-D488 IonicContact NE-OD2 3.8Å; R363-D488 PolarHBondContact NE-OD2 3.29Å; R363-D488 IonicContact NH2-OD1 3.72Å; R363-D488 PolarHBondContact NH2-OD1 3.26Å; R363-D488 IonicContact NH2-OD2 3.32Å; R363-D488 PolarHBondContact NH2-OD2 3.49Å; R363-D488 VanDerWaalsContact NH2-OD2 3.1Å; R363-E490 IonicContact CZ-OE2 3.55Å; R363-E490 IonicContact NH2-OE2 3.32Å; R363-E490 PolarHBondContact NH2-OE2 3.12Å
364	I	89.8	Confident	82.2	Confident	55 Å²	55	53 Å²	53	28%	0.282	29%	0.29	S	S	.	.			trans	-90.9	-50.4	-178	-58.7	170.5	0	0	0	111.8	F341 L362 Q369 H470	F341-I364 HydrophobicContact CZ-CG2 4.41Å; L362-I364 PolarHBondContact O-N 3Å; I364-Q369 WeakPolarHBondContact O-CG 3.11Å; I364-Q369 PolarHBondContact O-NE2 2.88Å; I364-Q369 VanDerWaalsContact O-NE2 3.16Å; I364-H470 HydrophobicContact CD1-CB 3.94Å; I364-H470 HydrophobicContact CG1-CB 4.15Å; I364-H470 PolarHBondContact N-O 3.31Å
365	P	92	Very high	84.4	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.065	26%	0.255	C	S	.	.			trans	-71.6	140.9	-179.3	-16.6	32.9	0	0	0	111.6	I348 R363 L466 H470 D488 E490	I348-P365 WeakPolarHBondContact CD1-O 3.29Å; R363-P365 PolarHBondContact NE-O 3.09Å; P365-L466 HydrophobicContact CG-CD1 3.38Å; P365-H470 VanDerWaalsContact CD-O 3.28Å; P365-H470 WeakPolarHBondContact CD-O 3.17Å; P365-D488 HydrophobicContact CG-CB 4.39Å; P365-E490 HydrophobicContact CB-CB 4.07Å
366	G	91.8	Very high	86.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.			trans	-169.6	171.6	178.3	0	0	0	0	0	112.7	L368 Q369 R370	G366-L368 PolarHBondContact O-N 3.05Å; G366-Q369 PolarHBondContact O-N 3.33Å; G366-Q369 PolarHBondContact O-OE1 3.18Å; G366-R370 WeakPolarHBondContact O-CB 3.46Å; G366-R370 PolarHBondContact O-N 3.38Å
367	V	92.3	Very high	88.4	Confident	32 Å²	32	41.8 Å²	41.8	19%	0.194	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-46	-174.5	175.9	0	0	0	0	111.2	F301 L371 E490	F301-V367 HydrophobicContact CD2-CG1 3.76Å; F301-V367 HydrophobicContact CE1-CG1 4.44Å; F301-V367 HydrophobicContact CE2-CB 4.47Å; F301-V367 HydrophobicContact CE2-CG1 3.46Å; F301-V367 VanDerWaalsContact CE2-CG1 3.46Å; F301-V367 HydrophobicContact CG-CG1 4.41Å; F301-V367 HydrophobicContact CZ-CB 4.4Å; F301-V367 HydrophobicContact CZ-CG1 3.84Å; V367-L371 HydrophobicContact CG1-CD1 4.28Å; V367-L371 VanDerWaalsContact O-CG 3.31Å; V367-L371 WeakPolarHBondContact O-CG 3.41Å; V367-L371 PolarHBondContact O-N 3.47Å; V367-E490 HydrophobicContact CG2-CG 4.32Å
368	L	93.2	Very high	90.2	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-71.8	-35.5	-179.5	-70.8	176.6	0	0	0	112.8	L340 I343 I347 G366 L371 A372 I599 Y602	L340-L368 HydrophobicContact CD1-CD2 3.73Å; L340-L368 HydrophobicContact CG-CD2 4.45Å; I343-L368 HydrophobicContact CG2-CD1 4.12Å; I347-L368 HydrophobicContact CD1-CD1 3.88Å; G366-L368 PolarHBondContact O-N 3.05Å; L368-L371 HydrophobicContact CD2-CD1 4.17Å; L368-L371 PolarHBondContact O-N 3.13Å; L368-A372 WeakPolarHBondContact O-CB 3.41Å; L368-A372 PolarHBondContact O-N 3.15Å; L368-I599 HydrophobicContact CD2-CD1 4.36Å; L368-Y602 HydrophobicContact CD1-CD1 4Å; L368-Y602 HydrophobicContact CD1-CE1 3.58Å; L368-Y602 HydrophobicContact CD2-CD1 3.74Å; L368-Y602 HydrophobicContact CD2-CE1 3.63Å; L368-Y602 HydrophobicContact CG-CD1 4.09Å; L368-Y602 HydrophobicContact CG-CE1 3.51Å
369	Q	95.1	Very high	91.6	Very high	12 Å²	12	35.6 Å²	35.6	6%	0.056	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-44.6	176.1	-64.3	85.6	-27.7	0	0	110.2	F341 G344 V345 I364 G366 A372 W373	F341-Q369 HydrophobicContact CD2-CB 3.74Å; F341-Q369 HydrophobicContact CD2-CG 3.69Å; F341-Q369 HydrophobicContact CE2-CB 3.73Å; F341-Q369 HydrophobicContact CE2-CG 3.62Å; F341-Q369 HydrophobicContact CG-CG 4.29Å; F341-Q369 HydrophobicContact CZ-CG 4.16Å; G344-Q369 PolarHBondContact O-NE2 3.5Å; V345-Q369 HydrophobicContact CG2-CG 4.32Å; I364-Q369 WeakPolarHBondContact O-CG 3.11Å; I364-Q369 PolarHBondContact O-NE2 2.88Å; I364-Q369 VanDerWaalsContact O-NE2 3.16Å; G366-Q369 PolarHBondContact O-N 3.33Å; G366-Q369 PolarHBondContact O-OE1 3.18Å; Q369-A372 WeakPolarHBondContact O-CB 3.31Å; Q369-A372 PolarHBondContact O-N 3.47Å; Q369-W373 PolarHBondContact O-N 3.47Å
370	R	95.8	Very high	92.6	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-45.3	173.5	-178.5	169.7	-76.2	-179.2	-1.1	111.4	F301 G366 A372 W373 S374 P489 E490 G491 S495	F301-R370 HydrophobicContact CZ-CB 4.3Å; F301-R370 HydrophobicContact CZ-CG 4.24Å; G366-R370 WeakPolarHBondContact O-CB 3.46Å; G366-R370 PolarHBondContact O-N 3.38Å; R370-A372 VanDerWaalsContact C-N 3.3Å; R370-A372 PolarHBondContact O-N 3.03Å; R370-W373 PolarHBondContact O-N 3.12Å; R370-S374 PolarHBondContact O-N 3.34Å; R370-S374 PolarHBondContact O-OG 2.9Å; R370-P489 PolarHBondContact NH1-O 3.33Å; R370-P489 PolarHBondContact NH2-O 3.35Å; R370-E490 VanDerWaalsContact CZ-CA 3.48Å; R370-E490 PolarHBondContact NH2-O 2.69Å; R370-E490 VanDerWaalsContact NH2-O 3.15Å; R370-G491 VanDerWaalsContact NH2-N 3.2Å; R370-G491 PolarHBondContact NH2-O 3.47Å; R370-S495 PolarHBondContact NE-OG 3.49Å
371	L	95	Very high	93.4	Very high	10 Å²	10	26.8 Å²	26.8	5%	0.052	13%	0.133	C	C	.	.	H	α-helix	trans	-58.3	-41.9	174.8	-74.3	167.4	0	0	0	112.4	F301 F304 V305 M308 L340 V367 L368 Y375	F301-L371 HydrophobicContact CE2-CD1 4.22Å; F301-L371 HydrophobicContact CE2-CD2 4.04Å; F301-L371 HydrophobicContact CE2-CG 3.88Å; F304-L371 HydrophobicContact CD1-CD1 4.21Å; F304-L371 HydrophobicContact CD1-CD2 3.99Å; F304-L371 HydrophobicContact CE1-CD1 4.23Å; F304-L371 HydrophobicContact CE1-CD2 4.44Å; V305-L371 HydrophobicContact CB-CD2 4.49Å; V305-L371 HydrophobicContact CG2-CD2 3.61Å; M308-L371 HydrophobicContact CE-CD2 3.83Å; M308-L371 HydrophobicContact SD-CD2 3.96Å; L340-L371 HydrophobicContact CD2-CB 3.92Å; V367-L371 HydrophobicContact CG1-CD1 4.28Å; V367-L371 VanDerWaalsContact O-CG 3.31Å; V367-L371 WeakPolarHBondContact O-CG 3.41Å; V367-L371 PolarHBondContact O-N 3.47Å; L368-L371 HydrophobicContact CD2-CD1 4.17Å; L368-L371 PolarHBondContact O-N 3.13Å; L371-Y375 WeakPolarHBondContact O-CB 3.45Å; L371-Y375 PolarHBondContact O-N 2.98Å
372	A	96.6	Very high	94	Very high	4 Å²	4	22.5 Å²	22.5	3%	0.033	11%	0.11	C	C	.	.	H	α-helix	trans	-61.2	-45.8	176.3	0	0	0	0	0	111.5	S337 L340 F341 L368 Q369 R370 L376	S337-A372 WeakPolarHBondContact O-CB 3.48Å; L340-A372 HydrophobicContact CB-CB 4.04Å; L340-A372 HydrophobicContact CD2-CB 4.09Å; L340-A372 HydrophobicContact CG-CB 4.17Å; F341-A372 HydrophobicContact CB-CB 4.06Å; L368-A372 WeakPolarHBondContact O-CB 3.41Å; L368-A372 PolarHBondContact O-N 3.15Å; Q369-A372 WeakPolarHBondContact O-CB 3.31Å; Q369-A372 PolarHBondContact O-N 3.47Å; R370-A372 VanDerWaalsContact C-N 3.3Å; R370-A372 PolarHBondContact O-N 3.03Å; A372-L376 VanDerWaalsContact O-CB 3.3Å; A372-L376 WeakPolarHBondContact O-CB 3.24Å; A372-L376 PolarHBondContact O-N 3.31Å
373	W	96.9	Very high	94.3	Very high	123 Å²	123	21.3 Å²	21.3	47%	0.466	10%	0.103	S	C	.	.	H	α-helix	trans	-63.3	-52.3	176.9	177.3	-106.4	0	0	0	112.4	Q369 R370 Y375 L376 V377	Q369-W373 PolarHBondContact O-N 3.47Å; R370-W373 PolarHBondContact O-N 3.12Å; W373-Y375 VanDerWaalsContact C-N 3.28Å; W373-Y375 PolarHBondContact O-N 3.41Å; W373-L376 PolarHBondContact O-N 3.16Å; W373-V377 HydrophobicContact CD2-CG2 3.99Å; W373-V377 HydrophobicContact CE3-CG2 4.34Å; W373-V377 HydrophobicContact CH2-CG2 4.07Å; W373-V377 HydrophobicContact CZ2-CG2 3.68Å; W373-V377 HydrophobicContact CZ3-CG2 4.37Å; W373-V377 WeakPolarHBondContact O-CG2 3.48Å; W373-V377 PolarHBondContact O-N 2.87Å
374	S	97.3	Very high	94.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.3	-39.8	-179.8	-37	0	0	0	0	111.4	R370 V378 S498	R370-S374 PolarHBondContact O-N 3.34Å; R370-S374 PolarHBondContact O-OG 2.9Å; S374-V378 WeakPolarHBondContact O-CB 3.29Å; S374-V378 WeakPolarHBondContact O-CG2 3.49Å; S374-V378 PolarHBondContact O-N 2.88Å; S374-S498 WeakPolarHBondContact OG-CB 3.23Å; S374-S498 PolarHBondContact OG-OG 2.95Å
375	Y	96.7	Very high	94	Very high	22 Å²	22	24.8 Å²	24.8	9%	0.086	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-48.3	175.5	179.3	-91.4	0	0	0	111.5	M308 I312 V333 R336 S337 L371 W373 V377 A379	M308-Y375 HydrophobicContact CG-CD2 4.16Å; M308-Y375 HydrophobicContact SD-CD2 4.12Å; M308-Y375 HydrophobicContact SD-CG 4.49Å; I312-Y375 HydrophobicContact CD1-CD2 3.6Å; I312-Y375 HydrophobicContact CD1-CE2 4.01Å; I312-Y375 HydrophobicContact CD1-CG 4.36Å; I312-Y375 HydrophobicContact CG1-CD2 3.74Å; I312-Y375 HydrophobicContact CG1-CE2 3.63Å; V333-Y375 HydrophobicContact CB-CE1 4.35Å; V333-Y375 HydrophobicContact CG1-CD1 4.29Å; V333-Y375 HydrophobicContact CG1-CE1 3.88Å; V333-Y375 HydrophobicContact CG2-CE1 4.33Å; R336-Y375 HydrophobicContact CB-CE1 4.47Å; R336-Y375 HydrophobicContact CG-CE1 4.25Å; S337-Y375 WeakPolarHBondContact OG-CD1 3.36Å; L371-Y375 WeakPolarHBondContact O-CB 3.45Å; L371-Y375 PolarHBondContact O-N 2.98Å; W373-Y375 VanDerWaalsContact C-N 3.28Å; W373-Y375 PolarHBondContact O-N 3.41Å; Y375-V377 PolarHBondContact O-N 3.27Å; Y375-A379 HydrophobicContact CE1-CB 4.41Å; Y375-A379 WeakPolarHBondContact O-CB 3.43Å; Y375-A379 PolarHBondContact O-N 2.93Å
376	L	97.5	Very high	93.1	Very high	45 Å²	45	24.6 Å²	24.6	24%	0.236	13%	0.125	C	C	.	.	H	α-helix	trans	-57.8	-50.6	-179.9	179	59.3	0	0	0	111.4	V333 I334 A372 W373 S380	V333-L376 HydrophobicContact CG1-CD1 3.93Å; I334-L376 HydrophobicContact CG1-CD1 3.91Å; A372-L376 VanDerWaalsContact O-CB 3.3Å; A372-L376 WeakPolarHBondContact O-CB 3.24Å; A372-L376 PolarHBondContact O-N 3.31Å; W373-L376 PolarHBondContact O-N 3.16Å; L376-S380 WeakPolarHBondContact O-CB 3.22Å; L376-S380 PolarHBondContact O-N 2.97Å; L376-S380 PolarHBondContact O-OG 3.49Å
377	V	97.2	Very high	91.9	Very high	24 Å²	24	32.6 Å²	32.6	15%	0.145	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-53.6	-177.2	176.2	0	0	0	0	110.6	W373 Y375 A379 S380 L381 M418 V499	W373-V377 HydrophobicContact CD2-CG2 3.99Å; W373-V377 HydrophobicContact CE3-CG2 4.34Å; W373-V377 HydrophobicContact CH2-CG2 4.07Å; W373-V377 HydrophobicContact CZ2-CG2 3.68Å; W373-V377 HydrophobicContact CZ3-CG2 4.37Å; W373-V377 WeakPolarHBondContact O-CG2 3.48Å; W373-V377 PolarHBondContact O-N 2.87Å; Y375-V377 PolarHBondContact O-N 3.27Å; V377-A379 PolarHBondContact O-N 3.49Å; V377-S380 PolarHBondContact O-N 3.46Å; V377-L381 HydrophobicContact CG1-CD1 3.87Å; V377-L381 HydrophobicContact CG1-CG 4.42Å; V377-L381 WeakPolarHBondContact O-CB 3.46Å; V377-L381 VanDerWaalsContact O-CG 3.3Å; V377-L381 WeakPolarHBondContact O-CG 3.4Å; V377-L381 PolarHBondContact O-N 2.94Å; V377-M418 HydrophobicContact CG1-CE 4.4Å; V377-M418 HydrophobicContact CG1-SD 4.31Å; V377-V499 HydrophobicContact CB-CG1 4.31Å; V377-V499 HydrophobicContact CB-CG2 3.99Å; V377-V499 HydrophobicContact CG1-CG1 3.67Å; V377-V499 HydrophobicContact CG1-CG2 4.06Å; V377-V499 HydrophobicContact CG2-CG2 4.28Å
378	V	97	Very high	90.1	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-41.2	-175.8	173.8	0	0	0	0	112	I312 S374 L381 D382 V499 A502 F503 L506	I312-V378 HydrophobicContact CD1-CB 4.29Å; I312-V378 HydrophobicContact CD1-CG1 4.1Å; S374-V378 WeakPolarHBondContact O-CB 3.29Å; S374-V378 WeakPolarHBondContact O-CG2 3.49Å; S374-V378 PolarHBondContact O-N 2.88Å; V378-L381 PolarHBondContact O-N 2.9Å; V378-D382 WeakPolarHBondContact O-CB 3.42Å; V378-D382 PolarHBondContact O-N 3.48Å; V378-V499 HydrophobicContact CG2-CG1 3.83Å; V378-A502 HydrophobicContact CB-CB 4.43Å; V378-A502 HydrophobicContact CG2-CB 3.74Å; V378-F503 HydrophobicContact CG2-CB 4.25Å; V378-L506 HydrophobicContact CG1-CB 4.01Å; V378-L506 HydrophobicContact CG1-CD1 3.77Å; V378-L506 HydrophobicContact CG1-CG 4.36Å
379	A	95.6	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-37.3	177.2	0	0	0	0	0	112.2	I312 I316 V333 Y375 V377 D382 L383	I312-A379 HydrophobicContact CD1-CB 4.32Å; I312-A379 HydrophobicContact CG2-CB 3.87Å; I316-A379 HydrophobicContact CD1-CB 4.08Å; V333-A379 HydrophobicContact CG1-CB 3.73Å; V333-A379 HydrophobicContact CG2-CB 3.91Å; Y375-A379 HydrophobicContact CE1-CB 4.41Å; Y375-A379 WeakPolarHBondContact O-CB 3.43Å; Y375-A379 PolarHBondContact O-N 2.93Å; V377-A379 PolarHBondContact O-N 3.49Å; A379-D382 PolarHBondContact O-N 3.02Å; A379-L383 VanDerWaalsContact O-CG 3.32Å; A379-L383 WeakPolarHBondContact O-CG 3.42Å; A379-L383 PolarHBondContact O-N 3.31Å
380	S	95.1	Very high	86	Confident	25 Å²	25	42 Å²	42	18%	0.175	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-44.9	175.7	-58.9	0	0	0	0	111.3	L376 V377 D382 L383 L384	L376-S380 WeakPolarHBondContact O-CB 3.22Å; L376-S380 PolarHBondContact O-N 2.97Å; L376-S380 PolarHBondContact O-OG 3.49Å; V377-S380 PolarHBondContact O-N 3.46Å; S380-D382 VanDerWaalsContact C-N 3.35Å; S380-D382 PolarHBondContact O-N 3.43Å; S380-L383 PolarHBondContact O-N 3.36Å; S380-L384 VanDerWaalsContact O-CG 3.32Å; S380-L384 WeakPolarHBondContact O-CG 3.43Å; S380-L384 PolarHBondContact O-N 2.88Å
381	L	93.5	Very high	83.7	Confident	24 Å²	24	46 Å²	46	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-45.4	174	-72.5	172.9	0	0	0	111.6	V377 V378 L383 L384 V385 C414 V415	V377-L381 HydrophobicContact CG1-CD1 3.87Å; V377-L381 HydrophobicContact CG1-CG 4.42Å; V377-L381 WeakPolarHBondContact O-CB 3.46Å; V377-L381 VanDerWaalsContact O-CG 3.3Å; V377-L381 WeakPolarHBondContact O-CG 3.4Å; V377-L381 PolarHBondContact O-N 2.94Å; V378-L381 PolarHBondContact O-N 2.9Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L381-L383 PolarHBondContact O-N 2.91Å; L381-L384 PolarHBondContact O-N 3Å; L381-V385 WeakPolarHBondContact O-CG2 3.29Å; L381-V385 PolarHBondContact O-N 3.39Å; L381-V385 VanDerWaalsContact O-N 3.09Å; L381-C414 HydrophobicContact CD2-CB 3.98Å; L381-V415 HydrophobicContact CD1-CG2 4.18Å
382	D	91.6	Very high	81.3	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.011	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-39.6	177	-166.8	41	0	0	0	111.7	I316 V378 A379 S380 L384 V385 A386 L506 K510	I316-D382 HydrophobicContact CD1-CB 4.08Å; V378-D382 WeakPolarHBondContact O-CB 3.42Å; V378-D382 PolarHBondContact O-N 3.48Å; A379-D382 PolarHBondContact O-N 3.02Å; S380-D382 VanDerWaalsContact C-N 3.35Å; S380-D382 PolarHBondContact O-N 3.43Å; D382-L384 VanDerWaalsContact C-N 3.33Å; D382-L384 PolarHBondContact O-N 2.71Å; D382-V385 PolarHBondContact O-N 2.7Å; D382-A386 WeakPolarHBondContact O-CA 3.36Å; D382-A386 WeakPolarHBondContact O-CB 3.42Å; D382-A386 PolarHBondContact O-N 2.85Å; D382-L506 HydrophobicContact CB-CD1 3.78Å; D382-K510 WeakPolarHBondContact OD1-CE 3.5Å; D382-K510 IonicContact OD1-NZ 3.26Å; D382-K510 PolarHBondContact OD1-NZ 2.99Å; D382-K510 IonicContact OD2-NZ 3Å; D382-K510 PolarHBondContact OD2-NZ 3.49Å
383	L	91.3	Very high	79.1	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-36.1	176.8	-76.2	172.3	0	0	0	113.4	I316 L329 L330 V333 A379 S380 L381	I316-L383 HydrophobicContact CD1-CD2 4.3Å; I316-L383 HydrophobicContact CD1-CG 4.06Å; I316-L383 HydrophobicContact CG1-CD2 4.39Å; I316-L383 HydrophobicContact CG2-CD2 3.64Å; I316-L383 HydrophobicContact CG2-CG 4.39Å; L329-L383 HydrophobicContact CB-CD1 3.99Å; L329-L383 HydrophobicContact CB-CD2 3.74Å; L329-L383 HydrophobicContact CD1-CD2 3.74Å; L329-L383 HydrophobicContact CG-CD2 4.41Å; L330-L383 HydrophobicContact CB-CD1 4.2Å; L330-L383 HydrophobicContact CD1-CD1 4.37Å; V333-L383 HydrophobicContact CG2-CD1 4.1Å; A379-L383 VanDerWaalsContact O-CG 3.32Å; A379-L383 WeakPolarHBondContact O-CG 3.42Å; A379-L383 PolarHBondContact O-N 3.31Å; S380-L383 PolarHBondContact O-N 3.36Å; L381-L383 VanDerWaalsContact C-N 3.34Å; L381-L383 PolarHBondContact O-N 2.91Å
384	L	87.7	Confident	76.6	Confident	143 Å²	143	58.8 Å²	58.8	75%	0.749	31%	0.309	S	S	*	.	H	α-helix	trans	-70.4	-38.9	178.5	-68.7	172.3	0	0	0	111.7	S380 L381 D382	S380-L384 VanDerWaalsContact O-CG 3.32Å; S380-L384 WeakPolarHBondContact O-CG 3.43Å; S380-L384 PolarHBondContact O-N 2.88Å; L381-L384 PolarHBondContact O-N 3Å; D382-L384 VanDerWaalsContact C-N 3.33Å; D382-L384 PolarHBondContact O-N 2.71Å
385	V	84.4	Confident	74.4	Confident	26 Å²	26	64.7 Å²	64.7	16%	0.158	35%	0.345	C	S	.	.	H	α-helix	trans	-92.9	-22.6	-175.7	-178.1	0	0	0	0	112.6	L381 D382 R387 Y408 P410 A411	L381-V385 WeakPolarHBondContact O-CG2 3.29Å; L381-V385 PolarHBondContact O-N 3.39Å; L381-V385 VanDerWaalsContact O-N 3.09Å; D382-V385 PolarHBondContact O-N 2.7Å; V385-R387 PolarHBondContact O-N 2.81Å; V385-Y408 HydrophobicContact CG1-CD1 3.86Å; V385-P410 HydrophobicContact CG1-CG 4.4Å; V385-P410 HydrophobicContact CG2-CB 4.1Å; V385-A411 HydrophobicContact CG2-CB 4.07Å
386	A	74.3	Confident	72.1	Confident	6 Å²	6	71.1 Å²	71.1	5%	0.05	38%	0.381	C	S	.	.			trans	-61.2	112.7	-177.5	0	0	0	0	0	111.6	L320 R326 D382	L320-A386 HydrophobicContact CD1-CB 3.59Å; R326-A386 PolarHBondContact NH2-O 3.12Å; D382-A386 WeakPolarHBondContact O-CA 3.36Å; D382-A386 WeakPolarHBondContact O-CB 3.42Å; D382-A386 PolarHBondContact O-N 2.85Å
387	R	66.6	Low	70	Confident	168 Å²	168	71.3 Å²	71.3	63%	0.634	39%	0.389	S	S	*	.			trans	-81	116.2	165.6	-63.3	-173.3	-178.9	-171.5	-0.3	108	V385 H389	V385-R387 PolarHBondContact O-N 2.81Å; R387-H389 PolarHBondContact O-N 3.09Å; R387-H389 VanDerWaalsContact O-N 3.15Å
388	G	53.8	Low	68	Low	38 Å²	38	81.8 Å²	81.8	39%	0.392	43%	0.426	S	S	.	.	S	Bend	trans	-68.1	-6.2	-176.8	0	0	0	0	0	114.8
389	H	49.8	Very low	65.9	Low	152 Å²	152	90.7 Å²	90.7	70%	0.704	46%	0.46	S	S	*	.			trans	-124.8	89.3	178.1	-128.5	56.4	0	0	0	107.9	R387	R387-H389 PolarHBondContact O-N 3.09Å; R387-H389 VanDerWaalsContact O-N 3.15Å
390	L	52.4	Low	64.1	Low	59 Å²	59	92.7 Å²	92.7	31%	0.309	47%	0.474	S	S	.	.			trans	-111.4	39.3	170.3	-143.5	84.1	0	0	0	111	L407	L390-L407 HydrophobicContact CD1-CD1 3.85Å; L390-L407 HydrophobicContact CD1-CD2 3.24Å; L390-L407 HydrophobicContact CD1-CG 4.13Å; L390-L407 HydrophobicContact CD2-CD2 3.5Å; L390-L407 HydrophobicContact CG-CD2 3.96Å
391	D	46.5	Very low	62.4	Low	89 Å²	89	95.2 Å²	95.2	48%	0.476	49%	0.489	S	S	.	.	S	Bend	trans	-107.7	129.1	164.8	-59.5	-23.1	0	0	0	104.3	R321	R321-D391 IonicContact NH2-OD1 3.73Å; R321-D391 PolarHBondContact NH2-OD1 3.27Å
392	I	46.5	Very low	61	Low	150 Å²	150	95.1 Å²	95.1	77%	0.769	50%	0.495	S	S	*	.			trans	86.3	56.7	177.1	-38.8	154	0	0	0	115.7
393	L	49	Very low	59.8	Low	144 Å²	144	97.2 Å²	97.2	75%	0.754	51%	0.506	S	S	*	.			trans	-121.1	117.5	137	-111.6	99.4	0	0	0	107.5
394	T	44.8	Very low	58.7	Low	110 Å²	110	97.1 Å²	97.1	68%	0.675	51%	0.505	S	S	*	.			trans	-58.1	137.7	-168.1	39.4	0	0	0	0	112.7	D396	T394-D396 PolarHBondContact O-N 3.05Å
395	T	51.5	Low	58	Low	125 Å²	125	93.5 Å²	93.5	77%	0.767	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	6.7	-179	-31.9	0	0	0	0	114
396	D	47.3	Very low	57.5	Low	156 Å²	156	96.4 Å²	96.4	83%	0.834	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	11.1	-168.7	-73.2	-27.2	0	0	0	115	T394	T394-D396 PolarHBondContact O-N 3.05Å
397	A	54.6	Low	57.4	Low	49 Å²	49	98 Å²	98	41%	0.405	51%	0.507	S	S	.	.	S	Bend	trans	-92.5	140.2	174.3	0	0	0	0	0	112	W399 S400	A397-W399 PolarHBondContact O-N 3.44Å; A397-S400 WeakPolarHBondContact O-CB 3.16Å; A397-S400 PolarHBondContact O-N 3.22Å; A397-S400 PolarHBondContact O-OG 2.91Å
398	W	54.5	Low	58	Low	244 Å²	244	90.8 Å²	90.8	92%	0.924	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-20	170.5	-171.5	7.2	0	0	0	112.8	P401	W398-P401 WeakPolarHBondContact O-CD 3.38Å
399	W	53.9	Low	59.5	Low	189 Å²	189	96.4 Å²	96.4	72%	0.716	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.5	175.8	-57.2	85.2	0	0	0	114.6	A397 P401 G402	A397-W399 PolarHBondContact O-N 3.44Å; W399-P401 WeakPolarHBondContact O-CD 3.32Å; W399-P401 VanDerWaalsContact O-N 3.15Å; W399-G402 PolarHBondContact O-N 3.22Å; W399-G402 VanDerWaalsContact O-N 3.1Å
400	S	56.2	Low	61.3	Low	42 Å²	42	91.3 Å²	91.3	29%	0.294	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-52.4	-28.7	176.5	61.8	0	0	0	0	115.1	A397 G402 L403 Y515	A397-S400 WeakPolarHBondContact O-CB 3.16Å; A397-S400 PolarHBondContact O-N 3.22Å; A397-S400 PolarHBondContact O-OG 2.91Å; S400-G402 VanDerWaalsContact C-N 3.31Å; S400-G402 PolarHBondContact O-N 2.86Å; S400-L403 PolarHBondContact O-N 3.46Å; S400-Y515 PolarHBondContact O-OH 3.29Å
401	P	60.6	Low	63.2	Low	77 Å²	77	88.6 Å²	88.6	50%	0.5	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-68.5	-27.3	177.8	-20.4	34	0	0	0	113.9	W398 W399 R525	W398-P401 WeakPolarHBondContact O-CD 3.38Å; W399-P401 WeakPolarHBondContact O-CD 3.32Å; W399-P401 VanDerWaalsContact O-N 3.15Å; P401-R525 VanDerWaalsContact C-NH2 3.31Å; P401-R525 VanDerWaalsContact O-CZ 3.28Å; P401-R525 PolarHBondContact O-NH1 2.97Å; P401-R525 PolarHBondContact O-NH2 2.99Å
402	G	63.5	Low	65.3	Low	23 Å²	23	86 Å²	86	24%	0.237	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-99	-2.6	-178.4	0	0	0	0	0	114.3	W399 S400 D404 I405 I406	W399-G402 PolarHBondContact O-N 3.22Å; W399-G402 VanDerWaalsContact O-N 3.1Å; S400-G402 VanDerWaalsContact C-N 3.31Å; S400-G402 PolarHBondContact O-N 2.86Å; G402-D404 PolarHBondContact O-N 2.89Å; G402-I405 PolarHBondContact O-N 3.39Å; G402-I406 WeakPolarHBondContact O-CB 3.48Å; G402-I406 VanDerWaalsContact O-CG1 3.26Å; G402-I406 WeakPolarHBondContact O-CG1 3.48Å; G402-I406 PolarHBondContact O-N 3.39Å
403	L	66.3	Low	67.5	Low	46 Å²	46	82.5 Å²	82.5	24%	0.241	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-31.3	-170.3	-152.4	85.4	0	0	0	112.7	S400 I405 L407	S400-L403 PolarHBondContact O-N 3.46Å; L403-I405 VanDerWaalsContact C-N 3.27Å; L403-I405 PolarHBondContact O-N 3.27Å; L403-L407 WeakPolarHBondContact O-CB 3.34Å; L403-L407 PolarHBondContact O-N 3.01Å
404	D	68	Low	69.7	Low	4 Å²	4	78.3 Å²	78.3	2%	0.021	41%	0.407	C	S	.	.	H	α-helix	trans	-69.1	-22.1	175.8	62.9	-42.1	0	0	0	113.5	G402 Y408 Q507 R525	G402-D404 PolarHBondContact O-N 2.89Å; D404-Y408 WeakPolarHBondContact O-CD2 3.05Å; D404-Q507 PolarHBondContact O-NE2 3Å; D404-Q507 PolarHBondContact OD2-NE2 3.09Å; D404-R525 IonicContact OD1-CZ 3.64Å; D404-R525 IonicContact OD1-NH1 2.98Å; D404-R525 PolarHBondContact OD1-NH1 3.21Å; D404-R525 IonicContact OD2-CZ 3.82Å; D404-R525 IonicContact OD2-NH1 3.76Å; D404-R525 PolarHBondContact OD2-NH1 2.94Å
405	I	74.4	Confident	72.1	Confident	66 Å²	66	73.1 Å²	73.1	34%	0.338	38%	0.375	S	S	.	.	H	α-helix	trans	-95.5	-46.8	174.4	-62.2	169.5	0	0	0	109.5	G402 L403 L407 Y408 W409 W529	G402-I405 PolarHBondContact O-N 3.39Å; L403-I405 VanDerWaalsContact C-N 3.27Å; L403-I405 PolarHBondContact O-N 3.27Å; I405-L407 VanDerWaalsContact C-N 3.31Å; I405-L407 PolarHBondContact O-N 3.33Å; I405-Y408 CarbonylContact O-C 3.58Å; I405-Y408 PolarHBondContact O-N 3.42Å; I405-Y408 VanDerWaalsContact O-N 3.1Å; I405-W409 PolarHBondContact O-N 3.37Å; I405-W529 HydrophobicContact CD1-CH2 4.38Å; I405-W529 HydrophobicContact CD1-CZ2 3.76Å; I405-W529 HydrophobicContact CG1-CZ2 4.1Å
406	I	73.1	Confident	74.1	Confident	87 Å²	87	71.5 Å²	71.5	45%	0.446	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-39.3	-177.8	-67.3	166.8	0	0	0	111	G402 Y408 W409	G402-I406 WeakPolarHBondContact O-CB 3.48Å; G402-I406 VanDerWaalsContact O-CG1 3.26Å; G402-I406 WeakPolarHBondContact O-CG1 3.48Å; G402-I406 PolarHBondContact O-N 3.39Å; I406-Y408 VanDerWaalsContact C-N 3.28Å; I406-Y408 PolarHBondContact O-N 3.35Å; I406-W409 WeakPolarHBondContact O-CB 3.48Å; I406-W409 PolarHBondContact O-N 2.97Å
407	L	71.9	Confident	76.5	Confident	39 Å²	39	69 Å²	69	20%	0.204	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.5	178.7	179.9	69.8	0	0	0	113	L390 L403 I405	L390-L407 HydrophobicContact CD1-CD1 3.85Å; L390-L407 HydrophobicContact CD1-CD2 3.24Å; L390-L407 HydrophobicContact CD1-CG 4.13Å; L390-L407 HydrophobicContact CD2-CD2 3.5Å; L390-L407 HydrophobicContact CG-CD2 3.96Å; L403-L407 WeakPolarHBondContact O-CB 3.34Å; L403-L407 PolarHBondContact O-N 3.01Å; I405-L407 VanDerWaalsContact C-N 3.31Å; I405-L407 PolarHBondContact O-N 3.33Å
408	Y	80.1	Confident	78.5	Confident	17 Å²	17	68.9 Å²	68.9	7%	0.067	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	17.9	-176.9	-66.1	-77.9	0	0	0	112.6	V385 D404 I405 I406 P410 A411 W412 K510	V385-Y408 HydrophobicContact CG1-CD1 3.86Å; D404-Y408 WeakPolarHBondContact O-CD2 3.05Å; I405-Y408 CarbonylContact O-C 3.58Å; I405-Y408 PolarHBondContact O-N 3.42Å; I405-Y408 VanDerWaalsContact O-N 3.1Å; I406-Y408 VanDerWaalsContact C-N 3.28Å; I406-Y408 PolarHBondContact O-N 3.35Å; Y408-P410 VanDerWaalsContact C-N 3.31Å; Y408-A411 PolarHBondContact O-N 2.98Å; Y408-W412 PolarHBondContact O-N 2.94Å; Y408-K510 HydrophobicContact CD2-CG 4.44Å; Y408-K510 HydrophobicContact CE1-CD 4.23Å; Y408-K510 HydrophobicContact CE2-CB 4.35Å; Y408-K510 HydrophobicContact CE2-CD 3.92Å; Y408-K510 HydrophobicContact CE2-CG 4.01Å
409	W	84.3	Confident	80.4	Confident	157 Å²	157	57.8 Å²	57.8	60%	0.595	30%	0.298	S	S	*	.	H	α-helix	trans	-52.6	-35.9	-177.9	81.9	-94.3	0	0	0	114.6	I405 I406 A411 W412 V413	I405-W409 PolarHBondContact O-N 3.37Å; I406-W409 WeakPolarHBondContact O-CB 3.48Å; I406-W409 PolarHBondContact O-N 2.97Å; W409-A411 VanDerWaalsContact C-N 3.33Å; W409-A411 PolarHBondContact O-N 3.37Å; W409-W412 WeakPolarHBondContact O-CB 3.32Å; W409-W412 PolarHBondContact O-N 3.07Å; W409-V413 HydrophobicContact CE3-CG2 3.74Å; W409-V413 HydrophobicContact CZ3-CG2 3.97Å; W409-V413 WeakPolarHBondContact O-CG2 3.36Å; W409-V413 PolarHBondContact O-N 2.92Å
410	P	88.7	Confident	82.4	Confident	44 Å²	44	53.4 Å²	53.4	29%	0.286	29%	0.287	S	S	.	.	H	α-helix	trans	-67.1	-36.3	179.5	-18.9	33.7	0	0	0	111.9	V385 Y408 V413 C414	V385-P410 HydrophobicContact CG1-CG 4.4Å; V385-P410 HydrophobicContact CG2-CB 4.1Å; Y408-P410 VanDerWaalsContact C-N 3.31Å; P410-V413 PolarHBondContact O-N 3.05Å; P410-C414 PolarHBondContact O-N 3.45Å; P410-C414 PolarHBondContact O-SG 2.86Å; P410-C414 VanDerWaalsContact O-SG 3.34Å
411	A	90.7	Very high	84.3	Confident	3 Å²	3	54.6 Å²	54.6	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-67.8	-39.1	176.6	0	0	0	0	0	111.2	V385 Y408 W409 C414 V415 F503	V385-A411 HydrophobicContact CG2-CB 4.07Å; Y408-A411 PolarHBondContact O-N 2.98Å; W409-A411 VanDerWaalsContact C-N 3.33Å; W409-A411 PolarHBondContact O-N 3.37Å; A411-C414 PolarHBondContact O-N 2.97Å; A411-V415 WeakPolarHBondContact O-CG2 3.33Å; A411-V415 PolarHBondContact O-N 3.05Å; A411-F503 HydrophobicContact CB-CE2 3.75Å; A411-F503 HydrophobicContact CB-CZ 4.09Å
412	W	91.9	Very high	86	Confident	33 Å²	33	51.1 Å²	51.1	13%	0.125	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-45.6	172.5	-84.1	102.3	0	0	0	111.9	Y408 W409 C414 V415 L416 F503 L504 Q507 W529	Y408-W412 PolarHBondContact O-N 2.94Å; W409-W412 WeakPolarHBondContact O-CB 3.32Å; W409-W412 PolarHBondContact O-N 3.07Å; W412-C414 VanDerWaalsContact C-N 3.35Å; W412-C414 PolarHBondContact O-N 3.16Å; W412-V415 PolarHBondContact O-N 3.05Å; W412-L416 WeakPolarHBondContact O-CB 3.47Å; W412-L416 WeakPolarHBondContact O-CG 3.33Å; W412-L416 PolarHBondContact O-N 3.39Å; W412-F503 AromaticContact CD1-CZ 3.99Å; W412-F503 AromaticContact CD2-CE1 3.48Å; W412-F503 HydrophobicContact CD2-CE1 3.48Å; W412-F503 VanDerWaalsContact CD2-CE1 3.48Å; W412-F503 AromaticContact CD2-CZ 3.91Å; W412-F503 HydrophobicContact CD2-CZ 3.91Å; W412-F503 AromaticContact CE2-CE1 3.49Å; W412-F503 VanDerWaalsContact CE2-CE1 3.49Å; W412-F503 AromaticContact CE2-CZ 3.87Å; W412-F503 AromaticContact CE3-CE1 3.65Å; W412-F503 HydrophobicContact CE3-CE1 3.65Å; W412-F503 HydrophobicContact CE3-CZ 4.47Å; W412-F503 HydrophobicContact CG-CE1 4.04Å; W412-F503 AromaticContact CG-CZ 3.98Å; W412-F503 HydrophobicContact CG-CZ 3.98Å; W412-F503 HydrophobicContact CH2-CD1 4.34Å; W412-F503 AromaticContact CH2-CE1 3.83Å; W412-F503 HydrophobicContact CH2-CE1 3.83Å; W412-F503 HydrophobicContact CZ2-CD1 4.49Å; W412-F503 AromaticContact CZ2-CE1 3.67Å; W412-F503 HydrophobicContact CZ2-CE1 3.67Å; W412-F503 HydrophobicContact CZ2-CZ 4.39Å; W412-F503 HydrophobicContact CZ3-CD1 4.36Å; W412-F503 AromaticContact CZ3-CE1 3.82Å; W412-F503 HydrophobicContact CZ3-CE1 3.82Å; W412-F503 AromaticContact NE1-CZ 3.91Å; W412-L504 HydrophobicContact CH2-CD2 3.98Å; W412-Q507 HydrophobicContact CZ2-CB 4.5Å; W412-Q507 HydrophobicContact CZ2-CG 4.24Å; W412-W529 AromaticContact CH2-CH2 3.38Å; W412-W529 HydrophobicContact CH2-CH2 3.38Å; W412-W529 HydrophobicContact CH2-CZ2 4.31Å; W412-W529 AromaticContact CH2-CZ3 3.82Å; W412-W529 HydrophobicContact CH2-CZ3 3.82Å; W412-W529 AromaticContact CZ2-CH2 3.4Å; W412-W529 HydrophobicContact CZ2-CH2 3.4Å; W412-W529 VanDerWaalsContact CZ2-CH2 3.4Å; W412-W529 AromaticContact CZ2-CZ2 3.92Å; W412-W529 HydrophobicContact CZ2-CZ2 3.92Å; W412-W529 HydrophobicContact CZ2-CZ3 4.26Å; W412-W529 HydrophobicContact CZ3-CH2 4.43Å
413	V	93.1	Very high	87.6	Confident	78 Å²	78	52.8 Å²	52.8	47%	0.473	27%	0.272	S	S	.	.	H	α-helix	trans	-60.5	-44	176.8	171.1	0	0	0	0	111.4	W409 P410 L416 L417	W409-V413 HydrophobicContact CE3-CG2 3.74Å; W409-V413 HydrophobicContact CZ3-CG2 3.97Å; W409-V413 WeakPolarHBondContact O-CG2 3.36Å; W409-V413 PolarHBondContact O-N 2.92Å; P410-V413 PolarHBondContact O-N 3.05Å; V413-L416 PolarHBondContact O-N 3.3Å; V413-L417 WeakPolarHBondContact O-CB 3.17Å; V413-L417 PolarHBondContact O-N 3.28Å
414	C	94.3	Very high	89	Confident	55 Å²	55	53.2 Å²	53.2	37%	0.372	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-45.9	176.7	-68.8	0	0	0	0	112.5	L381 P410 A411 W412 L417 M418	L381-C414 HydrophobicContact CD2-CB 3.98Å; P410-C414 PolarHBondContact O-N 3.45Å; P410-C414 PolarHBondContact O-SG 2.86Å; P410-C414 VanDerWaalsContact O-SG 3.34Å; A411-C414 PolarHBondContact O-N 2.97Å; W412-C414 VanDerWaalsContact C-N 3.35Å; W412-C414 PolarHBondContact O-N 3.16Å; C414-L417 PolarHBondContact O-N 3Å; C414-M418 WeakPolarHBondContact O-CG 3.25Å; C414-M418 PolarHBondContact O-N 3.44Å; C414-M418 VanDerWaalsContact O-N 3.09Å
415	V	94.9	Very high	90.3	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-68.4	-43.1	-179.7	173.8	0	0	0	0	111	L381 A411 W412 L417 M418 E419 L500 F503	L381-V415 HydrophobicContact CD1-CG2 4.18Å; A411-V415 WeakPolarHBondContact O-CG2 3.33Å; A411-V415 PolarHBondContact O-N 3.05Å; W412-V415 PolarHBondContact O-N 3.05Å; V415-L417 VanDerWaalsContact C-N 3.28Å; V415-L417 PolarHBondContact O-N 3.37Å; V415-M418 WeakPolarHBondContact O-CB 3.45Å; V415-M418 PolarHBondContact O-N 3.3Å; V415-M418 VanDerWaalsContact O-N 3.09Å; V415-E419 WeakPolarHBondContact O-CG 3.34Å; V415-E419 PolarHBondContact O-N 3.42Å; V415-L500 HydrophobicContact CG1-CB 4.28Å; V415-L500 HydrophobicContact CG1-CD1 3.72Å; V415-F503 HydrophobicContact CB-CD1 4.23Å; V415-F503 HydrophobicContact CB-CE1 4.47Å; V415-F503 HydrophobicContact CB-CG 4.47Å; V415-F503 HydrophobicContact CG1-CD1 4.07Å; V415-F503 HydrophobicContact CG1-CG 4.4Å; V415-F503 HydrophobicContact CG2-CB 4.17Å; V415-F503 HydrophobicContact CG2-CD1 3.97Å; V415-F503 HydrophobicContact CG2-CD2 3.91Å; V415-F503 HydrophobicContact CG2-CE1 4.32Å; V415-F503 HydrophobicContact CG2-CE2 4.29Å; V415-F503 HydrophobicContact CG2-CG 3.74Å; V415-F503 HydrophobicContact CG2-CZ 4.48Å
416	L	94.8	Very high	91.3	Very high	91 Å²	91	53 Å²	53	48%	0.476	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-36.5	175.7	-70.4	172.1	0	0	0	112	W412 V413 E419 I420	W412-L416 WeakPolarHBondContact O-CB 3.47Å; W412-L416 WeakPolarHBondContact O-CG 3.33Å; W412-L416 PolarHBondContact O-N 3.39Å; V413-L416 PolarHBondContact O-N 3.3Å; L416-E419 PolarHBondContact O-N 3.4Å; L416-I420 VanDerWaalsContact O-CG1 3.25Å; L416-I420 WeakPolarHBondContact O-CG1 3.49Å; L416-I420 PolarHBondContact O-N 3.17Å
417	L	96.3	Very high	92.3	Very high	105 Å²	105	52.3 Å²	52.3	55%	0.55	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-42.2	173.2	-179.3	65.4	0	0	0	111.5	V413 C414 V415 E419 I420 V421	V413-L417 WeakPolarHBondContact O-CB 3.17Å; V413-L417 PolarHBondContact O-N 3.28Å; C414-L417 PolarHBondContact O-N 3Å; V415-L417 VanDerWaalsContact C-N 3.28Å; V415-L417 PolarHBondContact O-N 3.37Å; L417-E419 VanDerWaalsContact C-N 3.32Å; L417-E419 PolarHBondContact O-N 3.41Å; L417-I420 PolarHBondContact O-N 3.17Å; L417-V421 WeakPolarHBondContact O-CG2 3.42Å; L417-V421 PolarHBondContact O-N 2.8Å
418	M	96.1	Very high	93.4	Very high	45 Å²	45	56.3 Å²	56.3	22%	0.222	29%	0.293	C	S	.	.	H	α-helix	trans	-62	-40.9	175.1	-67.6	177.2	66.9	0	0	111.6	V377 C414 V415 V421 W422 I496 V499	V377-M418 HydrophobicContact CG1-CE 4.4Å; V377-M418 HydrophobicContact CG1-SD 4.31Å; C414-M418 WeakPolarHBondContact O-CG 3.25Å; C414-M418 PolarHBondContact O-N 3.44Å; C414-M418 VanDerWaalsContact O-N 3.09Å; V415-M418 WeakPolarHBondContact O-CB 3.45Å; V415-M418 PolarHBondContact O-N 3.3Å; V415-M418 VanDerWaalsContact O-N 3.09Å; M418-V421 WeakPolarHBondContact O-CB 3.32Å; M418-V421 PolarHBondContact O-N 2.93Å; M418-W422 PolarHBondContact O-N 3.38Å; M418-I496 HydrophobicContact CB-CG2 3.9Å; M418-I496 HydrophobicContact CE-CG2 4.33Å; M418-V499 HydrophobicContact CE-CB 4.21Å; M418-V499 HydrophobicContact CE-CG1 4.12Å; M418-V499 HydrophobicContact CE-CG2 4.1Å; M418-V499 HydrophobicContact SD-CG1 4.25Å
419	E	95.6	Very high	94.1	Very high	12 Å²	12	57.9 Å²	57.9	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-38.6	175.9	-66.7	-57.4	132.8	0	0	112.5	V415 L416 L417 V421 W422 L423 N497 L500	V415-E419 WeakPolarHBondContact O-CG 3.34Å; V415-E419 PolarHBondContact O-N 3.42Å; L416-E419 PolarHBondContact O-N 3.4Å; L417-E419 VanDerWaalsContact C-N 3.32Å; L417-E419 PolarHBondContact O-N 3.41Å; E419-V421 VanDerWaalsContact C-N 3.33Å; E419-V421 PolarHBondContact O-N 3.24Å; E419-W422 WeakPolarHBondContact O-CB 3.32Å; E419-W422 PolarHBondContact O-N 3.26Å; E419-L423 WeakPolarHBondContact O-CG 3.34Å; E419-L423 PolarHBondContact O-N 3.21Å; E419-N497 PolarHBondContact OE1-OD1 3.31Å; E419-N497 PolarHBondContact OE2-OD1 3.34Å; E419-N497 VanDerWaalsContact OE2-OD1 3.11Å; E419-L500 HydrophobicContact CG-CB 4.42Å; E419-L500 HydrophobicContact CG-CD2 4.01Å; E419-L500 WeakPolarHBondContact OE1-CB 3.44Å
420	I	96.4	Very high	94.5	Very high	97 Å²	97	55 Å²	55	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-44.2	172.3	-70.3	163.8	0	0	0	110	L416 L417 W422 L423 C424	L416-I420 VanDerWaalsContact O-CG1 3.25Å; L416-I420 WeakPolarHBondContact O-CG1 3.49Å; L416-I420 PolarHBondContact O-N 3.17Å; L417-I420 PolarHBondContact O-N 3.17Å; I420-W422 VanDerWaalsContact C-N 3.32Å; I420-W422 PolarHBondContact O-N 3.04Å; I420-L423 PolarHBondContact O-N 3.25Å; I420-C424 WeakPolarHBondContact O-CB 3.33Å; I420-C424 PolarHBondContact O-N 2.66Å; I420-C424 PolarHBondContact O-SG 3.47Å
421	V	96.3	Very high	94.6	Very high	66 Å²	66	53.7 Å²	53.7	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175.2	170.7	0	0	0	0	110.8	L417 M418 E419 C424 L425	L417-V421 WeakPolarHBondContact O-CG2 3.42Å; L417-V421 PolarHBondContact O-N 2.8Å; M418-V421 WeakPolarHBondContact O-CB 3.32Å; M418-V421 PolarHBondContact O-N 2.93Å; E419-V421 VanDerWaalsContact C-N 3.33Å; E419-V421 PolarHBondContact O-N 3.24Å; V421-C424 PolarHBondContact O-N 2.97Å; V421-L425 HydrophobicContact CG1-CD1 3.85Å; V421-L425 HydrophobicContact CG1-CG 4.26Å; V421-L425 WeakPolarHBondContact O-CB 3.39Å; V421-L425 VanDerWaalsContact O-CG 3.3Å; V421-L425 WeakPolarHBondContact O-CG 3.39Å; V421-L425 PolarHBondContact O-N 3.03Å
422	W	96.1	Very high	94.6	Very high	4 Å²	4	57 Å²	57	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-46.6	175.8	-178.6	91.2	0	0	0	112.1	M418 E419 I420 L425 T426 L493 I496 N497 I550 L559	M418-W422 PolarHBondContact O-N 3.38Å; E419-W422 WeakPolarHBondContact O-CB 3.32Å; E419-W422 PolarHBondContact O-N 3.26Å; I420-W422 VanDerWaalsContact C-N 3.32Å; I420-W422 PolarHBondContact O-N 3.04Å; W422-L425 PolarHBondContact O-N 3.4Å; W422-T426 HydrophobicContact CH2-CG2 4.34Å; W422-T426 HydrophobicContact CZ2-CG2 4.44Å; W422-T426 VanDerWaalsContact O-CB 3.25Å; W422-T426 WeakPolarHBondContact O-CB 3.37Å; W422-T426 PolarHBondContact O-N 3.33Å; W422-T426 PolarHBondContact O-OG1 3.32Å; W422-L493 VanDerWaalsContact CD1-O 3.25Å; W422-L493 HydrophobicContact CG-CD1 4.32Å; W422-I496 HydrophobicContact CB-CB 4.46Å; W422-I496 HydrophobicContact CB-CD1 4.39Å; W422-I496 HydrophobicContact CB-CG2 4Å; W422-N497 WeakPolarHBondContact CZ2-ND2 3.4Å; W422-N497 PolarHBondContact NE1-ND2 3.36Å; W422-I550 HydrophobicContact CZ3-CD1 4.35Å; W422-L559 HydrophobicContact CH2-CB 4.31Å; W422-L559 HydrophobicContact CZ3-CB 3.86Å
423	L	95.9	Very high	94.3	Very high	58 Å²	58	62.8 Å²	62.8	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-61.5	-45.6	176.5	-72.4	169.8	0	0	0	111.3	E419 I420 T426 F427 I550 L559	E419-L423 WeakPolarHBondContact O-CG 3.34Å; E419-L423 PolarHBondContact O-N 3.21Å; I420-L423 PolarHBondContact O-N 3.25Å; L423-T426 PolarHBondContact O-N 3.06Å; L423-F427 HydrophobicContact CD2-CD2 4.19Å; L423-F427 HydrophobicContact CD2-CE2 3.91Å; L423-F427 WeakPolarHBondContact O-CB 3.22Å; L423-F427 WeakPolarHBondContact O-CD2 3.47Å; L423-F427 PolarHBondContact O-N 3.49Å; L423-I550 HydrophobicContact CD2-CD1 4.11Å; L423-L559 HydrophobicContact CD2-CD2 4.35Å
424	C	96.3	Very high	94.3	Very high	56 Å²	56	60 Å²	60	38%	0.378	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-47.5	177.3	-72.3	0	0	0	0	111.7	I420 V421 T426 L428	I420-C424 WeakPolarHBondContact O-CB 3.33Å; I420-C424 PolarHBondContact O-N 2.66Å; I420-C424 PolarHBondContact O-SG 3.47Å; V421-C424 PolarHBondContact O-N 2.97Å; C424-T426 VanDerWaalsContact C-N 3.31Å; C424-T426 PolarHBondContact O-N 2.92Å; C424-L428 HydrophobicContact CB-CD1 3.93Å; C424-L428 WeakPolarHBondContact O-CA 3.43Å; C424-L428 WeakPolarHBondContact O-CB 3.2Å; C424-L428 PolarHBondContact O-N 3.32Å
425	L	95.4	Very high	94.2	Very high	58 Å²	58	60 Å²	60	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-64.8	-37.4	178	-70.8	175.1	0	0	0	112.1	V421 W422 L429 A457 L493	V421-L425 HydrophobicContact CG1-CD1 3.85Å; V421-L425 HydrophobicContact CG1-CG 4.26Å; V421-L425 WeakPolarHBondContact O-CB 3.39Å; V421-L425 VanDerWaalsContact O-CG 3.3Å; V421-L425 WeakPolarHBondContact O-CG 3.39Å; V421-L425 PolarHBondContact O-N 3.03Å; W422-L425 PolarHBondContact O-N 3.4Å; L425-L429 WeakPolarHBondContact O-CB 3.5Å; L425-A457 WeakPolarHBondContact O-CB 3.44Å; L425-L493 HydrophobicContact CB-CD1 4Å; L425-L493 HydrophobicContact CD1-CD1 3.84Å
426	T	94.3	Very high	94	Very high	8 Å²	8	64.3 Å²	64.3	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-70.9	-41.9	-178.7	-58.7	0	0	0	0	111.9	W422 L423 C424 L439	W422-T426 HydrophobicContact CH2-CG2 4.34Å; W422-T426 HydrophobicContact CZ2-CG2 4.44Å; W422-T426 VanDerWaalsContact O-CB 3.25Å; W422-T426 WeakPolarHBondContact O-CB 3.37Å; W422-T426 PolarHBondContact O-N 3.33Å; W422-T426 PolarHBondContact O-OG1 3.32Å; L423-T426 PolarHBondContact O-N 3.06Å; C424-T426 VanDerWaalsContact C-N 3.31Å; C424-T426 PolarHBondContact O-N 2.92Å; T426-L439 HydrophobicContact CG2-CD2 3.42Å; T426-L439 VanDerWaalsContact CG2-CD2 3.42Å
427	F	95.1	Very high	93.8	Very high	72 Å²	72	61 Å²	61	32%	0.316	35%	0.347	S	S	.	.	H	α-helix	trans	-105	-18	-170.9	-69.9	-71.8	0	0	0	115.8	L423 T436 L439 I550	L423-F427 HydrophobicContact CD2-CD2 4.19Å; L423-F427 HydrophobicContact CD2-CE2 3.91Å; L423-F427 WeakPolarHBondContact O-CB 3.22Å; L423-F427 WeakPolarHBondContact O-CD2 3.47Å; L423-F427 PolarHBondContact O-N 3.49Å; F427-T436 WeakPolarHBondContact O-CG2 3.33Å; F427-L439 HydrophobicContact CE1-CD1 4.26Å; F427-L439 HydrophobicContact CZ-CD1 4.1Å; F427-I550 HydrophobicContact CE2-CD1 3.94Å; F427-I550 HydrophobicContact CE2-CG1 4.35Å; F427-I550 HydrophobicContact CZ-CD1 4.05Å; F427-I550 HydrophobicContact CZ-CG1 3.94Å
428	L	94.8	Very high	93.7	Very high	123 Å²	123	57 Å²	57	64%	0.644	33%	0.325	S	S	*	.	H	α-helix	trans	-113.3	-15.8	-176	-57.5	162.9	0	0	0	113.3	C424 P430	C424-L428 HydrophobicContact CB-CD1 3.93Å; C424-L428 WeakPolarHBondContact O-CA 3.43Å; C424-L428 WeakPolarHBondContact O-CB 3.2Å; C424-L428 PolarHBondContact O-N 3.32Å; L428-P430 VanDerWaalsContact O-CD 3.27Å; L428-P430 WeakPolarHBondContact O-CD 3.34Å
429	L	93.9	Very high	93.5	Very high	50 Å²	50	56.1 Å²	56.1	26%	0.262	32%	0.32	S	S	.	.			trans	-72.3	118.6	-179.9	-173.8	71.8	0	0	0	110.3	L425 V431 A457 Y460 I461	L425-L429 WeakPolarHBondContact O-CB 3.5Å; L429-V431 PolarHBondContact O-N 3.46Å; L429-A457 HydrophobicContact CB-CB 4.4Å; L429-A457 HydrophobicContact CD2-CB 4.15Å; L429-Y460 HydrophobicContact CD2-CD1 4.39Å; L429-I461 HydrophobicContact CD2-CD1 3.93Å; L429-I461 HydrophobicContact CD2-CG1 3.96Å
430	P	92.9	Very high	93.3	Very high	97 Å²	97	56 Å²	56	63%	0.63	32%	0.323	S	S	*	.			trans	-73.4	121.8	174.9	29.5	-32.8	0	0	0	109.8	L428	L428-P430 VanDerWaalsContact O-CD 3.27Å; L428-P430 WeakPolarHBondContact O-CD 3.34Å
431	V	91.8	Very high	93	Very high	16 Å²	16	51.7 Å²	51.7	10%	0.097	30%	0.301	C	S	.	.			trans	-105.2	133.1	174.8	179.1	0	0	0	0	107.8	L429 D433 C434 A457 Y460	L429-V431 PolarHBondContact O-N 3.46Å; V431-D433 PolarHBondContact O-N 2.81Å; V431-C434 HydrophobicContact CB-CB 4.06Å; V431-C434 HydrophobicContact CG1-CB 4.03Å; V431-C434 PolarHBondContact O-N 3.17Å; V431-A457 HydrophobicContact CG2-CB 4.25Å; V431-Y460 HydrophobicContact CG1-CD2 3.99Å; V431-Y460 HydrophobicContact CG1-CG 3.98Å; V431-Y460 HydrophobicContact CG2-CD1 4.35Å; V431-Y460 HydrophobicContact CG2-CG 4.24Å
432	P	89.5	Confident	92.8	Very high	73 Å²	73	48.6 Å²	48.6	47%	0.474	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	137.7	178.8	24.7	-34.1	0	0	0	110.7	C434 Y460	P432-C434 PolarHBondContact O-N 2.79Å; P432-C434 VanDerWaalsContact O-N 3.12Å; P432-C434 PolarHBondContact O-SG 3.31Å; P432-C434 VanDerWaalsContact O-SG 3.36Å; P432-Y460 HydrophobicContact CG-CE2 3.95Å
433	D	87.3	Confident	92.5	Very high	153 Å²	153	48.6 Å²	48.6	82%	0.818	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	11.8	177	-49	-47.9	0	0	0	116	V431 C453	V431-D433 PolarHBondContact O-N 2.81Å; D433-C453 PolarHBondContact O-SG 3.39Å; D433-C453 VanDerWaalsContact O-SG 3.37Å
434	C	91.4	Very high	92.3	Very high	21 Å²	21	47.1 Å²	47.1	14%	0.142	28%	0.276	C	S	.	.	S	Bend	trans	-127.3	145.8	-178.7	-52.6	0	0	0	0	111.3	V431 P432 C453	V431-C434 HydrophobicContact CB-CB 4.06Å; V431-C434 HydrophobicContact CG1-CB 4.03Å; V431-C434 PolarHBondContact O-N 3.17Å; P432-C434 PolarHBondContact O-N 2.79Å; P432-C434 VanDerWaalsContact O-N 3.12Å; P432-C434 PolarHBondContact O-SG 3.31Å; P432-C434 VanDerWaalsContact O-SG 3.36Å; C434-C453 WeakPolarHBondContact CA-SG 3.42Å; C434-C453 HydrophobicContact CB-CB 3.86Å; C434-C453 WeakPolarHBondContact CB-SG 3.3Å; C434-C453 WeakPolarHBondContact SG-CA 3.46Å; C434-C453 WeakPolarHBondContact SG-CB 3.24Å; C434-C453 CovalentContact SG-SG 2.02Å; C434-C453 PolarHBondContact SG-SG 3.19Å
435	P	92.3	Very high	91.9	Very high	55 Å²	55	44.5 Å²	44.5	36%	0.357	26%	0.258	S	S	.	.			trans	-67.9	143	175	27.9	-30.5	0	0	0	109.7	G437 Y438 H450	P435-G437 PolarHBondContact O-N 3.3Å; P435-Y438 HydrophobicContact CG-CD2 3.8Å; P435-Y438 HydrophobicContact CG-CG 4.2Å; P435-Y438 WeakPolarHBondContact O-CB 3.47Å; P435-Y438 PolarHBondContact O-N 2.78Å; P435-H450 VanDerWaalsContact CD-CE1 3.44Å; P435-H450 WeakPolarHBondContact CD-CE1 3.29Å; P435-H450 WeakPolarHBondContact CG-NE2 3.31Å
436	T	92	Very high	91.6	Very high	91 Å²	91	43.5 Å²	43.5	56%	0.558	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	130.4	177.9	-42.3	0	0	0	0	109.8	F427	F427-T436 WeakPolarHBondContact O-CG2 3.33Å
437	G	90.6	Very high	91.4	Very high	20 Å²	20	48.8 Å²	48.8	21%	0.206	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	16.1	-176.9	0	0	0	0	0	115.5	P435 L439	P435-G437 PolarHBondContact O-N 3.3Å; G437-L439 PolarHBondContact O-N 3.12Å
438	Y	92.6	Very high	91	Very high	22 Å²	22	46.3 Å²	46.3	9%	0.086	27%	0.274	C	S	.	.			trans	-63.2	122.8	176.2	-170	-109.1	0	0	0	112.8	P435 G440 G442 D446 H450 C453 G456	P435-Y438 HydrophobicContact CG-CD2 3.8Å; P435-Y438 HydrophobicContact CG-CG 4.2Å; P435-Y438 WeakPolarHBondContact O-CB 3.47Å; P435-Y438 PolarHBondContact O-N 2.78Å; Y438-G440 VanDerWaalsContact CE1-C 3.48Å; Y438-G440 VanDerWaalsContact CE1-O 3.22Å; Y438-G440 WeakPolarHBondContact CE1-O 3.4Å; Y438-G440 VanDerWaalsContact CZ-CA 3.41Å; Y438-G440 WeakPolarHBondContact OH-CA 3.5Å; Y438-G442 WeakPolarHBondContact OH-CA 3.44Å; Y438-G442 PolarHBondContact OH-N 3.34Å; Y438-D446 WeakPolarHBondContact CE2-OD2 3.44Å; Y438-D446 VanDerWaalsContact CZ-OD2 3.27Å; Y438-D446 PolarHBondContact OH-OD2 3.43Å; Y438-H450 HydrophobicContact CE2-CB 4.23Å; Y438-H450 AromaticContact CE2-CD2 3.76Å; Y438-C453 HydrophobicContact CD1-CB 3.73Å; Y438-C453 VanDerWaalsContact CD1-O 3.24Å; Y438-C453 WeakPolarHBondContact CD1-O 3.46Å; Y438-C453 HydrophobicContact CE1-CB 3.68Å; Y438-C453 WeakPolarHBondContact CE1-O 3.47Å; Y438-G456 WeakPolarHBondContact O-CA 3.31Å
439	L	92.4	Very high	90.7	Very high	26 Å²	26	46.9 Å²	46.9	14%	0.136	28%	0.276	C	S	.	.			trans	-111.5	3.1	176.8	-58.9	177.7	0	0	0	113	W291 T426 F427 G437 L556	W291-L439 PolarHBondContact NE1-O 2.87Å; T426-L439 HydrophobicContact CG2-CD2 3.42Å; T426-L439 VanDerWaalsContact CG2-CD2 3.42Å; F427-L439 HydrophobicContact CE1-CD1 4.26Å; F427-L439 HydrophobicContact CZ-CD1 4.1Å; G437-L439 PolarHBondContact O-N 3.12Å; L439-L556 HydrophobicContact CB-CD1 4.03Å; L439-L556 HydrophobicContact CD2-CD1 4.04Å; L439-L556 WeakPolarHBondContact O-CD1 3.12Å
440	G	91.3	Very high	90.5	Very high	11 Å²	11	46.2 Å²	46.2	11%	0.113	27%	0.272	C	S	.	.	S	Bend	trans	-79.9	168.5	-171.3	0	0	0	0	0	114.3	W291 Y438 G442 G455	W291-G440 VanDerWaalsContact CZ2-O 3.24Å; W291-G440 WeakPolarHBondContact CZ2-O 3.38Å; Y438-G440 VanDerWaalsContact CE1-C 3.48Å; Y438-G440 VanDerWaalsContact CE1-O 3.22Å; Y438-G440 WeakPolarHBondContact CE1-O 3.4Å; Y438-G440 VanDerWaalsContact CZ-CA 3.41Å; Y438-G440 WeakPolarHBondContact OH-CA 3.5Å; G440-G442 VanDerWaalsContact C-N 3.28Å; G440-G442 PolarHBondContact O-N 2.9Å; G440-G455 PolarHBondContact O-N 3.08Å; G440-G455 VanDerWaalsContact O-N 3.13Å
441	P	91.1	Very high	90.3	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.039	26%	0.258	C	S	.	.			trans	-74.8	-15.5	178.9	27.3	-29.3	0	0	0	113.1	W291 T454 Y481 T483	W291-P441 HydrophobicContact CB-CB 4.26Å; W291-P441 HydrophobicContact CB-CG 4.44Å; W291-P441 HydrophobicContact CD2-CB 3.6Å; W291-P441 HydrophobicContact CD2-CG 4.38Å; W291-P441 HydrophobicContact CE3-CB 3.99Å; W291-P441 HydrophobicContact CG-CB 3.74Å; W291-P441 HydrophobicContact CG-CG 4.04Å; W291-P441 HydrophobicContact CZ2-CB 4.46Å; P441-T454 VanDerWaalsContact O-CA 3.3Å; P441-T454 WeakPolarHBondContact O-CA 3.4Å; P441-T454 VanDerWaalsContact O-CB 3.27Å; P441-T454 WeakPolarHBondContact O-CB 3.24Å; P441-T454 VanDerWaalsContact O-CG2 3.31Å; P441-T454 WeakPolarHBondContact O-CG2 3.41Å; P441-T454 PolarHBondContact O-OG1 3.5Å; P441-Y481 HydrophobicContact CB-CD1 4.12Å; P441-Y481 HydrophobicContact CB-CD2 3.92Å; P441-Y481 HydrophobicContact CB-CE1 4.5Å; P441-Y481 HydrophobicContact CB-CE2 4.33Å; P441-Y481 HydrophobicContact CB-CG 3.8Å; P441-Y481 HydrophobicContact CG-CD1 3.36Å; P441-Y481 HydrophobicContact CG-CD2 3.87Å; P441-Y481 HydrophobicContact CG-CE1 3.45Å; P441-Y481 VanDerWaalsContact CG-CE1 3.45Å; P441-Y481 HydrophobicContact CG-CE2 3.96Å; P441-Y481 HydrophobicContact CG-CG 3.57Å; P441-T483 HydrophobicContact CB-CG2 4.44Å; P441-T483 WeakPolarHBondContact O-CG2 3.25Å
442	G	90.7	Very high	90.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.275	C	S	.	.			trans	66.8	-149.8	-168.1	0	0	0	0	0	112.2	Y438 G440 I444 G445 H450	Y438-G442 WeakPolarHBondContact OH-CA 3.44Å; Y438-G442 PolarHBondContact OH-N 3.34Å; G440-G442 VanDerWaalsContact C-N 3.28Å; G440-G442 PolarHBondContact O-N 2.9Å; G442-I444 PolarHBondContact O-N 2.99Å; G442-G445 PolarHBondContact O-N 3.06Å; G442-H450 WeakPolarHBondContact CA-O 3.33Å
443	G	90.4	Very high	90.3	Very high	4 Å²	4	44.1 Å²	44.1	4%	0.041	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	-128.6	-178	0	0	0	0	0	112.7	G445 T451 Y481	G443-G445 VanDerWaalsContact C-N 3.32Å; G443-T451 PolarHBondContact N-O 2.98Å; G443-T451 VanDerWaalsContact N-O 3.12Å; G443-Y481 WeakPolarHBondContact CA-O 3.35Å
444	I	91.2	Very high	90.6	Very high	28 Å²	28	36.9 Å²	36.9	14%	0.144	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.5	178.6	65.5	169.1	0	0	0	113.6	C102 L103 Q105 G442 G448 Y481 A482	C102-I444 VanDerWaalsContact CA-O 3.27Å; C102-I444 WeakPolarHBondContact CA-O 3.19Å; C102-I444 HydrophobicContact CB-CD1 4.18Å; C102-I444 HydrophobicContact CB-CG1 4.22Å; L103-I444 HydrophobicContact CB-CB 4.46Å; L103-I444 PolarHBondContact N-O 3.23Å; Q105-I444 HydrophobicContact CG-CD1 3.92Å; G442-I444 PolarHBondContact O-N 2.99Å; I444-G448 PolarHBondContact O-N 3.38Å; I444-Y481 WeakPolarHBondContact CG1-O 3.47Å; I444-Y481 PolarHBondContact N-O 3.39Å; I444-A482 HydrophobicContact CG1-CB 4.47Å; I444-A482 HydrophobicContact CG2-CB 4.16Å
445	G	89.6	Confident	90.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-68.8	165.5	174	0	0	0	0	0	112.2	G442 G443 M447 G448	G442-G445 PolarHBondContact O-N 3.06Å; G443-G445 VanDerWaalsContact C-N 3.32Å; G445-M447 PolarHBondContact O-N 3.14Å; G445-G448 WeakPolarHBondContact O-CA 3.44Å; G445-G448 PolarHBondContact O-N 3.22Å
446	D	89.2	Confident	90.6	Very high	38 Å²	38	33.3 Å²	33.3	20%	0.203	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	49.9	44.4	-177.4	-51.9	-52.3	0	0	0	112.4	Q101 Y438 G448 L449	Q101-D446 PolarHBondContact O-N 2.89Å; Y438-D446 WeakPolarHBondContact CE2-OD2 3.44Å; Y438-D446 VanDerWaalsContact CZ-OD2 3.27Å; Y438-D446 PolarHBondContact OH-OD2 3.43Å; D446-G448 PolarHBondContact O-N 2.88Å; D446-G448 VanDerWaalsContact O-N 3.17Å; D446-L449 WeakPolarHBondContact O-CB 2.99Å; D446-L449 PolarHBondContact O-N 3.33Å
447	M	88.1	Confident	90.7	Very high	119 Å²	119	29.2 Å²	29.2	59%	0.586	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	58.5	23.8	-176	-54.3	-62.3	-68.8	0	0	114.2	Q101 L103 G445 L449	Q101-M447 PolarHBondContact O-N 3.42Å; L103-M447 HydrophobicContact CD2-CB 4.44Å; L103-M447 HydrophobicContact CD2-CE 4.18Å; L103-M447 WeakPolarHBondContact CD2-O 3.44Å; G445-M447 PolarHBondContact O-N 3.14Å; M447-L449 VanDerWaalsContact C-N 3.29Å; M447-L449 PolarHBondContact O-N 3.37Å
448	G	86.9	Confident	90.8	Very high	20 Å²	20	28.7 Å²	28.7	21%	0.206	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	74.3	14.3	179.5	0	0	0	0	0	114.5	I444 G445 D446 H450 T451	I444-G448 PolarHBondContact O-N 3.38Å; G445-G448 WeakPolarHBondContact O-CA 3.44Å; G445-G448 PolarHBondContact O-N 3.22Å; D446-G448 PolarHBondContact O-N 2.88Å; D446-G448 VanDerWaalsContact O-N 3.17Å; G448-H450 VanDerWaalsContact C-N 3.33Å; G448-H450 PolarHBondContact O-N 3.05Å; G448-T451 WeakPolarHBondContact O-CG2 3.27Å
449	L	88.6	Confident	90.9	Very high	135 Å²	135	27.7 Å²	27.7	71%	0.707	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.9	-175.7	-160.1	71	0	0	0	112.8	D446 M447	D446-L449 WeakPolarHBondContact O-CB 2.99Å; D446-L449 PolarHBondContact O-N 3.33Å; M447-L449 VanDerWaalsContact C-N 3.29Å; M447-L449 PolarHBondContact O-N 3.37Å
450	H	90.3	Very high	90.9	Very high	35 Å²	35	29.1 Å²	29.1	16%	0.162	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	55.2	-169.7	-59.9	-47.3	0	0	0	112.8	P435 Y438 G442 G448 N452 C453	P435-H450 VanDerWaalsContact CD-CE1 3.44Å; P435-H450 WeakPolarHBondContact CD-CE1 3.29Å; P435-H450 WeakPolarHBondContact CG-NE2 3.31Å; Y438-H450 HydrophobicContact CE2-CB 4.23Å; Y438-H450 AromaticContact CE2-CD2 3.76Å; G442-H450 WeakPolarHBondContact CA-O 3.33Å; G448-H450 VanDerWaalsContact C-N 3.33Å; G448-H450 PolarHBondContact O-N 3.05Å; H450-N452 VanDerWaalsContact C-N 3.3Å; H450-N452 PolarHBondContact O-N 3.44Å; H450-C453 HydrophobicContact CB-CB 3.9Å; H450-C453 PolarHBondContact O-N 3.35Å
451	T	88.8	Confident	91.1	Very high	57 Å²	57	30.1 Å²	30.1	35%	0.35	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.4	-170.2	63.5	0	0	0	0	114.5	G443 G448	G443-T451 PolarHBondContact N-O 2.98Å; G443-T451 VanDerWaalsContact N-O 3.12Å; G448-T451 WeakPolarHBondContact O-CG2 3.27Å
452	N	91.3	Very high	91.2	Very high	84 Å²	84	30 Å²	30	45%	0.449	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	9.4	-173.3	-62.9	-12.9	0	0	0	113.6	H450 M485	H450-N452 VanDerWaalsContact C-N 3.3Å; H450-N452 PolarHBondContact O-N 3.44Å; N452-M485 HydrophobicContact CB-CG 4.28Å; N452-M485 HydrophobicContact CB-SD 4.42Å
453	C	90.9	Very high	91.4	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.014	17%	0.168	C	C	.	.			trans	-99	21.9	-171.9	-63.8	0	0	0	0	114.3	D433 C434 Y438 H450 G455 G456	D433-C453 PolarHBondContact O-SG 3.39Å; D433-C453 VanDerWaalsContact O-SG 3.37Å; C434-C453 WeakPolarHBondContact CA-SG 3.42Å; C434-C453 HydrophobicContact CB-CB 3.86Å; C434-C453 WeakPolarHBondContact CB-SG 3.3Å; C434-C453 WeakPolarHBondContact SG-CA 3.46Å; C434-C453 WeakPolarHBondContact SG-CB 3.24Å; C434-C453 CovalentContact SG-SG 2.02Å; C434-C453 PolarHBondContact SG-SG 3.19Å; Y438-C453 HydrophobicContact CD1-CB 3.73Å; Y438-C453 VanDerWaalsContact CD1-O 3.24Å; Y438-C453 WeakPolarHBondContact CD1-O 3.46Å; Y438-C453 HydrophobicContact CE1-CB 3.68Å; Y438-C453 WeakPolarHBondContact CE1-O 3.47Å; H450-C453 HydrophobicContact CB-CB 3.9Å; H450-C453 PolarHBondContact O-N 3.35Å; C453-G455 PolarHBondContact O-N 3.47Å; C453-G456 PolarHBondContact O-N 2.9Å
454	T	91.9	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	115.9	-175.9	-57.7	0	0	0	0	112.2	W291 P441 G456 T483 F487	W291-T454 HydrophobicContact CH2-CG2 4.14Å; W291-T454 HydrophobicContact CZ3-CG2 4.35Å; P441-T454 VanDerWaalsContact O-CA 3.3Å; P441-T454 WeakPolarHBondContact O-CA 3.4Å; P441-T454 VanDerWaalsContact O-CB 3.27Å; P441-T454 WeakPolarHBondContact O-CB 3.24Å; P441-T454 VanDerWaalsContact O-CG2 3.31Å; P441-T454 WeakPolarHBondContact O-CG2 3.41Å; P441-T454 PolarHBondContact O-OG1 3.5Å; T454-G456 VanDerWaalsContact C-N 3.26Å; T454-G456 PolarHBondContact O-N 3.44Å; T454-T483 HydrophobicContact CG2-CG2 4.41Å; T454-F487 HydrophobicContact CG2-CB 3.84Å; T454-F487 HydrophobicContact CG2-CD2 4.35Å; T454-F487 HydrophobicContact CG2-CG 4.14Å
455	G	90.6	Very high	91.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.01	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	9.3	-179.6	0	0	0	0	0	115.7	G440 C453 A457 A458 G459	G440-G455 PolarHBondContact O-N 3.08Å; G440-G455 VanDerWaalsContact O-N 3.13Å; C453-G455 PolarHBondContact O-N 3.47Å; G455-A457 PolarHBondContact O-N 3.25Å; G455-A458 WeakPolarHBondContact O-CB 3.44Å; G455-A458 PolarHBondContact O-N 2.96Å; G455-A458 VanDerWaalsContact O-N 3.08Å; G455-G459 PolarHBondContact O-N 2.95Å
456	G	93.7	Very high	91.7	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	49.3	-125.2	175	0	0	0	0	0	113.7	Y438 C453 T454 A458 Y460	Y438-G456 WeakPolarHBondContact O-CA 3.31Å; C453-G456 PolarHBondContact O-N 2.9Å; T454-G456 VanDerWaalsContact C-N 3.26Å; T454-G456 PolarHBondContact O-N 3.44Å; G456-A458 VanDerWaalsContact C-N 3.33Å; G456-A458 PolarHBondContact O-N 2.64Å; G456-Y460 WeakPolarHBondContact O-CB 3.26Å; G456-Y460 PolarHBondContact O-N 2.78Å
457	A	94.4	Very high	91.8	Very high	5 Å²	5	45.4 Å²	45.4	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-38.3	179.9	0	0	0	0	0	113.1	L425 L429 V431 G455 Y460 I461	L425-A457 WeakPolarHBondContact O-CB 3.44Å; L429-A457 HydrophobicContact CB-CB 4.4Å; L429-A457 HydrophobicContact CD2-CB 4.15Å; V431-A457 HydrophobicContact CG2-CB 4.25Å; G455-A457 PolarHBondContact O-N 3.25Å; A457-Y460 PolarHBondContact O-N 3.45Å; A457-I461 VanDerWaalsContact O-CG1 3.28Å; A457-I461 WeakPolarHBondContact O-CG1 3.38Å; A457-I461 PolarHBondContact O-N 2.94Å
458	A	93.8	Very high	91.8	Very high	9 Å²	9	44.7 Å²	44.7	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-54.5	-179.9	0	0	0	0	0	110.9	G455 G456 Y460 I461 D462 F487 L493 L556	G455-A458 WeakPolarHBondContact O-CB 3.44Å; G455-A458 PolarHBondContact O-N 2.96Å; G455-A458 VanDerWaalsContact O-N 3.08Å; G456-A458 VanDerWaalsContact C-N 3.33Å; G456-A458 PolarHBondContact O-N 2.64Å; A458-Y460 VanDerWaalsContact C-N 3.27Å; A458-Y460 PolarHBondContact O-N 2.93Å; A458-I461 PolarHBondContact O-N 3.35Å; A458-D462 PolarHBondContact O-N 2.73Å; A458-F487 HydrophobicContact CB-CE2 4.44Å; A458-L493 HydrophobicContact CB-CB 4.28Å; A458-L493 HydrophobicContact CB-CD2 3.85Å; A458-L556 HydrophobicContact CB-CD2 3.73Å
459	G	92.9	Very high	91.8	Very high	1 Å²	1	49 Å²	49	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-33	179	0	0	0	0	0	112.6	G455 R463	G455-G459 PolarHBondContact O-N 2.95Å; G459-R463 WeakPolarHBondContact O-CB 3.31Å; G459-R463 VanDerWaalsContact O-CG 3.31Å; G459-R463 WeakPolarHBondContact O-CG 3.14Å; G459-R463 PolarHBondContact O-N 2.99Å; G459-R463 PolarHBondContact O-NE 3.3Å
460	Y	94.1	Very high	91.8	Very high	55 Å²	55	44.8 Å²	44.8	22%	0.216	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-47	174.9	-179	-103.8	0	0	0	112.7	L429 V431 P432 G456 A457 A458 R464	L429-Y460 HydrophobicContact CD2-CD1 4.39Å; V431-Y460 HydrophobicContact CG1-CD2 3.99Å; V431-Y460 HydrophobicContact CG1-CG 3.98Å; V431-Y460 HydrophobicContact CG2-CD1 4.35Å; V431-Y460 HydrophobicContact CG2-CG 4.24Å; P432-Y460 HydrophobicContact CG-CE2 3.95Å; G456-Y460 WeakPolarHBondContact O-CB 3.26Å; G456-Y460 PolarHBondContact O-N 2.78Å; A457-Y460 PolarHBondContact O-N 3.45Å; A458-Y460 VanDerWaalsContact C-N 3.27Å; A458-Y460 PolarHBondContact O-N 2.93Å; Y460-R464 HydrophobicContact CE1-CG 4.15Å; Y460-R464 HydrophobicContact CE2-CG 4.12Å; Y460-R464 WeakPolarHBondContact O-CB 3.3Å; Y460-R464 WeakPolarHBondContact O-CG 3.24Å; Y460-R464 PolarHBondContact O-N 3.2Å; Y460-R464 VanDerWaalsContact O-N 3.11Å; Y460-R464 PolarHBondContact OH-NE 2.92Å; Y460-R464 PolarHBondContact OH-NH2 3.19Å
461	I	94.7	Very high	91.7	Very high	33 Å²	33	43.4 Å²	43.4	17%	0.169	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-45.6	178.1	-70.9	164.1	0	0	0	110.5	L429 A457 A458 R463 R464 L465 L493	L429-I461 HydrophobicContact CD2-CD1 3.93Å; L429-I461 HydrophobicContact CD2-CG1 3.96Å; A457-I461 VanDerWaalsContact O-CG1 3.28Å; A457-I461 WeakPolarHBondContact O-CG1 3.38Å; A457-I461 PolarHBondContact O-N 2.94Å; A458-I461 PolarHBondContact O-N 3.35Å; I461-R463 PolarHBondContact O-N 3.37Å; I461-R464 PolarHBondContact O-N 2.9Å; I461-L465 WeakPolarHBondContact O-CB 3.49Å; I461-L465 PolarHBondContact O-N 2.93Å; I461-L493 HydrophobicContact CD1-CD2 4.35Å
462	D	94.1	Very high	91.7	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-46.4	-177.7	-68	-28.2	0	0	0	111.5	A458 R464 L465 L466 G491 V492	A458-D462 PolarHBondContact O-N 2.73Å; D462-R464 VanDerWaalsContact C-N 3.3Å; D462-R464 PolarHBondContact O-N 2.88Å; D462-L465 PolarHBondContact O-N 3.33Å; D462-L466 VanDerWaalsContact O-CB 3.31Å; D462-L466 WeakPolarHBondContact O-CB 3.42Å; D462-L466 PolarHBondContact O-N 2.68Å; D462-G491 WeakPolarHBondContact OD2-CA 3.25Å; D462-V492 WeakPolarHBondContact OD1-CB 3.35Å; D462-V492 WeakPolarHBondContact OD1-CG2 3.01Å; D462-V492 PolarHBondContact OD1-N 3.45Å
463	R	93.2	Very high	91.5	Very high	29 Å²	29	45.4 Å²	45.4	11%	0.109	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-36.7	176.2	-73.6	175.9	-71.1	176.3	-4.6	112.8	G459 I461 G467 E468 I471	G459-R463 WeakPolarHBondContact O-CB 3.31Å; G459-R463 VanDerWaalsContact O-CG 3.31Å; G459-R463 WeakPolarHBondContact O-CG 3.14Å; G459-R463 PolarHBondContact O-N 2.99Å; G459-R463 PolarHBondContact O-NE 3.3Å; I461-R463 PolarHBondContact O-N 3.37Å; R463-G467 WeakPolarHBondContact O-CA 3.37Å; R463-G467 PolarHBondContact O-N 2.91Å; R463-G467 VanDerWaalsContact O-N 3.12Å; R463-E468 HydrophobicContact CB-CG 4.25Å; R463-E468 HydrophobicContact CG-CG 4.14Å; R463-I471 HydrophobicContact CG-CD1 3.55Å
464	R	93.4	Very high	91.2	Very high	183 Å²	183	48.4 Å²	48.4	69%	0.691	23%	0.234	S	C	*	.	H	α-helix	trans	-76.8	-40.2	-179.6	-75.5	-68.5	-168.7	156.4	0.6	113.3	Y460 I461 D462	Y460-R464 HydrophobicContact CE1-CG 4.15Å; Y460-R464 HydrophobicContact CE2-CG 4.12Å; Y460-R464 WeakPolarHBondContact O-CB 3.3Å; Y460-R464 WeakPolarHBondContact O-CG 3.24Å; Y460-R464 PolarHBondContact O-N 3.2Å; Y460-R464 VanDerWaalsContact O-N 3.11Å; Y460-R464 PolarHBondContact OH-NE 2.92Å; Y460-R464 PolarHBondContact OH-NH2 3.19Å; I461-R464 PolarHBondContact O-N 2.9Å; D462-R464 VanDerWaalsContact C-N 3.3Å; D462-R464 PolarHBondContact O-N 2.88Å
465	L	93.8	Very high	90.9	Very high	122 Å²	122	48.5 Å²	48.5	64%	0.639	24%	0.235	S	C	*	.	H	α-helix	trans	-84.3	-41	-175.1	-170.8	67.3	0	0	0	112.2	I461 D462 V492	I461-L465 WeakPolarHBondContact O-CB 3.49Å; I461-L465 PolarHBondContact O-N 2.93Å; D462-L465 PolarHBondContact O-N 3.33Å; L465-V492 HydrophobicContact CD2-CG1 4.28Å; L465-V492 HydrophobicContact CD2-CG2 3.91Å
466	L	91.4	Very high	90.7	Very high	36 Å²	36	50.5 Å²	50.5	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-98.8	-24.4	-174.8	-56.9	173.2	0	0	0	112.4	P365 D462 H470 I471 V492	P365-L466 HydrophobicContact CG-CD1 3.38Å; D462-L466 VanDerWaalsContact O-CB 3.31Å; D462-L466 WeakPolarHBondContact O-CB 3.42Å; D462-L466 PolarHBondContact O-N 2.68Å; L466-H470 WeakPolarHBondContact O-CB 3.48Å; L466-H470 PolarHBondContact O-CD2 2.62Å; L466-I471 HydrophobicContact CB-CG2 4.09Å; L466-I471 HydrophobicContact CD1-CG2 4.12Å; L466-V492 HydrophobicContact CD1-CG2 4.11Å; L466-V492 HydrophobicContact CG-CG2 4.35Å
467	G	90.6	Very high	90.3	Very high	24 Å²	24	50.4 Å²	50.4	25%	0.247	25%	0.248	C	C	.	.			trans	89.6	149.6	-173.6	0	0	0	0	0	112.6	R463 Q469 H470	R463-G467 WeakPolarHBondContact O-CA 3.37Å; R463-G467 PolarHBondContact O-N 2.91Å; R463-G467 VanDerWaalsContact O-N 3.12Å; G467-Q469 VanDerWaalsContact C-N 3.29Å; G467-Q469 PolarHBondContact O-N 2.86Å; G467-H470 PolarHBondContact O-N 3.48Å
468	E	88.8	Confident	90	Very high	103 Å²	103	55.2 Å²	55.2	48%	0.481	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-66.6	-28.1	-175.4	-62.1	-166.8	163.8	0	0	113.6	R463 H470 I471 Q473 P486	R463-E468 HydrophobicContact CB-CG 4.25Å; R463-E468 HydrophobicContact CG-CG 4.14Å; E468-H470 VanDerWaalsContact C-N 3.34Å; E468-I471 WeakPolarHBondContact O-CG1 3.14Å; E468-Q473 PolarHBondContact O-NE2 3.03Å; E468-P486 HydrophobicContact CB-CG 4.46Å
469	Q	86.3	Confident	89.6	Confident	112 Å²	112	60.9 Å²	60.9	52%	0.523	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-78.7	-18.7	-180	-65.5	177	-8.8	0	0	113	D360 G467	D360-Q469 VanDerWaalsContact O-CB 3.3Å; D360-Q469 WeakPolarHBondContact O-CB 3.37Å; D360-Q469 PolarHBondContact O-OE1 2.92Å; G467-Q469 VanDerWaalsContact C-N 3.29Å; G467-Q469 PolarHBondContact O-N 2.86Å
470	H	87.9	Confident	89.4	Confident	46 Å²	46	62.4 Å²	62.4	21%	0.213	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-99.8	6.5	-174.3	-62.1	-63.6	0	0	0	114.2	I359 D360 L362 R363 I364 P365 L466 G467 E468	I359-H470 PolarHBondContact O-CE1 3.41Å; I359-H470 VanDerWaalsContact O-CE1 3.28Å; D360-H470 PolarHBondContact O-CE1 3.3Å; L362-H470 WeakPolarHBondContact O-CA 3.24Å; L362-H470 WeakPolarHBondContact O-CB 3.11Å; L362-H470 PolarHBondContact O-ND1 3Å; R363-H470 WeakPolarHBondContact CA-O 3.46Å; I364-H470 HydrophobicContact CD1-CB 3.94Å; I364-H470 HydrophobicContact CG1-CB 4.15Å; I364-H470 PolarHBondContact N-O 3.31Å; P365-H470 VanDerWaalsContact CD-O 3.28Å; P365-H470 WeakPolarHBondContact CD-O 3.17Å; L466-H470 WeakPolarHBondContact O-CB 3.48Å; L466-H470 PolarHBondContact O-CD2 2.62Å; G467-H470 PolarHBondContact O-N 3.48Å; E468-H470 VanDerWaalsContact C-N 3.34Å
471	I	90.1	Very high	89.2	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.026	30%	0.3	C	S	.	.	S	Bend	trans	-115.9	166.6	179.5	59.3	165.5	0	0	0	111.2	R463 L466 E468 Q473 P486 D488	R463-I471 HydrophobicContact CG-CD1 3.55Å; L466-I471 HydrophobicContact CB-CG2 4.09Å; L466-I471 HydrophobicContact CD1-CG2 4.12Å; E468-I471 WeakPolarHBondContact O-CG1 3.14Å; I471-Q473 PolarHBondContact O-N 3.46Å; I471-Q473 PolarHBondContact O-NE2 2.72Å; I471-P486 HydrophobicContact CD1-CB 3.72Å; I471-P486 HydrophobicContact CD1-CG 3.83Å; I471-P486 HydrophobicContact CG1-CB 4.07Å; I471-P486 HydrophobicContact CG1-CG 4.42Å; I471-D488 HydrophobicContact CB-CB 4.08Å; I471-D488 HydrophobicContact CG2-CB 4.34Å
472	Y	87.4	Confident	88.9	Confident	87 Å²	87	60.9 Å²	60.9	34%	0.341	31%	0.311	S	S	.	.			trans	-65.9	125.5	-179.1	-166.6	-125	0	0	0	113.6	S474 F487 D488	Y472-S474 WeakPolarHBondContact CE1-O 3.4Å; Y472-S474 PolarHBondContact OH-O 3.17Å; Y472-F487 PolarHBondContact O-N 3.18Å; Y472-F487 VanDerWaalsContact O-N 3.16Å; Y472-D488 WeakPolarHBondContact CB-OD2 3.44Å; Y472-D488 PolarHBondContact N-OD2 3.4Å
473	Q	86.9	Confident	88.6	Confident	97 Å²	97	60.9 Å²	60.9	45%	0.453	31%	0.311	S	S	.	.	S	Bend	trans	-88	-18.5	-172.4	-60.4	-56.4	-46.8	0	0	114.7	E468 I471 P475	E468-Q473 PolarHBondContact O-NE2 3.03Å; I471-Q473 PolarHBondContact O-N 3.46Å; I471-Q473 PolarHBondContact O-NE2 2.72Å; Q473-P475 VanDerWaalsContact C-CD 3.44Å; Q473-P475 WeakPolarHBondContact O-CD 3.29Å
474	S	85.1	Confident	88.3	Confident	64 Å²	64	67.5 Å²	67.5	45%	0.448	34%	0.34	S	S	.	.	S	Bend	trans	-126.9	62.2	-172.7	-64	0	0	0	0	111.7	Y472	Y472-S474 WeakPolarHBondContact CE1-O 3.4Å; Y472-S474 PolarHBondContact OH-O 3.17Å
475	P	86.4	Confident	88.1	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.019	32%	0.317	C	S	.	.			trans	-61.9	152.1	-178.1	28.4	-36	0	0	0	111.8	Q473 S477 K478 F487	Q473-P475 VanDerWaalsContact C-CD 3.44Å; Q473-P475 WeakPolarHBondContact O-CD 3.29Å; P475-S477 PolarHBondContact O-N 2.65Å; P475-S477 VanDerWaalsContact O-N 3.1Å; P475-K478 HydrophobicContact CG-CB 4.46Å; P475-K478 WeakPolarHBondContact O-CB 3.19Å; P475-K478 PolarHBondContact O-N 3.29Å; P475-F487 HydrophobicContact CB-CB 4.17Å; P475-F487 HydrophobicContact CG-CB 4.24Å
476	S	85.1	Confident	87.9	Confident	42 Å²	42	55.4 Å²	55.4	29%	0.294	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.9	179.6	-53.9	0	0	0	0	113.5	K478	S476-K478 PolarHBondContact O-N 3.49Å
477	S	85.8	Confident	87.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-24.5	174.4	50.6	0	0	0	0	113.2	S290 P475 V479 Y481 T483	S290-S477 PolarHBondContact O-N 3.01Å; P475-S477 PolarHBondContact O-N 2.65Å; P475-S477 VanDerWaalsContact O-N 3.1Å; S477-V479 VanDerWaalsContact C-N 3.28Å; S477-V479 PolarHBondContact O-N 3.02Å; S477-Y481 WeakPolarHBondContact O-CA 3.44Å; S477-Y481 WeakPolarHBondContact O-CB 3.47Å; S477-Y481 PolarHBondContact O-N 2.96Å; S477-T483 PolarHBondContact OG-OG1 3.28Å
478	K	88.7	Confident	88	Confident	105 Å²	105	52.7 Å²	52.7	46%	0.457	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-32.8	-178	-170.8	172.6	-176.5	176.3	0	113.1	P475 S476 A482 T483	P475-K478 HydrophobicContact CG-CB 4.46Å; P475-K478 WeakPolarHBondContact O-CB 3.19Å; P475-K478 PolarHBondContact O-N 3.29Å; S476-K478 PolarHBondContact O-N 3.49Å; K478-A482 VanDerWaalsContact O-CA 3.32Å; K478-A482 WeakPolarHBondContact O-CA 3.22Å; K478-A482 PolarHBondContact O-N 3Å; K478-T483 VanDerWaalsContact CA-OG1 3.29Å; K478-T483 WeakPolarHBondContact CA-OG1 3.37Å; K478-T483 PolarHBondContact N-OG1 3.32Å
479	V	85.3	Confident	88.1	Confident	129 Å²	129	48.5 Å²	48.5	78%	0.782	25%	0.251	S	S	*	.	H	α-helix	trans	-71.5	-45.5	-176.2	-179	0	0	0	0	111.8	S477	S477-V479 VanDerWaalsContact C-N 3.28Å; S477-V479 PolarHBondContact O-N 3.02Å
480	I	87.4	Confident	88.4	Confident	33 Å²	33	44.1 Å²	44.1	17%	0.169	23%	0.231	C	C	.	.	H	α-helix	trans	-93.8	-42.7	-176.2	-64.6	-166.6	0	0	0	111.9	R98 C99 S290	R98-I480 HydrophobicContact CB-CD1 4.07Å; C99-I480 HydrophobicContact CB-CG2 3.6Å; C99-I480 VanDerWaalsContact SG-CG2 3.53Å; C99-I480 PolarHBondContact SG-O 3.08Å; C99-I480 VanDerWaalsContact SG-O 3.34Å; S290-I480 WeakPolarHBondContact OG-CD1 3.3Å; S290-I480 WeakPolarHBondContact OG-CG1 3.42Å
481	Y	90.1	Very high	88.6	Confident	7 Å²	7	42.1 Å²	42.1	3%	0.027	22%	0.223	C	C	.	.	H	α-helix	trans	-98.7	4.8	-173.5	-65	-88.9	0	0	0	113.6	R98 Y100 C102 W291 P441 G443 I444 S477 T483	R98-Y481 PolarHBondContact O-OH 3.05Å; Y100-Y481 PolarHBondContact N-OH 3.31Å; C102-Y481 WeakPolarHBondContact SG-CD1 3.44Å; C102-Y481 WeakPolarHBondContact SG-CE1 3.11Å; W291-Y481 HydrophobicContact CB-CE2 3.86Å; P441-Y481 HydrophobicContact CB-CD1 4.12Å; P441-Y481 HydrophobicContact CB-CD2 3.92Å; P441-Y481 HydrophobicContact CB-CE1 4.5Å; P441-Y481 HydrophobicContact CB-CE2 4.33Å; P441-Y481 HydrophobicContact CB-CG 3.8Å; P441-Y481 HydrophobicContact CG-CD1 3.36Å; P441-Y481 HydrophobicContact CG-CD2 3.87Å; P441-Y481 HydrophobicContact CG-CE1 3.45Å; P441-Y481 VanDerWaalsContact CG-CE1 3.45Å; P441-Y481 HydrophobicContact CG-CE2 3.96Å; P441-Y481 HydrophobicContact CG-CG 3.57Å; G443-Y481 WeakPolarHBondContact CA-O 3.35Å; I444-Y481 WeakPolarHBondContact CG1-O 3.47Å; I444-Y481 PolarHBondContact N-O 3.39Å; S477-Y481 WeakPolarHBondContact O-CA 3.44Å; S477-Y481 WeakPolarHBondContact O-CB 3.47Å; S477-Y481 PolarHBondContact O-N 2.96Å; Y481-T483 PolarHBondContact O-N 3.48Å
482	A	88.9	Confident	88.7	Confident	48 Å²	48	44.5 Å²	44.5	40%	0.397	24%	0.238	S	C	.	.			trans	48.2	39.3	178	0	0	0	0	0	113.5	I444 K478	I444-A482 HydrophobicContact CG1-CB 4.47Å; I444-A482 HydrophobicContact CG2-CB 4.16Å; K478-A482 VanDerWaalsContact O-CA 3.32Å; K478-A482 WeakPolarHBondContact O-CA 3.22Å; K478-A482 PolarHBondContact O-N 3Å
483	T	88.8	Confident	89	Confident	4 Å²	4	40.7 Å²	40.7	3%	0.025	22%	0.223	C	C	.	.			trans	-67.4	138.2	-176	58.6	0	0	0	0	111.4	P441 T454 S477 K478 Y481	P441-T483 HydrophobicContact CB-CG2 4.44Å; P441-T483 WeakPolarHBondContact O-CG2 3.25Å; T454-T483 HydrophobicContact CG2-CG2 4.41Å; S477-T483 PolarHBondContact OG-OG1 3.28Å; K478-T483 VanDerWaalsContact CA-OG1 3.29Å; K478-T483 WeakPolarHBondContact CA-OG1 3.37Å; K478-T483 PolarHBondContact N-OG1 3.32Å; Y481-T483 PolarHBondContact O-N 3.48Å
484	K	85.9	Confident	89.4	Confident	167 Å²	167	36.3 Å²	36.3	73%	0.726	20%	0.204	S	C	*	.			trans	-93.6	-25.1	-178.4	-62.7	-176.8	-178.2	177.7	0	113.7
485	M	89	Confident	89.9	Confident	39 Å²	39	33.9 Å²	33.9	19%	0.192	19%	0.187	C	C	.	.	S	Bend	trans	-88.5	143.7	-174.5	-58.1	-52.1	-71.9	0	0	112.1	N452	N452-M485 HydrophobicContact CB-CG 4.28Å; N452-M485 HydrophobicContact CB-SD 4.42Å
486	P	90	Very high	90.4	Very high	13 Å²	13	35.1 Å²	35.1	8%	0.084	19%	0.193	C	C	.	.			trans	-67.8	145.8	169.3	29.6	-34.5	0	0	0	110.7	E468 I471	E468-P486 HydrophobicContact CB-CG 4.46Å; I471-P486 HydrophobicContact CD1-CB 3.72Å; I471-P486 HydrophobicContact CD1-CG 3.83Å; I471-P486 HydrophobicContact CG1-CB 4.07Å; I471-P486 HydrophobicContact CG1-CG 4.42Å
487	F	91.8	Very high	90.9	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.009	18%	0.179	C	C	.	.			trans	-152.7	131.1	-177.6	177.7	-89	0	0	0	110.2	W291 T454 A458 Y472 P475 P489 N555 L556	W291-F487 HydrophobicContact CH2-CD1 4.33Å; W291-F487 HydrophobicContact CH2-CD2 4.49Å; W291-F487 HydrophobicContact CH2-CE1 4.19Å; W291-F487 HydrophobicContact CH2-CE2 4.35Å; W291-F487 HydrophobicContact CH2-CG 4.5Å; W291-F487 HydrophobicContact CH2-CZ 4.2Å; W291-F487 HydrophobicContact CZ3-CD1 4.21Å; W291-F487 HydrophobicContact CZ3-CE1 4.26Å; T454-F487 HydrophobicContact CG2-CB 3.84Å; T454-F487 HydrophobicContact CG2-CD2 4.35Å; T454-F487 HydrophobicContact CG2-CG 4.14Å; A458-F487 HydrophobicContact CB-CE2 4.44Å; Y472-F487 PolarHBondContact O-N 3.18Å; Y472-F487 VanDerWaalsContact O-N 3.16Å; P475-F487 HydrophobicContact CB-CB 4.17Å; P475-F487 HydrophobicContact CG-CB 4.24Å; F487-P489 HydrophobicContact CE1-CB 4.33Å; F487-N555 HydrophobicContact CE1-CB 3.79Å; F487-N555 HydrophobicContact CZ-CB 4.43Å; F487-N555 WeakPolarHBondContact CZ-O 3.11Å; F487-L556 HydrophobicContact CE2-CD2 4.19Å; F487-L556 HydrophobicContact CZ-CD2 3.94Å
488	D	91.6	Very high	91.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.179	C	C	.	.			trans	-108.7	115.4	-179.7	-154.6	-58.4	0	0	0	111.7	R363 P365 I471 Y472 E490 G491	R363-D488 IonicContact CZ-OD2 2.68Å; R363-D488 IonicContact NE-OD2 3.8Å; R363-D488 PolarHBondContact NE-OD2 3.29Å; R363-D488 IonicContact NH2-OD1 3.72Å; R363-D488 PolarHBondContact NH2-OD1 3.26Å; R363-D488 IonicContact NH2-OD2 3.32Å; R363-D488 PolarHBondContact NH2-OD2 3.49Å; R363-D488 VanDerWaalsContact NH2-OD2 3.1Å; P365-D488 HydrophobicContact CG-CB 4.39Å; I471-D488 HydrophobicContact CB-CB 4.08Å; I471-D488 HydrophobicContact CG2-CB 4.34Å; Y472-D488 WeakPolarHBondContact CB-OD2 3.44Å; Y472-D488 PolarHBondContact N-OD2 3.4Å; D488-E490 PolarHBondContact O-N 3.08Å; D488-E490 WeakPolarHBondContact OD1-CA 3.4Å; D488-E490 WeakPolarHBondContact OD1-CB 3.43Å; D488-E490 PolarHBondContact OD1-N 3.12Å; D488-G491 PolarHBondContact O-N 2.92Å; D488-G491 VanDerWaalsContact O-N 3.17Å
489	P	91.6	Very high	91.9	Very high	14 Å²	14	28.1 Å²	28.1	9%	0.091	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17	177.6	26.4	-28.4	0	0	0	113	R370 F487 N555	R370-P489 PolarHBondContact NH1-O 3.33Å; R370-P489 PolarHBondContact NH2-O 3.35Å; F487-P489 HydrophobicContact CE1-CB 4.33Å; P489-N555 WeakPolarHBondContact CA-O 3.42Å; P489-N555 HydrophobicContact CB-CB 4.41Å
490	E	92.1	Very high	92.5	Very high	21 Å²	21	22.7 Å²	22.7	10%	0.098	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	11.3	175	-67.3	75.7	-142.5	0	0	113.7	R363 P365 V367 R370 D488	R363-E490 IonicContact CZ-OE2 3.55Å; R363-E490 IonicContact NH2-OE2 3.32Å; R363-E490 PolarHBondContact NH2-OE2 3.12Å; P365-E490 HydrophobicContact CB-CB 4.07Å; V367-E490 HydrophobicContact CG2-CG 4.32Å; R370-E490 VanDerWaalsContact CZ-CA 3.48Å; R370-E490 PolarHBondContact NH2-O 2.69Å; R370-E490 VanDerWaalsContact NH2-O 3.15Å; D488-E490 PolarHBondContact O-N 3.08Å; D488-E490 WeakPolarHBondContact OD1-CA 3.4Å; D488-E490 WeakPolarHBondContact OD1-CB 3.43Å; D488-E490 PolarHBondContact OD1-N 3.12Å
491	G	92	Very high	93	Very high	3 Å²	3	21.1 Å²	21.1	3%	0.031	12%	0.116	C	C	.	.			trans	-59.6	-177.7	-179.3	0	0	0	0	0	118.1	R370 D462 D488 S495	R370-G491 VanDerWaalsContact NH2-N 3.2Å; R370-G491 PolarHBondContact NH2-O 3.47Å; D462-G491 WeakPolarHBondContact OD2-CA 3.25Å; D488-G491 PolarHBondContact O-N 2.92Å; D488-G491 VanDerWaalsContact O-N 3.17Å; G491-S495 PolarHBondContact O-N 3.28Å; G491-S495 PolarHBondContact O-OG 2.96Å
492	V	93.7	Very high	93.4	Very high	56 Å²	56	20.8 Å²	20.8	34%	0.339	11%	0.114	S	C	.	.	H	α-helix	trans	-70.5	-48.9	-167.2	-179.7	0	0	0	0	111.2	D462 L465 L466 G494 S495	D462-V492 WeakPolarHBondContact OD1-CB 3.35Å; D462-V492 WeakPolarHBondContact OD1-CG2 3.01Å; D462-V492 PolarHBondContact OD1-N 3.45Å; L465-V492 HydrophobicContact CD2-CG1 4.28Å; L465-V492 HydrophobicContact CD2-CG2 3.91Å; L466-V492 HydrophobicContact CD1-CG2 4.11Å; L466-V492 HydrophobicContact CG-CG2 4.35Å; V492-G494 PolarHBondContact O-N 3.3Å; V492-S495 VanDerWaalsContact O-CB 3.26Å; V492-S495 WeakPolarHBondContact O-CB 3.47Å; V492-S495 PolarHBondContact O-N 2.65Å; V492-S495 VanDerWaalsContact O-N 3.08Å
493	L	93.8	Very high	93.8	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-66.1	-42.8	-175.1	-168.6	63.2	0	0	0	111.1	W422 L425 A458 I461 S495 I496	W422-L493 VanDerWaalsContact CD1-O 3.25Å; W422-L493 HydrophobicContact CG-CD1 4.32Å; L425-L493 HydrophobicContact CB-CD1 4Å; L425-L493 HydrophobicContact CD1-CD1 3.84Å; A458-L493 HydrophobicContact CB-CB 4.28Å; A458-L493 HydrophobicContact CB-CD2 3.85Å; I461-L493 HydrophobicContact CD1-CD2 4.35Å; L493-S495 PolarHBondContact O-N 2.86Å; L493-I496 HydrophobicContact CD1-CD1 4.21Å; L493-I496 WeakPolarHBondContact O-CB 3.29Å; L493-I496 PolarHBondContact O-N 3.09Å; L493-I496 VanDerWaalsContact O-N 3.14Å
494	G	94.4	Very high	94.2	Very high	6 Å²	6	18.6 Å²	18.6	6%	0.062	10%	0.096	C	C	.	.	H	α-helix	trans	-64.1	-20.5	174.2	0	0	0	0	0	114.1	V492 I496 N497 S498	V492-G494 PolarHBondContact O-N 3.3Å; G494-I496 VanDerWaalsContact C-N 3.28Å; G494-I496 PolarHBondContact O-N 2.98Å; G494-N497 PolarHBondContact O-N 3.4Å; G494-S498 PolarHBondContact O-N 3.09Å
495	S	95.8	Very high	94.7	Very high	13 Å²	13	10.6 Å²	10.6	9%	0.091	6%	0.061	C	C	.	.	H	α-helix	trans	-70.3	-23.8	175.6	-62.8	0	0	0	0	112.5	R370 G491 V492 L493 S498 V499	R370-S495 PolarHBondContact NE-OG 3.49Å; G491-S495 PolarHBondContact O-N 3.28Å; G491-S495 PolarHBondContact O-OG 2.96Å; V492-S495 VanDerWaalsContact O-CB 3.26Å; V492-S495 WeakPolarHBondContact O-CB 3.47Å; V492-S495 PolarHBondContact O-N 2.65Å; V492-S495 VanDerWaalsContact O-N 3.08Å; L493-S495 PolarHBondContact O-N 2.86Å; S495-S498 WeakPolarHBondContact CA-OG 3.44Å; S495-S498 PolarHBondContact O-N 3.39Å; S495-S498 PolarHBondContact O-OG 2.92Å; S495-V499 PolarHBondContact O-N 2.88Å
496	I	96.2	Very high	95	Very high	28 Å²	28	9 Å²	9	14%	0.144	5%	0.053	C	C	.	.	H	α-helix	trans	-63.1	-52.7	170.5	-63.1	177	0	0	0	110.4	M418 W422 L493 G494 S498 V499 L500	M418-I496 HydrophobicContact CB-CG2 3.9Å; M418-I496 HydrophobicContact CE-CG2 4.33Å; W422-I496 HydrophobicContact CB-CB 4.46Å; W422-I496 HydrophobicContact CB-CD1 4.39Å; W422-I496 HydrophobicContact CB-CG2 4Å; L493-I496 HydrophobicContact CD1-CD1 4.21Å; L493-I496 WeakPolarHBondContact O-CB 3.29Å; L493-I496 PolarHBondContact O-N 3.09Å; L493-I496 VanDerWaalsContact O-N 3.14Å; G494-I496 VanDerWaalsContact C-N 3.28Å; G494-I496 PolarHBondContact O-N 2.98Å; I496-S498 PolarHBondContact O-N 3.33Å; I496-V499 WeakPolarHBondContact O-CA 3.46Å; I496-V499 WeakPolarHBondContact O-CB 3.48Å; I496-V499 PolarHBondContact O-N 3.41Å; I496-L500 PolarHBondContact O-N 3.36Å
497	N	96.9	Very high	95.2	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-64.3	-26.6	-179.6	-69.7	2.5	0	0	0	112.3	E419 W422 G494 V499 L500 M501 W557 V562	E419-N497 PolarHBondContact OE1-OD1 3.31Å; E419-N497 PolarHBondContact OE2-OD1 3.34Å; E419-N497 VanDerWaalsContact OE2-OD1 3.11Å; W422-N497 WeakPolarHBondContact CZ2-ND2 3.4Å; W422-N497 PolarHBondContact NE1-ND2 3.36Å; G494-N497 PolarHBondContact O-N 3.4Å; N497-V499 VanDerWaalsContact C-N 3.32Å; N497-V499 PolarHBondContact O-N 3.11Å; N497-L500 WeakPolarHBondContact O-CB 3.31Å; N497-L500 PolarHBondContact O-N 3.16Å; N497-M501 PolarHBondContact O-N 3.1Å; N497-W557 HydrophobicContact CB-CB 4.46Å; N497-W557 WeakPolarHBondContact CB-O 3.36Å; N497-W557 PolarHBondContact ND2-O 2.91Å; N497-V562 HydrophobicContact CB-CG2 3.86Å
498	S	97.3	Very high	95.4	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-65.8	-31.1	170.1	81.9	0	0	0	0	114	V305 S374 G494 S495 I496 M501 A502	V305-S498 WeakPolarHBondContact CG1-O 3.5Å; S374-S498 WeakPolarHBondContact OG-CB 3.23Å; S374-S498 PolarHBondContact OG-OG 2.95Å; G494-S498 PolarHBondContact O-N 3.09Å; S495-S498 WeakPolarHBondContact CA-OG 3.44Å; S495-S498 PolarHBondContact O-N 3.39Å; S495-S498 PolarHBondContact O-OG 2.92Å; I496-S498 PolarHBondContact O-N 3.33Å; S498-M501 PolarHBondContact O-N 3.01Å; S498-A502 WeakPolarHBondContact O-CB 3.49Å; S498-A502 PolarHBondContact O-N 3.33Å
499	V	98	Very high	95.4	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-65.3	-43.9	172	172.1	0	0	0	0	109.3	V377 V378 M418 S495 I496 N497 M501 A502 F503	V377-V499 HydrophobicContact CB-CG1 4.31Å; V377-V499 HydrophobicContact CB-CG2 3.99Å; V377-V499 HydrophobicContact CG1-CG1 3.67Å; V377-V499 HydrophobicContact CG1-CG2 4.06Å; V377-V499 HydrophobicContact CG2-CG2 4.28Å; V378-V499 HydrophobicContact CG2-CG1 3.83Å; M418-V499 HydrophobicContact CE-CB 4.21Å; M418-V499 HydrophobicContact CE-CG1 4.12Å; M418-V499 HydrophobicContact CE-CG2 4.1Å; M418-V499 HydrophobicContact SD-CG1 4.25Å; S495-V499 PolarHBondContact O-N 2.88Å; I496-V499 WeakPolarHBondContact O-CA 3.46Å; I496-V499 WeakPolarHBondContact O-CB 3.48Å; I496-V499 PolarHBondContact O-N 3.41Å; N497-V499 VanDerWaalsContact C-N 3.32Å; N497-V499 PolarHBondContact O-N 3.11Å; V499-M501 PolarHBondContact O-N 3.06Å; V499-A502 PolarHBondContact O-N 3.27Å; V499-F503 VanDerWaalsContact O-CB 3.25Å; V499-F503 WeakPolarHBondContact O-CB 3.37Å; V499-F503 PolarHBondContact O-N 2.78Å
500	L	97.8	Very high	95.2	Very high	14 Å²	14	7.9 Å²	7.9	7%	0.073	5%	0.046	C	C	.	.	H	α-helix	trans	-58.8	-46.3	173.7	173.6	65.9	0	0	0	111.6	V415 E419 I496 N497 A502 F503 L504 L559 V562	V415-L500 HydrophobicContact CG1-CB 4.28Å; V415-L500 HydrophobicContact CG1-CD1 3.72Å; E419-L500 HydrophobicContact CG-CB 4.42Å; E419-L500 HydrophobicContact CG-CD2 4.01Å; E419-L500 WeakPolarHBondContact OE1-CB 3.44Å; I496-L500 PolarHBondContact O-N 3.36Å; N497-L500 WeakPolarHBondContact O-CB 3.31Å; N497-L500 PolarHBondContact O-N 3.16Å; L500-A502 PolarHBondContact O-N 3.32Å; L500-F503 PolarHBondContact O-N 3.06Å; L500-F503 VanDerWaalsContact O-N 3.12Å; L500-L504 HydrophobicContact CD1-CD1 4.33Å; L500-L504 HydrophobicContact CD1-CG 4.15Å; L500-L504 HydrophobicContact CG-CD1 4.23Å; L500-L504 HydrophobicContact CG-CG 4.46Å; L500-L504 WeakPolarHBondContact O-CG 3.47Å; L500-L504 PolarHBondContact O-N 3.33Å; L500-L559 HydrophobicContact CD2-CD1 3.66Å; L500-V562 HydrophobicContact CB-CG1 4.44Å; L500-V562 HydrophobicContact CD2-CG1 3.92Å; L500-V562 HydrophobicContact CG-CG1 4Å
501	M	98.1	Very high	95.1	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-59.5	-44.7	177.6	-172.6	52.7	167.1	0	0	112.3	P302 V305 F306 N497 S498 V499 F503 G505 W557 V562 L565 A566 A569	P302-M501 HydrophobicContact CB-CE 3.64Å; P302-M501 HydrophobicContact CB-CG 4.26Å; P302-M501 VanDerWaalsContact O-CE 3.32Å; P302-M501 WeakPolarHBondContact O-CE 3.43Å; V305-M501 HydrophobicContact CB-CG 4.27Å; V305-M501 HydrophobicContact CG1-CB 4.13Å; V305-M501 HydrophobicContact CG1-CG 4.17Å; F306-M501 HydrophobicContact CB-CE 3.75Å; F306-M501 HydrophobicContact CB-CG 4.41Å; F306-M501 HydrophobicContact CB-SD 4.2Å; F306-M501 HydrophobicContact CD2-CE 4.26Å; F306-M501 HydrophobicContact CD2-SD 4.17Å; F306-M501 HydrophobicContact CG-CE 4.36Å; N497-M501 PolarHBondContact O-N 3.1Å; S498-M501 PolarHBondContact O-N 3.01Å; V499-M501 PolarHBondContact O-N 3.06Å; M501-F503 VanDerWaalsContact C-N 3.32Å; M501-F503 PolarHBondContact O-N 2.81Å; M501-G505 PolarHBondContact O-N 2.7Å; M501-G505 VanDerWaalsContact O-N 3.16Å; M501-W557 HydrophobicContact CB-CZ3 4.06Å; M501-W557 HydrophobicContact CG-CZ3 4.42Å; M501-V562 HydrophobicContact CB-CG1 3.87Å; M501-V562 HydrophobicContact SD-CG1 4.2Å; M501-L565 HydrophobicContact CE-CB 3.94Å; M501-A566 HydrophobicContact CE-CB 4.3Å; M501-A566 HydrophobicContact SD-CB 3.82Å; M501-A569 HydrophobicContact CE-CB 4.39Å
502	A	98.1	Very high	95	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-64.8	-37.2	175.3	0	0	0	0	0	111.8	V305 G309 V378 S498 V499 L500 G505 L506	V305-A502 HydrophobicContact CG1-CB 3.67Å; G309-A502 VanDerWaalsContact CA-O 3.24Å; G309-A502 WeakPolarHBondContact CA-O 3.43Å; V378-A502 HydrophobicContact CB-CB 4.43Å; V378-A502 HydrophobicContact CG2-CB 3.74Å; S498-A502 WeakPolarHBondContact O-CB 3.49Å; S498-A502 PolarHBondContact O-N 3.33Å; V499-A502 PolarHBondContact O-N 3.27Å; L500-A502 PolarHBondContact O-N 3.32Å; A502-G505 CarbonylContact O-C 3.59Å; A502-G505 WeakPolarHBondContact O-CA 3.35Å; A502-G505 PolarHBondContact O-N 3.08Å; A502-L506 PolarHBondContact O-N 3.17Å
503	F	97.3	Very high	94.6	Very high	2 Å²	2	6.5 Å²	6.5	1%	0.009	4%	0.036	C	C	.	.	H	α-helix	trans	-70	-39.6	178.9	-179	-102.8	0	0	0	112.7	V378 A411 W412 V415 V499 L500 M501 G505 L506 Q507	V378-F503 HydrophobicContact CG2-CB 4.25Å; A411-F503 HydrophobicContact CB-CE2 3.75Å; A411-F503 HydrophobicContact CB-CZ 4.09Å; W412-F503 AromaticContact CD1-CZ 3.99Å; W412-F503 AromaticContact CD2-CE1 3.48Å; W412-F503 HydrophobicContact CD2-CE1 3.48Å; W412-F503 VanDerWaalsContact CD2-CE1 3.48Å; W412-F503 AromaticContact CD2-CZ 3.91Å; W412-F503 HydrophobicContact CD2-CZ 3.91Å; W412-F503 AromaticContact CE2-CE1 3.49Å; W412-F503 VanDerWaalsContact CE2-CE1 3.49Å; W412-F503 AromaticContact CE2-CZ 3.87Å; W412-F503 AromaticContact CE3-CE1 3.65Å; W412-F503 HydrophobicContact CE3-CE1 3.65Å; W412-F503 HydrophobicContact CE3-CZ 4.47Å; W412-F503 HydrophobicContact CG-CE1 4.04Å; W412-F503 AromaticContact CG-CZ 3.98Å; W412-F503 HydrophobicContact CG-CZ 3.98Å; W412-F503 HydrophobicContact CH2-CD1 4.34Å; W412-F503 AromaticContact CH2-CE1 3.83Å; W412-F503 HydrophobicContact CH2-CE1 3.83Å; W412-F503 HydrophobicContact CZ2-CD1 4.49Å; W412-F503 AromaticContact CZ2-CE1 3.67Å; W412-F503 HydrophobicContact CZ2-CE1 3.67Å; W412-F503 HydrophobicContact CZ2-CZ 4.39Å; W412-F503 HydrophobicContact CZ3-CD1 4.36Å; W412-F503 AromaticContact CZ3-CE1 3.82Å; W412-F503 HydrophobicContact CZ3-CE1 3.82Å; W412-F503 AromaticContact NE1-CZ 3.91Å; V415-F503 HydrophobicContact CB-CD1 4.23Å; V415-F503 HydrophobicContact CB-CE1 4.47Å; V415-F503 HydrophobicContact CB-CG 4.47Å; V415-F503 HydrophobicContact CG1-CD1 4.07Å; V415-F503 HydrophobicContact CG1-CG 4.4Å; V415-F503 HydrophobicContact CG2-CB 4.17Å; V415-F503 HydrophobicContact CG2-CD1 3.97Å; V415-F503 HydrophobicContact CG2-CD2 3.91Å; V415-F503 HydrophobicContact CG2-CE1 4.32Å; V415-F503 HydrophobicContact CG2-CE2 4.29Å; V415-F503 HydrophobicContact CG2-CG 3.74Å; V415-F503 HydrophobicContact CG2-CZ 4.48Å; V499-F503 VanDerWaalsContact O-CB 3.25Å; V499-F503 WeakPolarHBondContact O-CB 3.37Å; V499-F503 PolarHBondContact O-N 2.78Å; L500-F503 PolarHBondContact O-N 3.06Å; L500-F503 VanDerWaalsContact O-N 3.12Å; M501-F503 VanDerWaalsContact C-N 3.32Å; M501-F503 PolarHBondContact O-N 2.81Å; F503-G505 PolarHBondContact O-N 3.01Å; F503-L506 HydrophobicContact CD2-CD2 4.01Å; F503-L506 HydrophobicContact CE2-CD2 3.93Å; F503-L506 CarbonylContact O-C 3.55Å; F503-L506 WeakPolarHBondContact O-CA 3.29Å; F503-L506 VanDerWaalsContact O-CB 3.29Å; F503-L506 WeakPolarHBondContact O-CB 3.49Å; F503-L506 PolarHBondContact O-N 3.16Å; F503-Q507 PolarHBondContact O-N 2.85Å
504	L	97.3	Very high	94.1	Very high	4 Å²	4	9.7 Å²	9.7	2%	0.021	5%	0.051	C	C	.	.	H	α-helix	trans	-59.6	-38.5	170.3	-68	173.4	0	0	0	111	F306 W412 L500 Q507 A508 W529 L533 V562 A566	F306-L504 HydrophobicContact CD2-CB 4.26Å; F306-L504 HydrophobicContact CE2-CB 4.11Å; W412-L504 HydrophobicContact CH2-CD2 3.98Å; L500-L504 HydrophobicContact CD1-CD1 4.33Å; L500-L504 HydrophobicContact CD1-CG 4.15Å; L500-L504 HydrophobicContact CG-CD1 4.23Å; L500-L504 HydrophobicContact CG-CG 4.46Å; L500-L504 WeakPolarHBondContact O-CG 3.47Å; L500-L504 PolarHBondContact O-N 3.33Å; L504-Q507 WeakPolarHBondContact O-CB 3.44Å; L504-Q507 PolarHBondContact O-N 2.99Å; L504-A508 PolarHBondContact O-N 3.43Å; L504-A508 VanDerWaalsContact O-N 3.08Å; L504-W529 HydrophobicContact CD2-CZ3 4.34Å; L504-L533 HydrophobicContact CD1-CD1 4.14Å; L504-L533 HydrophobicContact CD1-CD2 4.2Å; L504-L533 HydrophobicContact CD2-CD1 4.31Å; L504-L533 HydrophobicContact CD2-CD2 4.37Å; L504-V562 HydrophobicContact CD1-CG1 4.35Å; L504-A566 HydrophobicContact CD1-CB 3.54Å
505	G	97.1	Very high	93.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-61.2	-43	169.9	0	0	0	0	0	113.5	F306 G309 T310 M501 A502 F503 A508 G509	F306-G505 VanDerWaalsContact CD2-CA 3.48Å; F306-G505 WeakPolarHBondContact O-CA 3.28Å; G309-G505 VanDerWaalsContact C-C 3.48Å; T310-G505 WeakPolarHBondContact CA-O 3.47Å; T310-G505 WeakPolarHBondContact CB-O 3.25Å; T310-G505 VanDerWaalsContact N-C 3.26Å; T310-G505 PolarHBondContact N-O 3.04Å; T310-G505 VanDerWaalsContact N-O 3.09Å; T310-G505 PolarHBondContact OG1-O 3.46Å; M501-G505 PolarHBondContact O-N 2.7Å; M501-G505 VanDerWaalsContact O-N 3.16Å; A502-G505 CarbonylContact O-C 3.59Å; A502-G505 WeakPolarHBondContact O-CA 3.35Å; A502-G505 PolarHBondContact O-N 3.08Å; F503-G505 PolarHBondContact O-N 3.01Å; G505-A508 WeakPolarHBondContact O-CB 3.45Å; G505-A508 PolarHBondContact O-N 3.44Å; G505-G509 PolarHBondContact O-N 2.89Å; G505-G509 VanDerWaalsContact O-N 3.08Å
506	L	94.9	Very high	92.9	Very high	4 Å²	4	15.9 Å²	15.9	2%	0.021	7%	0.07	C	C	.	.	H	α-helix	trans	-59.9	-44.5	174.4	-178.1	115.4	0	0	0	111	G309 I312 A313 V378 D382 A502 F503 A508 G509 K510	G309-L506 WeakPolarHBondContact O-CA 3.48Å; I312-L506 HydrophobicContact CB-CD1 4.08Å; I312-L506 HydrophobicContact CG2-CD1 3.65Å; A313-L506 HydrophobicContact CB-CD1 4.15Å; A313-L506 HydrophobicContact CB-CG 4.11Å; V378-L506 HydrophobicContact CG1-CB 4.01Å; V378-L506 HydrophobicContact CG1-CD1 3.77Å; V378-L506 HydrophobicContact CG1-CG 4.36Å; D382-L506 HydrophobicContact CB-CD1 3.78Å; A502-L506 PolarHBondContact O-N 3.17Å; F503-L506 HydrophobicContact CD2-CD2 4.01Å; F503-L506 HydrophobicContact CE2-CD2 3.93Å; F503-L506 CarbonylContact O-C 3.55Å; F503-L506 WeakPolarHBondContact O-CA 3.29Å; F503-L506 VanDerWaalsContact O-CB 3.29Å; F503-L506 WeakPolarHBondContact O-CB 3.49Å; F503-L506 PolarHBondContact O-N 3.16Å; L506-A508 VanDerWaalsContact C-N 3.29Å; L506-A508 PolarHBondContact O-N 3.39Å; L506-G509 CarbonylContact O-C 3.53Å; L506-G509 WeakPolarHBondContact O-CA 3.21Å; L506-G509 PolarHBondContact O-N 3.31Å; L506-K510 WeakPolarHBondContact O-CG 3.31Å; L506-K510 PolarHBondContact O-N 3.11Å
507	Q	94.3	Very high	92.2	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-56.9	-43.5	174.5	-173.4	63.8	19.6	0	0	111.2	D404 W412 F503 L504 G509 K510 I511 W529	D404-Q507 PolarHBondContact O-NE2 3Å; D404-Q507 PolarHBondContact OD2-NE2 3.09Å; W412-Q507 HydrophobicContact CZ2-CB 4.5Å; W412-Q507 HydrophobicContact CZ2-CG 4.24Å; F503-Q507 PolarHBondContact O-N 2.85Å; L504-Q507 WeakPolarHBondContact O-CB 3.44Å; L504-Q507 PolarHBondContact O-N 2.99Å; Q507-G509 VanDerWaalsContact C-N 3.25Å; Q507-G509 PolarHBondContact O-N 3.14Å; Q507-K510 PolarHBondContact O-N 3.17Å; Q507-K510 VanDerWaalsContact O-N 3.13Å; Q507-I511 HydrophobicContact CG-CD1 4.26Å; Q507-I511 WeakPolarHBondContact O-CG1 3.46Å; Q507-I511 PolarHBondContact O-N 3.44Å; Q507-W529 HydrophobicContact CG-CZ2 3.95Å
508	A	94.6	Very high	91.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.8	-38.6	174.8	0	0	0	0	0	112.3	F306 L504 G505 L506 I511 L512 F526 F570 L573	F306-A508 HydrophobicContact CE1-CB 4.07Å; F306-A508 HydrophobicContact CZ-CB 3.67Å; L504-A508 PolarHBondContact O-N 3.43Å; L504-A508 VanDerWaalsContact O-N 3.08Å; G505-A508 WeakPolarHBondContact O-CB 3.45Å; G505-A508 PolarHBondContact O-N 3.44Å; L506-A508 VanDerWaalsContact C-N 3.29Å; L506-A508 PolarHBondContact O-N 3.39Å; A508-I511 PolarHBondContact O-N 2.92Å; A508-L512 WeakPolarHBondContact O-CG 3.44Å; A508-L512 PolarHBondContact O-N 3.49Å; A508-L512 VanDerWaalsContact O-N 3.13Å; A508-F526 HydrophobicContact CB-CE1 3.88Å; A508-F526 HydrophobicContact CB-CZ 4.24Å; A508-F570 HydrophobicContact CB-CD1 4.44Å; A508-F570 HydrophobicContact CB-CE1 3.6Å; A508-F570 HydrophobicContact CB-CZ 4.14Å; A508-L573 HydrophobicContact CB-CD2 4.06Å
509	G	92.1	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-36.8	175	0	0	0	0	0	113.6	G505 L506 Q507 L512 L513	G505-G509 PolarHBondContact O-N 2.89Å; G505-G509 VanDerWaalsContact O-N 3.08Å; L506-G509 CarbonylContact O-C 3.53Å; L506-G509 WeakPolarHBondContact O-CA 3.21Å; L506-G509 PolarHBondContact O-N 3.31Å; Q507-G509 VanDerWaalsContact C-N 3.25Å; Q507-G509 PolarHBondContact O-N 3.14Å; G509-L512 PolarHBondContact O-N 3.02Å; G509-L513 WeakPolarHBondContact O-CG 3.36Å; G509-L513 PolarHBondContact O-N 3.37Å; G509-L513 VanDerWaalsContact O-N 3.07Å
510	K	88.6	Confident	90.9	Very high	7 Å²	7	31.6 Å²	31.6	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-40.9	174.1	-62.5	-57.1	-175.9	-175.9	0	111.9	A313 D382 Y408 L506 Q507 L512 L513 H514	A313-K510 HydrophobicContact CB-CD 4.04Å; A313-K510 HydrophobicContact CB-CG 4.4Å; D382-K510 WeakPolarHBondContact OD1-CE 3.5Å; D382-K510 IonicContact OD1-NZ 3.26Å; D382-K510 PolarHBondContact OD1-NZ 2.99Å; D382-K510 IonicContact OD2-NZ 3Å; D382-K510 PolarHBondContact OD2-NZ 3.49Å; Y408-K510 HydrophobicContact CD2-CG 4.44Å; Y408-K510 HydrophobicContact CE1-CD 4.23Å; Y408-K510 HydrophobicContact CE2-CB 4.35Å; Y408-K510 HydrophobicContact CE2-CD 3.92Å; Y408-K510 HydrophobicContact CE2-CG 4.01Å; L506-K510 WeakPolarHBondContact O-CG 3.31Å; L506-K510 PolarHBondContact O-N 3.11Å; Q507-K510 PolarHBondContact O-N 3.17Å; Q507-K510 VanDerWaalsContact O-N 3.13Å; K510-L512 VanDerWaalsContact C-N 3.3Å; K510-L512 PolarHBondContact O-N 3.19Å; K510-L513 HydrophobicContact CD-CD1 4.44Å; K510-L513 PolarHBondContact O-N 3.4Å; K510-L513 VanDerWaalsContact O-N 3.15Å; K510-H514 WeakPolarHBondContact O-CB 3.41Å; K510-H514 PolarHBondContact O-N 3Å
511	I	90	Very high	90.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-44.4	173.7	-67.6	163.6	0	0	0	110.3	Q507 A508 L513 H514 Y515 V522 R525 F526	Q507-I511 HydrophobicContact CG-CD1 4.26Å; Q507-I511 WeakPolarHBondContact O-CG1 3.46Å; Q507-I511 PolarHBondContact O-N 3.44Å; A508-I511 PolarHBondContact O-N 2.92Å; I511-L513 VanDerWaalsContact C-N 3.32Å; I511-L513 PolarHBondContact O-N 2.99Å; I511-H514 PolarHBondContact O-N 2.92Å; I511-Y515 HydrophobicContact CG2-CD2 4.21Å; I511-Y515 PolarHBondContact O-N 2.94Å; I511-V522 HydrophobicContact CG2-CG1 4.42Å; I511-R525 HydrophobicContact CD1-CB 4.2Å; I511-R525 HydrophobicContact CG2-CB 4.01Å; I511-F526 HydrophobicContact CB-CE1 3.91Å; I511-F526 HydrophobicContact CD1-CD1 4.15Å; I511-F526 HydrophobicContact CD1-CE1 4.08Å; I511-F526 HydrophobicContact CG2-CD1 4.18Å; I511-F526 HydrophobicContact CG2-CE1 3.74Å; I511-F526 HydrophobicContact CG2-CZ 4.46Å
512	L	88.9	Confident	90.2	Very high	9 Å²	9	32.7 Å²	32.7	5%	0.047	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-34.3	176.7	-73.5	166.1	0	0	0	113.4	L259 T310 A508 G509 K510 R516 V522 F526 Y577	L259-L512 HydrophobicContact CD1-CD1 4.23Å; T310-L512 HydrophobicContact CG2-CD1 3.88Å; A508-L512 WeakPolarHBondContact O-CG 3.44Å; A508-L512 PolarHBondContact O-N 3.49Å; A508-L512 VanDerWaalsContact O-N 3.13Å; G509-L512 PolarHBondContact O-N 3.02Å; K510-L512 VanDerWaalsContact C-N 3.3Å; K510-L512 PolarHBondContact O-N 3.19Å; L512-R516 WeakPolarHBondContact O-CA 3.38Å; L512-R516 WeakPolarHBondContact O-CB 3.47Å; L512-R516 PolarHBondContact O-N 3.36Å; L512-V522 HydrophobicContact CD2-CG1 3.66Å; L512-F526 HydrophobicContact CD1-CZ 4.2Å; L512-F526 HydrophobicContact CD2-CE2 4.31Å; L512-F526 HydrophobicContact CD2-CZ 4.07Å; L512-F526 HydrophobicContact CG-CZ 3.82Å; L512-Y577 HydrophobicContact CD2-CD2 4.13Å; L512-Y577 HydrophobicContact CD2-CE2 3.87Å
513	L	85.5	Confident	90	Very high	41 Å²	41	34.2 Å²	34.2	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-72.4	-44.8	176.6	-74.8	169.7	0	0	0	111.8	A313 L314 N317 G509 K510 I511	A313-L513 WeakPolarHBondContact O-CD1 3.4Å; L314-L513 HydrophobicContact CD2-CD1 4.26Å; L314-L513 HydrophobicContact CD2-CD2 3.56Å; L314-L513 HydrophobicContact CD2-CG 3.63Å; N317-L513 HydrophobicContact CB-CD1 3.7Å; G509-L513 WeakPolarHBondContact O-CG 3.36Å; G509-L513 PolarHBondContact O-N 3.37Å; G509-L513 VanDerWaalsContact O-N 3.07Å; K510-L513 HydrophobicContact CD-CD1 4.44Å; K510-L513 PolarHBondContact O-N 3.4Å; K510-L513 VanDerWaalsContact O-N 3.15Å; I511-L513 VanDerWaalsContact C-N 3.32Å; I511-L513 PolarHBondContact O-N 2.99Å
514	H	83.3	Confident	89.8	Confident	74 Å²	74	37 Å²	37	34%	0.343	20%	0.2	S	C	.	.	H	α-helix	trans	-75.1	-41.2	-173.8	-168.3	88.7	0	0	0	112.2	K510 I511	K510-H514 WeakPolarHBondContact O-CB 3.41Å; K510-H514 PolarHBondContact O-N 3Å; I511-H514 PolarHBondContact O-N 2.92Å
515	Y	83.9	Confident	89.5	Confident	30 Å²	30	38.3 Å²	38.3	12%	0.118	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	27.6	-178.3	-62.9	-80.7	0	0	0	112.7	S400 I511 D517 V518 S521 V522 R525	S400-Y515 PolarHBondContact O-OH 3.29Å; I511-Y515 HydrophobicContact CG2-CD2 4.21Å; I511-Y515 PolarHBondContact O-N 2.94Å; Y515-D517 PolarHBondContact O-N 3.33Å; Y515-D517 VanDerWaalsContact O-N 3.11Å; Y515-V518 CarbonylContact O-C 3.59Å; Y515-V518 PolarHBondContact O-N 3.31Å; Y515-S521 VanDerWaalsContact CD1-CB 3.48Å; Y515-V522 WeakPolarHBondContact O-CG2 3.26Å; Y515-R525 VanDerWaalsContact OH-CZ 3.3Å; Y515-R525 PolarHBondContact OH-NE 2.98Å; Y515-R525 PolarHBondContact OH-NH2 2.84Å
516	R	80.3	Confident	89.4	Confident	118 Å²	118	38.3 Å²	38.3	45%	0.445	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.7	-173.2	-176.1	176.6	178.7	158.2	1	113.7	L512	L512-R516 WeakPolarHBondContact O-CA 3.38Å; L512-R516 WeakPolarHBondContact O-CB 3.47Å; L512-R516 PolarHBondContact O-N 3.36Å
517	D	81.3	Confident	89.5	Confident	149 Å²	149	41.9 Å²	41.9	80%	0.797	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-9.8	-176.1	-58	-47.6	0	0	0	113.1	Y515 P519	Y515-D517 PolarHBondContact O-N 3.33Å; Y515-D517 VanDerWaalsContact O-N 3.11Å; D517-P519 WeakPolarHBondContact O-CD 3.32Å
518	V	88	Confident	89.5	Confident	65 Å²	65	46.5 Å²	46.5	39%	0.394	25%	0.247	S	C	.	.			trans	-121.8	81.4	-176.7	-167.9	0	0	0	0	109.7	Y515 T520 S521 V522	Y515-V518 CarbonylContact O-C 3.59Å; Y515-V518 PolarHBondContact O-N 3.31Å; V518-T520 WeakPolarHBondContact CG1-OG1 3.39Å; V518-T520 PolarHBondContact O-N 3.48Å; V518-S521 VanDerWaalsContact CG1-OG 3.25Å; V518-S521 WeakPolarHBondContact CG1-OG 3.34Å; V518-S521 PolarHBondContact O-N 2.93Å; V518-S521 VanDerWaalsContact O-N 3.09Å; V518-V522 PolarHBondContact O-N 2.96Å
519	P	87.9	Confident	89.6	Confident	44 Å²	44	47.9 Å²	47.9	29%	0.286	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-26.9	-173.6	23.1	-32.9	0	0	0	113.3	D517 V522 I523 Y577 V582	D517-P519 WeakPolarHBondContact O-CD 3.32Å; P519-V522 PolarHBondContact O-N 3.01Å; P519-I523 VanDerWaalsContact O-CG1 3.32Å; P519-I523 WeakPolarHBondContact O-CG1 3.35Å; P519-I523 PolarHBondContact O-N 3.05Å; P519-Y577 HydrophobicContact CB-CE1 4.1Å; P519-V582 HydrophobicContact CB-CG2 3.85Å
520	T	89.8	Confident	89.8	Confident	101 Å²	101	48 Å²	48	62%	0.62	25%	0.253	S	S	*	.	H	α-helix	trans	-63.6	-41.5	174.6	45.1	0	0	0	0	111.7	V518 I523 S524	V518-T520 WeakPolarHBondContact CG1-OG1 3.39Å; V518-T520 PolarHBondContact O-N 3.48Å; T520-I523 PolarHBondContact O-N 2.66Å; T520-S524 WeakPolarHBondContact O-CB 3.17Å; T520-S524 PolarHBondContact O-N 3.37Å
521	S	89.4	Confident	90.2	Very high	38 Å²	38	54 Å²	54	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-67.7	-37.8	176.9	-59.7	0	0	0	0	112.2	Y515 V518 R525	Y515-S521 VanDerWaalsContact CD1-CB 3.48Å; V518-S521 VanDerWaalsContact CG1-OG 3.25Å; V518-S521 WeakPolarHBondContact CG1-OG 3.34Å; V518-S521 PolarHBondContact O-N 2.93Å; V518-S521 VanDerWaalsContact O-N 3.09Å; S521-R525 WeakPolarHBondContact O-CB 3.47Å; S521-R525 VanDerWaalsContact O-CG 3.29Å; S521-R525 WeakPolarHBondContact O-CG 3.39Å; S521-R525 PolarHBondContact O-N 3.33Å
522	V	91.1	Very high	90.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.8	-52.1	172.7	175	0	0	0	0	110.5	I511 L512 Y515 V518 P519 R525 F526 Y577	I511-V522 HydrophobicContact CG2-CG1 4.42Å; L512-V522 HydrophobicContact CD2-CG1 3.66Å; Y515-V522 WeakPolarHBondContact O-CG2 3.26Å; V518-V522 PolarHBondContact O-N 2.96Å; P519-V522 PolarHBondContact O-N 3.01Å; V522-R525 PolarHBondContact O-N 2.78Å; V522-F526 HydrophobicContact CG1-CD2 3.96Å; V522-F526 HydrophobicContact CG1-CE1 4.35Å; V522-F526 HydrophobicContact CG1-CE2 3.51Å; V522-F526 HydrophobicContact CG1-CZ 3.77Å; V522-F526 WeakPolarHBondContact O-CG 3.48Å; V522-F526 PolarHBondContact O-N 3.45Å; V522-Y577 HydrophobicContact CB-CE1 4.18Å; V522-Y577 HydrophobicContact CG1-CD1 4.26Å; V522-Y577 HydrophobicContact CG1-CE1 3.91Å
523	I	93.6	Very high	90.9	Very high	31 Å²	31	58.4 Å²	58.4	16%	0.159	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-48	-178	-68.7	165.5	0	0	0	110.7	P519 T520 R525 F526 L527 V574 Y577 Y578	P519-I523 VanDerWaalsContact O-CG1 3.32Å; P519-I523 WeakPolarHBondContact O-CG1 3.35Å; P519-I523 PolarHBondContact O-N 3.05Å; T520-I523 PolarHBondContact O-N 2.66Å; I523-R525 VanDerWaalsContact C-N 3.29Å; I523-R525 PolarHBondContact O-N 3.5Å; I523-F526 PolarHBondContact O-N 3.09Å; I523-L527 HydrophobicContact CG2-CD1 4.05Å; I523-L527 HydrophobicContact CG2-CG 4.49Å; I523-L527 WeakPolarHBondContact O-CG 3.38Å; I523-L527 PolarHBondContact O-N 3.32Å; I523-V574 HydrophobicContact CG2-CG1 3.88Å; I523-Y577 HydrophobicContact CD1-CD1 4.48Å; I523-Y577 HydrophobicContact CG1-CD1 4.08Å; I523-Y577 HydrophobicContact CG1-CE1 4.26Å; I523-Y578 HydrophobicContact CD1-CD2 3.81Å
524	S	93.3	Very high	91.5	Very high	62 Å²	62	57.5 Å²	57.5	43%	0.434	31%	0.309	S	S	.	.	H	α-helix	trans	-56.4	-44.1	178.3	-176.8	0	0	0	0	111.6	T520 L527 I528	T520-S524 WeakPolarHBondContact O-CB 3.17Å; T520-S524 PolarHBondContact O-N 3.37Å; S524-L527 PolarHBondContact O-N 3.26Å; S524-I528 WeakPolarHBondContact O-CD1 3.45Å; S524-I528 VanDerWaalsContact O-CG1 3.24Å; S524-I528 WeakPolarHBondContact O-CG1 3.24Å; S524-I528 PolarHBondContact O-N 2.86Å
525	R	92.1	Very high	92.1	Very high	31 Å²	31	56.6 Å²	56.6	12%	0.117	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-41.7	-179.9	-75.9	178.2	174.9	-83.5	-8.2	113	P401 D404 I511 Y515 S521 V522 I523 L527 I528 W529	P401-R525 VanDerWaalsContact C-NH2 3.31Å; P401-R525 VanDerWaalsContact O-CZ 3.28Å; P401-R525 PolarHBondContact O-NH1 2.97Å; P401-R525 PolarHBondContact O-NH2 2.99Å; D404-R525 IonicContact OD1-CZ 3.64Å; D404-R525 IonicContact OD1-NH1 2.98Å; D404-R525 PolarHBondContact OD1-NH1 3.21Å; D404-R525 IonicContact OD2-CZ 3.82Å; D404-R525 IonicContact OD2-NH1 3.76Å; D404-R525 PolarHBondContact OD2-NH1 2.94Å; I511-R525 HydrophobicContact CD1-CB 4.2Å; I511-R525 HydrophobicContact CG2-CB 4.01Å; Y515-R525 VanDerWaalsContact OH-CZ 3.3Å; Y515-R525 PolarHBondContact OH-NE 2.98Å; Y515-R525 PolarHBondContact OH-NH2 2.84Å; S521-R525 WeakPolarHBondContact O-CB 3.47Å; S521-R525 VanDerWaalsContact O-CG 3.29Å; S521-R525 WeakPolarHBondContact O-CG 3.39Å; S521-R525 PolarHBondContact O-N 3.33Å; V522-R525 PolarHBondContact O-N 2.78Å; I523-R525 VanDerWaalsContact C-N 3.29Å; I523-R525 PolarHBondContact O-N 3.5Å; R525-L527 VanDerWaalsContact C-N 3.27Å; R525-L527 PolarHBondContact O-N 2.83Å; R525-I528 PolarHBondContact O-N 3.3Å; R525-W529 VanDerWaalsContact O-CD1 3.27Å; R525-W529 PolarHBondContact O-N 3.39Å
526	F	95.3	Very high	92.7	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-38.8	175.1	-69.6	-11.6	0	0	0	111.8	A508 I511 L512 V522 I523 G530 F570 L573 V574	A508-F526 HydrophobicContact CB-CE1 3.88Å; A508-F526 HydrophobicContact CB-CZ 4.24Å; I511-F526 HydrophobicContact CB-CE1 3.91Å; I511-F526 HydrophobicContact CD1-CD1 4.15Å; I511-F526 HydrophobicContact CD1-CE1 4.08Å; I511-F526 HydrophobicContact CG2-CD1 4.18Å; I511-F526 HydrophobicContact CG2-CE1 3.74Å; I511-F526 HydrophobicContact CG2-CZ 4.46Å; L512-F526 HydrophobicContact CD1-CZ 4.2Å; L512-F526 HydrophobicContact CD2-CE2 4.31Å; L512-F526 HydrophobicContact CD2-CZ 4.07Å; L512-F526 HydrophobicContact CG-CZ 3.82Å; V522-F526 HydrophobicContact CG1-CD2 3.96Å; V522-F526 HydrophobicContact CG1-CE1 4.35Å; V522-F526 HydrophobicContact CG1-CE2 3.51Å; V522-F526 HydrophobicContact CG1-CZ 3.77Å; V522-F526 WeakPolarHBondContact O-CG 3.48Å; V522-F526 PolarHBondContact O-N 3.45Å; I523-F526 PolarHBondContact O-N 3.09Å; F526-G530 PolarHBondContact O-N 2.85Å; F526-F570 HydrophobicContact CB-CD1 4.01Å; F526-F570 AromaticContact CD1-CD1 3.73Å; F526-F570 HydrophobicContact CD1-CD1 3.73Å; F526-F570 AromaticContact CD1-CE1 3.81Å; F526-F570 HydrophobicContact CD1-CE1 3.81Å; F526-F570 HydrophobicContact CE1-CD1 4.41Å; F526-F570 HydrophobicContact CE1-CE1 4.22Å; F526-F570 HydrophobicContact CG-CD1 4Å; F526-L573 HydrophobicContact CD2-CD2 4.06Å; F526-L573 HydrophobicContact CD2-CG 4.12Å; F526-L573 HydrophobicContact CE1-CD2 4.25Å; F526-L573 HydrophobicContact CE2-CD2 3.38Å; F526-L573 HydrophobicContact CE2-CG 3.62Å; F526-L573 HydrophobicContact CZ-CD2 3.47Å; F526-L573 VanDerWaalsContact CZ-CD2 3.47Å; F526-L573 HydrophobicContact CZ-CG 4.22Å; F526-V574 HydrophobicContact CB-CG2 3.34Å; F526-V574 HydrophobicContact CD2-CG2 3.88Å; F526-V574 HydrophobicContact CG-CG2 4.14Å
527	L	96.3	Very high	93.5	Very high	79 Å²	79	52.8 Å²	52.8	41%	0.414	31%	0.307	S	S	.	.	H	α-helix	trans	-66	-41.9	173.9	-68.8	174.8	0	0	0	112.1	I523 S524 R525 G530 L531 V574	I523-L527 HydrophobicContact CG2-CD1 4.05Å; I523-L527 HydrophobicContact CG2-CG 4.49Å; I523-L527 WeakPolarHBondContact O-CG 3.38Å; I523-L527 PolarHBondContact O-N 3.32Å; S524-L527 PolarHBondContact O-N 3.26Å; R525-L527 VanDerWaalsContact C-N 3.27Å; R525-L527 PolarHBondContact O-N 2.83Å; L527-G530 PolarHBondContact O-N 3.08Å; L527-L531 WeakPolarHBondContact O-CB 3.37Å; L527-L531 VanDerWaalsContact O-CG 3.3Å; L527-L531 WeakPolarHBondContact O-CG 3.12Å; L527-L531 PolarHBondContact O-N 2.85Å; L527-V574 HydrophobicContact CD2-CG2 4.31Å; L527-V574 HydrophobicContact CG-CG2 4.3Å
528	I	94.8	Very high	94.2	Very high	97 Å²	97	47.5 Å²	47.5	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-48	175.4	-69.3	162	0	0	0	110.8	S524 R525 G530 L531 L532	S524-I528 WeakPolarHBondContact O-CD1 3.45Å; S524-I528 VanDerWaalsContact O-CG1 3.24Å; S524-I528 WeakPolarHBondContact O-CG1 3.24Å; S524-I528 PolarHBondContact O-N 2.86Å; R525-I528 PolarHBondContact O-N 3.3Å; I528-G530 PolarHBondContact O-N 2.92Å; I528-L531 PolarHBondContact O-N 2.83Å; I528-L532 WeakPolarHBondContact O-CB 3.29Å; I528-L532 PolarHBondContact O-N 3.22Å
529	W	95.2	Very high	94.6	Very high	29 Å²	29	49.3 Å²	49.3	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-42	176.3	-85.1	105.2	0	0	0	112.3	I405 W412 L504 Q507 R525 L532 L533 F570	I405-W529 HydrophobicContact CD1-CH2 4.38Å; I405-W529 HydrophobicContact CD1-CZ2 3.76Å; I405-W529 HydrophobicContact CG1-CZ2 4.1Å; W412-W529 AromaticContact CH2-CH2 3.38Å; W412-W529 HydrophobicContact CH2-CH2 3.38Å; W412-W529 HydrophobicContact CH2-CZ2 4.31Å; W412-W529 AromaticContact CH2-CZ3 3.82Å; W412-W529 HydrophobicContact CH2-CZ3 3.82Å; W412-W529 AromaticContact CZ2-CH2 3.4Å; W412-W529 HydrophobicContact CZ2-CH2 3.4Å; W412-W529 VanDerWaalsContact CZ2-CH2 3.4Å; W412-W529 AromaticContact CZ2-CZ2 3.92Å; W412-W529 HydrophobicContact CZ2-CZ2 3.92Å; W412-W529 HydrophobicContact CZ2-CZ3 4.26Å; W412-W529 HydrophobicContact CZ3-CH2 4.43Å; L504-W529 HydrophobicContact CD2-CZ3 4.34Å; Q507-W529 HydrophobicContact CG-CZ2 3.95Å; R525-W529 VanDerWaalsContact O-CD1 3.27Å; R525-W529 PolarHBondContact O-N 3.39Å; W529-L532 HydrophobicContact CE3-CD2 4.42Å; W529-L532 HydrophobicContact CZ3-CD2 4.34Å; W529-L532 PolarHBondContact O-N 3.44Å; W529-L533 HydrophobicContact CE3-CD1 4.26Å; W529-L533 HydrophobicContact CE3-CG 4.38Å; W529-L533 WeakPolarHBondContact O-CB 3.42Å; W529-L533 WeakPolarHBondContact O-CD1 3.32Å; W529-L533 VanDerWaalsContact O-CG 3.27Å; W529-L533 WeakPolarHBondContact O-CG 3.46Å; W529-L533 PolarHBondContact O-N 2.91Å; W529-F570 HydrophobicContact CB-CD1 4.18Å; W529-F570 HydrophobicContact CB-CD2 3.97Å; W529-F570 HydrophobicContact CB-CE1 4.01Å; W529-F570 HydrophobicContact CB-CE2 3.83Å; W529-F570 HydrophobicContact CB-CG 4.17Å; W529-F570 HydrophobicContact CB-CZ 3.85Å; W529-F570 HydrophobicContact CG-CE1 4.38Å; W529-F570 HydrophobicContact CG-CE2 4.41Å; W529-F570 HydrophobicContact CG-CZ 4.09Å
530	G	96.9	Very high	94.9	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-48.7	174.7	0	0	0	0	0	112	F526 L527 I528 G534 C567	F526-G530 PolarHBondContact O-N 2.85Å; L527-G530 PolarHBondContact O-N 3.08Å; I528-G530 PolarHBondContact O-N 2.92Å; G530-G534 PolarHBondContact O-N 3.13Å; G530-C567 PolarHBondContact O-SG 3.28Å
531	L	97.3	Very high	95.1	Very high	132 Å²	132	44.3 Å²	44.3	69%	0.691	26%	0.263	S	S	*	.	H	α-helix	trans	-64.1	-43.7	178	-71.7	170.8	0	0	0	112.4	L527 I528 G534 A535	L527-L531 WeakPolarHBondContact O-CB 3.37Å; L527-L531 VanDerWaalsContact O-CG 3.3Å; L527-L531 WeakPolarHBondContact O-CG 3.12Å; L527-L531 PolarHBondContact O-N 2.85Å; I528-L531 PolarHBondContact O-N 2.83Å; L531-G534 PolarHBondContact O-N 2.86Å; L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 3.08Å
532	L	96.4	Very high	95.3	Very high	90 Å²	90	47.9 Å²	47.9	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-48.7	179.1	-179.2	144.4	0	0	0	111.5	I528 W529 G534 A535 V536	I528-L532 WeakPolarHBondContact O-CB 3.29Å; I528-L532 PolarHBondContact O-N 3.22Å; W529-L532 HydrophobicContact CE3-CD2 4.42Å; W529-L532 HydrophobicContact CZ3-CD2 4.34Å; W529-L532 PolarHBondContact O-N 3.44Å; L532-G534 VanDerWaalsContact C-N 3.33Å; L532-A535 PolarHBondContact O-N 3.05Å; L532-V536 WeakPolarHBondContact O-CG2 3.06Å; L532-V536 PolarHBondContact O-N 3.5Å
533	L	97.2	Very high	95.2	Very high	12 Å²	12	53.1 Å²	53.1	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-68.6	-35.2	179	-66.5	167.6	0	0	0	111.6	L504 W529 S537 T563 A566 C567 F570	L504-L533 HydrophobicContact CD1-CD1 4.14Å; L504-L533 HydrophobicContact CD1-CD2 4.2Å; L504-L533 HydrophobicContact CD2-CD1 4.31Å; L504-L533 HydrophobicContact CD2-CD2 4.37Å; W529-L533 HydrophobicContact CE3-CD1 4.26Å; W529-L533 HydrophobicContact CE3-CG 4.38Å; W529-L533 WeakPolarHBondContact O-CB 3.42Å; W529-L533 WeakPolarHBondContact O-CD1 3.32Å; W529-L533 VanDerWaalsContact O-CG 3.27Å; W529-L533 WeakPolarHBondContact O-CG 3.46Å; W529-L533 PolarHBondContact O-N 2.91Å; L533-S537 WeakPolarHBondContact O-CB 3.18Å; L533-S537 PolarHBondContact O-N 2.9Å; L533-T563 HydrophobicContact CD2-CG2 4.14Å; L533-A566 HydrophobicContact CD1-CB 3.75Å; L533-C567 HydrophobicContact CB-CB 4.25Å; L533-F570 HydrophobicContact CD1-CD2 3.83Å; L533-F570 HydrophobicContact CD1-CE2 3.61Å
534	G	97.1	Very high	95	Very high	22 Å²	22	53.5 Å²	53.5	23%	0.227	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-41.9	172	0	0	0	0	0	112.6	G530 L531 L532 S537 A538	G530-G534 PolarHBondContact O-N 3.13Å; L531-G534 PolarHBondContact O-N 2.86Å; L532-G534 VanDerWaalsContact C-N 3.33Å; G534-S537 PolarHBondContact O-N 3.34Å; G534-A538 WeakPolarHBondContact O-CB 3.41Å; G534-A538 PolarHBondContact O-N 3.14Å
535	A	97.6	Very high	94.7	Very high	56 Å²	56	54.2 Å²	54.2	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-66.5	-45.4	176.5	0	0	0	0	0	111.9	L531 L532 S537 A538 V539	L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 3.08Å; L532-A535 PolarHBondContact O-N 3.05Å; A535-S537 VanDerWaalsContact C-N 3.28Å; A535-S537 PolarHBondContact O-N 2.71Å; A535-A538 PolarHBondContact O-N 3.41Å; A535-V539 WeakPolarHBondContact O-CG2 3.3Å; A535-V539 PolarHBondContact O-N 3.49Å
536	V	96.6	Very high	94.4	Very high	60 Å²	60	54.6 Å²	54.6	36%	0.364	32%	0.322	S	S	.	.	H	α-helix	trans	-57.3	-45.4	173.9	171.6	0	0	0	0	110.4	L532 V539 L540 T563	L532-V536 WeakPolarHBondContact O-CG2 3.06Å; L532-V536 PolarHBondContact O-N 3.5Å; V536-V539 PolarHBondContact O-N 3.48Å; V536-L540 HydrophobicContact CG1-CD1 3.97Å; V536-L540 HydrophobicContact CG1-CG 4.4Å; V536-L540 WeakPolarHBondContact O-CG 3.46Å; V536-L540 PolarHBondContact O-N 3.07Å; V536-T563 HydrophobicContact CG1-CG2 4.08Å
537	S	96.3	Very high	93.9	Very high	8 Å²	8	61.8 Å²	61.8	6%	0.056	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-44.3	177	-176	0	0	0	0	112.7	L533 G534 A535 V539 L540 T541 T564	L533-S537 WeakPolarHBondContact O-CB 3.18Å; L533-S537 PolarHBondContact O-N 2.9Å; G534-S537 PolarHBondContact O-N 3.34Å; A535-S537 VanDerWaalsContact C-N 3.28Å; A535-S537 PolarHBondContact O-N 2.71Å; S537-V539 VanDerWaalsContact C-N 3.29Å; S537-V539 PolarHBondContact O-N 3.3Å; S537-L540 PolarHBondContact O-N 3.11Å; S537-T541 WeakPolarHBondContact O-CB 3.16Å; S537-T541 VanDerWaalsContact O-CG2 3.25Å; S537-T541 WeakPolarHBondContact O-CG2 3.09Å; S537-T541 PolarHBondContact O-N 3.42Å; S537-T541 PolarHBondContact O-OG1 3.33Å; S537-T564 PolarHBondContact OG-OG1 2.85Å
538	A	95.4	Very high	93.4	Very high	37 Å²	37	58.6 Å²	58.6	31%	0.306	34%	0.34	S	S	.	.	H	α-helix	trans	-60.2	-40.1	178	0	0	0	0	0	111.6	G534 A535 T541 E542 C543	G534-A538 WeakPolarHBondContact O-CB 3.41Å; G534-A538 PolarHBondContact O-N 3.14Å; A535-A538 PolarHBondContact O-N 3.41Å; A538-T541 PolarHBondContact O-OG1 2.93Å; A538-E542 WeakPolarHBondContact O-CA 2.91Å; A538-E542 PolarHBondContact O-N 2.88Å; A538-C543 PolarHBondContact O-N 3.23Å
539	V	96.3	Very high	93.2	Very high	103 Å²	103	60.7 Å²	60.7	62%	0.624	35%	0.345	S	S	*	.	H	α-helix	trans	-65.8	-47	175	172.5	0	0	0	0	111.5	A535 V536 S537 T541	A535-V539 WeakPolarHBondContact O-CG2 3.3Å; A535-V539 PolarHBondContact O-N 3.49Å; V536-V539 PolarHBondContact O-N 3.48Å; S537-V539 VanDerWaalsContact C-N 3.29Å; S537-V539 PolarHBondContact O-N 3.3Å; V539-T541 VanDerWaalsContact C-N 3.26Å; V539-T541 PolarHBondContact O-N 2.88Å
540	L	94.8	Very high	93.2	Very high	31 Å²	31	59.6 Å²	59.6	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-30.2	-179.1	-71.5	175.8	0	0	0	113.3	V536 S537 G548 F549 I550 L559	V536-L540 HydrophobicContact CG1-CD1 3.97Å; V536-L540 HydrophobicContact CG1-CG 4.4Å; V536-L540 WeakPolarHBondContact O-CG 3.46Å; V536-L540 PolarHBondContact O-N 3.07Å; S537-L540 PolarHBondContact O-N 3.11Å; L540-G548 CarbonylContact O-C 3.45Å; L540-F549 PolarHBondContact O-N 3.32Å; L540-I550 HydrophobicContact CD2-CD1 4.22Å; L540-I550 HydrophobicContact CD2-CG1 4.41Å; L540-I550 PolarHBondContact O-N 3.27Å; L540-L559 HydrophobicContact CD1-CD2 4.15Å; L540-L559 HydrophobicContact CD1-CG 4Å
541	T	94.1	Very high	93	Very high	10 Å²	10	60 Å²	60	6%	0.061	34%	0.344	C	S	.	.	H	α-helix	trans	-99.6	-12.3	-174.6	58	0	0	0	0	113.2	S537 A538 V539 C543 S544 G548 V552	S537-T541 WeakPolarHBondContact O-CB 3.16Å; S537-T541 VanDerWaalsContact O-CG2 3.25Å; S537-T541 WeakPolarHBondContact O-CG2 3.09Å; S537-T541 PolarHBondContact O-N 3.42Å; S537-T541 PolarHBondContact O-OG1 3.33Å; A538-T541 PolarHBondContact O-OG1 2.93Å; V539-T541 VanDerWaalsContact C-N 3.26Å; V539-T541 PolarHBondContact O-N 2.88Å; T541-C543 PolarHBondContact O-N 3.29Å; T541-C543 VanDerWaalsContact O-N 3.12Å; T541-C543 PolarHBondContact OG1-N 3.08Å; T541-S544 PolarHBondContact O-N 3.26Å; T541-G548 WeakPolarHBondContact O-CA 3.43Å; T541-V552 HydrophobicContact CG2-CG2 3.51Å
542	E	93.1	Very high	92.9	Very high	113 Å²	113	54.6 Å²	54.6	53%	0.528	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	29.8	-166.1	-59.1	-172.9	173.5	0	0	112.7	A538 S544 F549	A538-E542 WeakPolarHBondContact O-CA 2.91Å; A538-E542 PolarHBondContact O-N 2.88Å; E542-S544 PolarHBondContact O-N 2.97Å; E542-S544 VanDerWaalsContact O-N 3.08Å; E542-F549 HydrophobicContact CG-CD2 4.45Å; E542-F549 HydrophobicContact CG-CE2 4.36Å; E542-F549 WeakPolarHBondContact OE1-CE2 3.39Å
543	C	89.8	Confident	92.9	Very high	109 Å²	109	50.3 Å²	50.3	74%	0.736	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	26.2	-172.1	-62.7	0	0	0	0	114.2	A538 T541	A538-C543 PolarHBondContact O-N 3.23Å; T541-C543 PolarHBondContact O-N 3.29Å; T541-C543 VanDerWaalsContact O-N 3.12Å; T541-C543 PolarHBondContact OG1-N 3.08Å
544	S	90.2	Very high	92.7	Very high	40 Å²	40	50.7 Å²	50.7	28%	0.28	30%	0.295	S	S	.	.			trans	-114.9	154.6	178.8	-177.2	0	0	0	0	110.7	T541 E542 K547	T541-S544 PolarHBondContact O-N 3.26Å; E542-S544 PolarHBondContact O-N 2.97Å; E542-S544 VanDerWaalsContact O-N 3.08Å; S544-K547 PolarHBondContact OG-N 2.8Å
545	T	86.3	Confident	92.5	Very high	76 Å²	76	50 Å²	50	47%	0.466	29%	0.286	S	S	.	.	S	Bend	trans	-71.6	-39.8	176.7	50.1	0	0	0	0	112	P551	T545-P551 WeakPolarHBondContact O-CB 3.33Å
546	D	85.4	Confident	92.3	Very high	40 Å²	40	47.9 Å²	47.9	21%	0.214	27%	0.267	C	S	.	.	S	Bend	trans	-128.2	-12.5	-166.3	-61	-74.9	0	0	0	114.8	Y100 N292	Y100-D546 HydrophobicContact CD1-CB 4.03Å; Y100-D546 HydrophobicContact CD2-CB 3.47Å; Y100-D546 VanDerWaalsContact CD2-CB 3.47Å; Y100-D546 HydrophobicContact CE1-CB 4.05Å; Y100-D546 HydrophobicContact CE2-CB 3.51Å; Y100-D546 HydrophobicContact CG-CB 3.74Å; N292-D546 WeakPolarHBondContact CB-OD1 3.36Å; N292-D546 PolarHBondContact ND2-OD1 3.02Å
547	K	84.3	Confident	92.3	Very high	151 Å²	151	45 Å²	45	66%	0.657	25%	0.249	S	C	*	.	S	Bend	trans	-99.3	-8.7	-172.1	-62.1	-176.7	-179.6	177.3	0	115.7	S544	S544-K547 PolarHBondContact OG-N 2.8Å
548	G	86.7	Confident	92.2	Very high	12 Å²	12	44.8 Å²	44.8	12%	0.124	25%	0.248	C	C	.	.	S	Bend	trans	-74.1	164.4	-178.8	0	0	0	0	0	114	L540 T541 I550	L540-G548 CarbonylContact O-C 3.45Å; T541-G548 WeakPolarHBondContact O-CA 3.43Å; G548-I550 VanDerWaalsContact C-N 3.26Å; G548-I550 PolarHBondContact O-N 3.12Å
549	F	90.8	Very high	92.3	Very high	140 Å²	140	44.3 Å²	44.3	61%	0.614	24%	0.24	S	C	*	.	S	Bend	trans	-52.3	-43.7	174.6	-63.8	-82.6	0	0	0	113	L540 E542	L540-F549 PolarHBondContact O-N 3.32Å; E542-F549 HydrophobicContact CG-CD2 4.45Å; E542-F549 HydrophobicContact CG-CE2 4.36Å; E542-F549 WeakPolarHBondContact OE1-CE2 3.39Å
550	I	94.1	Very high	92.3	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.031	21%	0.21	C	C	.	.	S	Bend	trans	-134.6	99.4	175.5	-52.6	-174.5	0	0	0	107.2	W422 L423 F427 L540 G548 L559 S560	W422-I550 HydrophobicContact CZ3-CD1 4.35Å; L423-I550 HydrophobicContact CD2-CD1 4.11Å; F427-I550 HydrophobicContact CE2-CD1 3.94Å; F427-I550 HydrophobicContact CE2-CG1 4.35Å; F427-I550 HydrophobicContact CZ-CD1 4.05Å; F427-I550 HydrophobicContact CZ-CG1 3.94Å; L540-I550 HydrophobicContact CD2-CD1 4.22Å; L540-I550 HydrophobicContact CD2-CG1 4.41Å; L540-I550 PolarHBondContact O-N 3.27Å; G548-I550 VanDerWaalsContact C-N 3.26Å; G548-I550 PolarHBondContact O-N 3.12Å; I550-L559 HydrophobicContact CD1-CB 4.38Å; I550-S560 WeakPolarHBondContact O-CB 3.06Å; I550-S560 PolarHBondContact O-OG 3.1Å
551	P	94.1	Very high	92.4	Very high	12 Å²	12	38 Å²	38	8%	0.078	20%	0.202	C	C	.	.			trans	-65.1	153.4	178	27.1	-34.1	0	0	0	111.1	N292 T545 N553 S558 S560	N292-P551 HydrophobicContact CB-CB 4.45Å; T545-P551 WeakPolarHBondContact O-CB 3.33Å; P551-N553 PolarHBondContact O-N 2.88Å; P551-N553 VanDerWaalsContact O-N 3.07Å; P551-S558 PolarHBondContact O-OG 2.84Å; P551-S560 PolarHBondContact O-OG 2.93Å
552	V	95.3	Very high	92.6	Very high	18 Å²	18	37.5 Å²	37.5	11%	0.109	20%	0.2	C	C	.	.			trans	-67.5	110.3	175.6	-179.8	0	0	0	0	108.3	G293 L294 T541 S560 Y561	G293-V552 PolarHBondContact N-O 3.29Å; L294-V552 HydrophobicContact CD1-CG1 3.85Å; L294-V552 HydrophobicContact CD2-CG1 3.52Å; L294-V552 HydrophobicContact CG-CG1 3.51Å; T541-V552 HydrophobicContact CG2-CG2 3.51Å; V552-S560 PolarHBondContact N-OG 2.78Å; V552-Y561 HydrophobicContact CG1-CD2 3.77Å; V552-Y561 HydrophobicContact CG1-CG 4.42Å
553	N	94.8	Very high	92.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-138.3	112.1	-172.4	-170	-51.2	0	0	0	110.5	W291 N292 P551 N555 L556 W557 S558	W291-N553 PolarHBondContact NE1-ND2 3.45Å; W291-N553 PolarHBondContact O-ND2 2.88Å; N292-N553 PolarHBondContact OD1-ND2 3.18Å; P551-N553 PolarHBondContact O-N 2.88Å; P551-N553 VanDerWaalsContact O-N 3.07Å; N553-N555 WeakPolarHBondContact OD1-CA 3.34Å; N553-N555 WeakPolarHBondContact OD1-CB 3.45Å; N553-N555 PolarHBondContact OD1-N 2.97Å; N553-L556 HydrophobicContact CB-CB 4.46Å; N553-L556 PolarHBondContact OD1-N 3.45Å; N553-W557 PolarHBondContact O-N 3.43Å; N553-S558 PolarHBondContact N-OG 2.81Å; N553-S558 VanDerWaalsContact N-OG 3.13Å; N553-S558 PolarHBondContact O-N 3.02Å
554	K	94	Very high	93.1	Very high	20 Å²	20	27.9 Å²	27.9	9%	0.087	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-41.7	175.5	171.2	-177.2	166.2	176.3	0	111.4	H288 D298 L556 W557 Y561	H288-K554 PolarHBondContact CE1-NZ 3Å; H288-K554 PolarHBondContact ND1-NZ 3.22Å; H288-K554 PolarHBondContact NE2-NZ 2.96Å; H288-K554 VanDerWaalsContact NE2-NZ 3.19Å; D298-K554 HydrophobicContact CB-CD 4.04Å; D298-K554 WeakPolarHBondContact OD1-CD 3.44Å; D298-K554 IonicContact OD1-NZ 3.85Å; K554-L556 VanDerWaalsContact C-N 3.27Å; K554-L556 PolarHBondContact O-N 2.89Å; K554-W557 PolarHBondContact O-N 2.85Å; K554-Y561 HydrophobicContact CB-CD2 4.44Å; K554-Y561 HydrophobicContact CB-CE1 4.49Å; K554-Y561 HydrophobicContact CB-CE2 3.85Å; K554-Y561 HydrophobicContact CG-CE2 4.49Å
555	N	92.8	Very high	93.5	Very high	8 Å²	8	26 Å²	26	4%	0.043	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-38.4	-173.4	-65.2	-67.9	0	0	0	111.7	S290 W291 F487 P489 N553	S290-N555 PolarHBondContact O-ND2 2.87Å; W291-N555 HydrophobicContact CE3-CB 4Å; W291-N555 HydrophobicContact CH2-CB 4.35Å; W291-N555 HydrophobicContact CZ3-CB 3.85Å; F487-N555 HydrophobicContact CE1-CB 3.79Å; F487-N555 HydrophobicContact CZ-CB 4.43Å; F487-N555 WeakPolarHBondContact CZ-O 3.11Å; P489-N555 WeakPolarHBondContact CA-O 3.42Å; P489-N555 HydrophobicContact CB-CB 4.41Å; N553-N555 WeakPolarHBondContact OD1-CA 3.34Å; N553-N555 WeakPolarHBondContact OD1-CB 3.45Å; N553-N555 PolarHBondContact OD1-N 2.97Å
556	L	93.5	Very high	94.1	Very high	11 Å²	11	22.4 Å²	22.4	6%	0.058	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.5	175.2	-63.9	175.2	0	0	0	113.6	W291 L439 A458 F487 N553 K554 S558	W291-L556 HydrophobicContact CZ2-CD1 4.39Å; W291-L556 HydrophobicContact CZ2-CD2 4.42Å; W291-L556 HydrophobicContact CZ2-CG 4.29Å; L439-L556 HydrophobicContact CB-CD1 4.03Å; L439-L556 HydrophobicContact CD2-CD1 4.04Å; L439-L556 WeakPolarHBondContact O-CD1 3.12Å; A458-L556 HydrophobicContact CB-CD2 3.73Å; F487-L556 HydrophobicContact CE2-CD2 4.19Å; F487-L556 HydrophobicContact CZ-CD2 3.94Å; N553-L556 HydrophobicContact CB-CB 4.46Å; N553-L556 PolarHBondContact OD1-N 3.45Å; K554-L556 VanDerWaalsContact C-N 3.27Å; K554-L556 PolarHBondContact O-N 2.89Å; L556-S558 PolarHBondContact O-N 2.95Å
557	W	95.6	Very high	94.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	46.3	-166.1	-97	67.1	0	0	0	111.3	F301 P302 V305 N497 M501 N553 K554 Y561 V562	F301-W557 HydrophobicContact CD1-CH2 4.45Å; F301-W557 AromaticContact CD1-CZ2 3.44Å; F301-W557 HydrophobicContact CD1-CZ2 3.44Å; F301-W557 VanDerWaalsContact CD1-CZ2 3.44Å; F301-W557 AromaticContact CE1-CE2 3.99Å; F301-W557 HydrophobicContact CE1-CH2 4.34Å; F301-W557 AromaticContact CE1-CZ2 3.4Å; F301-W557 HydrophobicContact CE1-CZ2 3.4Å; F301-W557 VanDerWaalsContact CE1-CZ2 3.4Å; F301-W557 HydrophobicContact CG-CZ2 4.2Å; F301-W557 HydrophobicContact CZ-CZ2 4.15Å; P302-W557 HydrophobicContact CB-CH2 4.13Å; P302-W557 HydrophobicContact CG-CH2 3.97Å; P302-W557 HydrophobicContact CG-CZ2 4Å; V305-W557 HydrophobicContact CG2-CH2 4.1Å; N497-W557 HydrophobicContact CB-CB 4.46Å; N497-W557 WeakPolarHBondContact CB-O 3.36Å; N497-W557 PolarHBondContact ND2-O 2.91Å; M501-W557 HydrophobicContact CB-CZ3 4.06Å; M501-W557 HydrophobicContact CG-CZ3 4.42Å; N553-W557 PolarHBondContact O-N 3.43Å; K554-W557 PolarHBondContact O-N 2.85Å; W557-Y561 HydrophobicContact CD2-CD1 4.42Å; W557-Y561 HydrophobicContact CD2-CE1 4.06Å; W557-Y561 HydrophobicContact CE3-CE1 4.45Å; W557-Y561 HydrophobicContact CG-CD1 4.48Å; W557-Y561 HydrophobicContact CG-CE1 4.32Å; W557-Y561 HydrophobicContact CZ2-CE1 4.45Å; W557-V562 HydrophobicContact CE3-CG2 3.89Å; W557-V562 HydrophobicContact CZ3-CG2 4.25Å
558	S	95.8	Very high	95.3	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.021	9%	0.092	C	C	.	.			trans	-57.7	157	-169.3	69.7	0	0	0	0	113.3	P551 N553 L556 S560 Y561 V562	P551-S558 PolarHBondContact O-OG 2.84Å; N553-S558 PolarHBondContact N-OG 2.81Å; N553-S558 VanDerWaalsContact N-OG 3.13Å; N553-S558 PolarHBondContact O-N 3.02Å; L556-S558 PolarHBondContact O-N 2.95Å; S558-S560 VanDerWaalsContact C-N 3.26Å; S558-S560 PolarHBondContact O-N 3.1Å; S558-S560 PolarHBondContact OG-OG 2.85Å; S558-S560 VanDerWaalsContact OG-OG 3.08Å; S558-Y561 WeakPolarHBondContact O-CA 3.49Å; S558-Y561 VanDerWaalsContact O-CB 3.29Å; S558-Y561 WeakPolarHBondContact O-CB 3.49Å; S558-Y561 PolarHBondContact O-N 2.68Å; S558-Y561 WeakPolarHBondContact OG-CB 3.24Å; S558-Y561 PolarHBondContact OG-N 3.03Å; S558-V562 PolarHBondContact O-N 2.95Å
559	L	96.3	Very high	95.8	Very high	26 Å²	26	17.7 Å²	17.7	14%	0.136	9%	0.087	C	C	.	.	H	α-helix	trans	-58.8	-38.7	178.8	179.8	59.8	0	0	0	112.3	W422 L423 L500 L540 I550 Y561 V562 T563	W422-L559 HydrophobicContact CH2-CB 4.31Å; W422-L559 HydrophobicContact CZ3-CB 3.86Å; L423-L559 HydrophobicContact CD2-CD2 4.35Å; L500-L559 HydrophobicContact CD2-CD1 3.66Å; L540-L559 HydrophobicContact CD1-CD2 4.15Å; L540-L559 HydrophobicContact CD1-CG 4Å; I550-L559 HydrophobicContact CD1-CB 4.38Å; L559-Y561 VanDerWaalsContact C-N 3.34Å; L559-V562 PolarHBondContact O-N 3.31Å; L559-T563 HydrophobicContact CD1-CG2 4.31Å; L559-T563 WeakPolarHBondContact O-CG2 3.44Å; L559-T563 PolarHBondContact O-N 3.16Å; L559-T563 PolarHBondContact O-OG1 3.4Å
560	S	96.6	Very high	96.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-36.5	173.7	54.5	0	0	0	0	112.3	I550 P551 V552 S558 T563 T564	I550-S560 WeakPolarHBondContact O-CB 3.06Å; I550-S560 PolarHBondContact O-OG 3.1Å; P551-S560 PolarHBondContact O-OG 2.93Å; V552-S560 PolarHBondContact N-OG 2.78Å; S558-S560 VanDerWaalsContact C-N 3.26Å; S558-S560 PolarHBondContact O-N 3.1Å; S558-S560 PolarHBondContact OG-OG 2.85Å; S558-S560 VanDerWaalsContact OG-OG 3.08Å; S560-T563 WeakPolarHBondContact CA-OG1 3.46Å; S560-T563 PolarHBondContact O-OG1 3.34Å; S560-T563 VanDerWaalsContact O-OG1 3.08Å; S560-T564 WeakPolarHBondContact O-CB 3.25Å; S560-T564 PolarHBondContact O-N 3.1Å; S560-T564 PolarHBondContact O-OG1 3.27Å
561	Y	97.1	Very high	96.3	Very high	1 Å²	1	13.8 Å²	13.8	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-62	-50.3	172.2	175.5	-104.7	0	0	0	111.7	L294 D298 P302 V552 K554 W557 S558 L559 T563 T564 L565	L294-Y561 HydrophobicContact CD2-CD2 3.7Å; L294-Y561 HydrophobicContact CD2-CE2 3.63Å; D298-Y561 HydrophobicContact CB-CE2 4.37Å; D298-Y561 PolarHBondContact O-OH 3.22Å; P302-Y561 HydrophobicContact CG-CE1 3.59Å; P302-Y561 WeakPolarHBondContact CG-OH 3.43Å; V552-Y561 HydrophobicContact CG1-CD2 3.77Å; V552-Y561 HydrophobicContact CG1-CG 4.42Å; K554-Y561 HydrophobicContact CB-CD2 4.44Å; K554-Y561 HydrophobicContact CB-CE1 4.49Å; K554-Y561 HydrophobicContact CB-CE2 3.85Å; K554-Y561 HydrophobicContact CG-CE2 4.49Å; W557-Y561 HydrophobicContact CD2-CD1 4.42Å; W557-Y561 HydrophobicContact CD2-CE1 4.06Å; W557-Y561 HydrophobicContact CE3-CE1 4.45Å; W557-Y561 HydrophobicContact CG-CD1 4.48Å; W557-Y561 HydrophobicContact CG-CE1 4.32Å; W557-Y561 HydrophobicContact CZ2-CE1 4.45Å; S558-Y561 WeakPolarHBondContact O-CA 3.49Å; S558-Y561 VanDerWaalsContact O-CB 3.29Å; S558-Y561 WeakPolarHBondContact O-CB 3.49Å; S558-Y561 PolarHBondContact O-N 2.68Å; S558-Y561 WeakPolarHBondContact OG-CB 3.24Å; S558-Y561 PolarHBondContact OG-N 3.03Å; L559-Y561 VanDerWaalsContact C-N 3.34Å; Y561-T563 PolarHBondContact O-N 2.93Å; Y561-T564 PolarHBondContact O-N 3.35Å; Y561-L565 HydrophobicContact CD2-CD2 3.51Å; Y561-L565 HydrophobicContact CD2-CG 4.27Å; Y561-L565 HydrophobicContact CE2-CD2 3.58Å; Y561-L565 HydrophobicContact CE2-CG 3.99Å; Y561-L565 HydrophobicContact CG-CD2 4.15Å; Y561-L565 WeakPolarHBondContact O-CB 3.3Å; Y561-L565 WeakPolarHBondContact O-CD2 3.42Å; Y561-L565 PolarHBondContact O-N 3.17Å
562	V	97.6	Very high	96.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.1	-43.7	178.8	171.9	0	0	0	0	112.2	N497 L500 M501 L504 W557 S558 L559 L565 A566	N497-V562 HydrophobicContact CB-CG2 3.86Å; L500-V562 HydrophobicContact CB-CG1 4.44Å; L500-V562 HydrophobicContact CD2-CG1 3.92Å; L500-V562 HydrophobicContact CG-CG1 4Å; M501-V562 HydrophobicContact CB-CG1 3.87Å; M501-V562 HydrophobicContact SD-CG1 4.2Å; L504-V562 HydrophobicContact CD1-CG1 4.35Å; W557-V562 HydrophobicContact CE3-CG2 3.89Å; W557-V562 HydrophobicContact CZ3-CG2 4.25Å; S558-V562 PolarHBondContact O-N 2.95Å; L559-V562 PolarHBondContact O-N 3.31Å; V562-L565 PolarHBondContact O-N 3.15Å; V562-A566 WeakPolarHBondContact O-CB 3.34Å; V562-A566 PolarHBondContact O-N 2.92Å
563	T	97.6	Very high	96.5	Very high	7 Å²	7	14 Å²	14	4%	0.043	7%	0.074	C	C	.	.	H	α-helix	trans	-67.3	-41	179.1	50.9	0	0	0	0	112.6	L533 V536 L559 S560 Y561 C567	L533-T563 HydrophobicContact CD2-CG2 4.14Å; V536-T563 HydrophobicContact CG1-CG2 4.08Å; L559-T563 HydrophobicContact CD1-CG2 4.31Å; L559-T563 WeakPolarHBondContact O-CG2 3.44Å; L559-T563 PolarHBondContact O-N 3.16Å; L559-T563 PolarHBondContact O-OG1 3.4Å; S560-T563 WeakPolarHBondContact CA-OG1 3.46Å; S560-T563 PolarHBondContact O-OG1 3.34Å; S560-T563 VanDerWaalsContact O-OG1 3.08Å; Y561-T563 PolarHBondContact O-N 2.93Å; T563-C567 WeakPolarHBondContact O-CB 3.38Å; T563-C567 PolarHBondContact O-N 2.83Å
564	T	97.4	Very high	96.6	Very high	14 Å²	14	14.8 Å²	14.8	9%	0.086	8%	0.078	C	C	.	.	H	α-helix	trans	-58.3	-50.8	172.6	-55.3	0	0	0	0	111	L294 S537 S560 Y561 A566 C567 F568	L294-T564 HydrophobicContact CD1-CG2 3.83Å; S537-T564 PolarHBondContact OG-OG1 2.85Å; S560-T564 WeakPolarHBondContact O-CB 3.25Å; S560-T564 PolarHBondContact O-N 3.1Å; S560-T564 PolarHBondContact O-OG1 3.27Å; Y561-T564 PolarHBondContact O-N 3.35Å; T564-A566 PolarHBondContact O-N 3.36Å; T564-C567 WeakPolarHBondContact O-CB 3.45Å; T564-C567 PolarHBondContact O-N 2.95Å; T564-F568 HydrophobicContact CG2-CD2 4.29Å; T564-F568 HydrophobicContact CG2-CE1 4.4Å; T564-F568 HydrophobicContact CG2-CE2 3.73Å; T564-F568 HydrophobicContact CG2-CZ 3.79Å; T564-F568 PolarHBondContact O-N 3.23Å; T564-F568 VanDerWaalsContact O-N 3.08Å
565	L	97.6	Very high	96.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-72.9	-32.4	-172.8	-82.9	-65.7	0	0	0	112	L294 L299 P302 W303 M501 Y561 V562 F568 A569	L294-L565 HydrophobicContact CD1-CD2 4.2Å; L294-L565 HydrophobicContact CD2-CD2 3.77Å; L299-L565 HydrophobicContact CB-CD1 4.16Å; L299-L565 HydrophobicContact CD2-CD1 3.44Å; L299-L565 VanDerWaalsContact CD2-CD1 3.44Å; L299-L565 HydrophobicContact CG-CD1 4.4Å; P302-L565 HydrophobicContact CB-CB 3.91Å; P302-L565 HydrophobicContact CB-CG 4.09Å; P302-L565 HydrophobicContact CG-CB 4.43Å; P302-L565 HydrophobicContact CG-CG 4.08Å; W303-L565 PolarHBondContact NE1-O 3.24Å; M501-L565 HydrophobicContact CE-CB 3.94Å; Y561-L565 HydrophobicContact CD2-CD2 3.51Å; Y561-L565 HydrophobicContact CD2-CG 4.27Å; Y561-L565 HydrophobicContact CE2-CD2 3.58Å; Y561-L565 HydrophobicContact CE2-CG 3.99Å; Y561-L565 HydrophobicContact CG-CD2 4.15Å; Y561-L565 WeakPolarHBondContact O-CB 3.3Å; Y561-L565 WeakPolarHBondContact O-CD2 3.42Å; Y561-L565 PolarHBondContact O-N 3.17Å; V562-L565 PolarHBondContact O-N 3.15Å; L565-F568 HydrophobicContact CD1-CD2 4.48Å; L565-F568 PolarHBondContact O-N 2.78Å; L565-A569 WeakPolarHBondContact O-CB 3.38Å; L565-A569 PolarHBondContact O-N 3.35Å
566	A	98.2	Very high	96.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.7	-41.5	170.9	0	0	0	0	0	111.5	M501 L504 L533 V562 T564 F568 A569 F570	M501-A566 HydrophobicContact CE-CB 4.3Å; M501-A566 HydrophobicContact SD-CB 3.82Å; L504-A566 HydrophobicContact CD1-CB 3.54Å; L533-A566 HydrophobicContact CD1-CB 3.75Å; V562-A566 WeakPolarHBondContact O-CB 3.34Å; V562-A566 PolarHBondContact O-N 2.92Å; T564-A566 PolarHBondContact O-N 3.36Å; A566-F568 PolarHBondContact O-N 3.43Å; A566-A569 PolarHBondContact O-N 3.42Å; A566-F570 WeakPolarHBondContact O-CD2 3.26Å; A566-F570 PolarHBondContact O-N 2.79Å
567	C	97.8	Very high	96.8	Very high	18 Å²	18	18.9 Å²	18.9	12%	0.122	10%	0.1	C	C	.	.	H	α-helix	trans	-54.9	-52.2	172	169.2	0	0	0	0	111.2	G530 L533 T563 T564 A569 F570 V571	G530-C567 PolarHBondContact O-SG 3.28Å; L533-C567 HydrophobicContact CB-CB 4.25Å; T563-C567 WeakPolarHBondContact O-CB 3.38Å; T563-C567 PolarHBondContact O-N 2.83Å; T564-C567 WeakPolarHBondContact O-CB 3.45Å; T564-C567 PolarHBondContact O-N 2.95Å; C567-A569 VanDerWaalsContact C-N 3.3Å; C567-A569 PolarHBondContact O-N 3.48Å; C567-F570 PolarHBondContact O-N 3.04Å; C567-V571 WeakPolarHBondContact O-CG2 3.29Å; C567-V571 PolarHBondContact O-N 3.44Å
568	F	97.7	Very high	96.7	Very high	87 Å²	87	22.8 Å²	22.8	38%	0.382	12%	0.115	S	C	.	.	H	α-helix	trans	-61.6	-37.9	177.2	-63.5	-15.2	0	0	0	112.6	L294 L299 W303 T564 L565 A566 V571 L572	L294-F568 HydrophobicContact CD1-CE2 4.28Å; L299-F568 HydrophobicContact CD2-CD2 4.25Å; L299-F568 HydrophobicContact CD2-CE2 4.49Å; W303-F568 HydrophobicContact CZ2-CB 3.98Å; T564-F568 HydrophobicContact CG2-CD2 4.29Å; T564-F568 HydrophobicContact CG2-CE1 4.4Å; T564-F568 HydrophobicContact CG2-CE2 3.73Å; T564-F568 HydrophobicContact CG2-CZ 3.79Å; T564-F568 PolarHBondContact O-N 3.23Å; T564-F568 VanDerWaalsContact O-N 3.08Å; L565-F568 HydrophobicContact CD1-CD2 4.48Å; L565-F568 PolarHBondContact O-N 2.78Å; A566-F568 PolarHBondContact O-N 3.43Å; F568-V571 PolarHBondContact O-N 3.42Å; F568-L572 VanDerWaalsContact O-CB 3.25Å; F568-L572 WeakPolarHBondContact O-CB 3.42Å; F568-L572 PolarHBondContact O-N 3.08Å
569	A	97.9	Very high	96.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.2	-41.2	176.8	0	0	0	0	0	112.4	F265 F306 M501 L565 A566 C567 L572 L573	F265-A569 HydrophobicContact CE1-CB 4.45Å; F265-A569 HydrophobicContact CZ-CB 4.13Å; F306-A569 HydrophobicContact CB-CB 4.36Å; F306-A569 HydrophobicContact CD1-CB 3.78Å; F306-A569 HydrophobicContact CD2-CB 4.06Å; F306-A569 HydrophobicContact CE1-CB 4Å; F306-A569 HydrophobicContact CE2-CB 4.26Å; F306-A569 HydrophobicContact CG-CB 3.81Å; F306-A569 HydrophobicContact CZ-CB 4.23Å; M501-A569 HydrophobicContact CE-CB 4.39Å; L565-A569 WeakPolarHBondContact O-CB 3.38Å; L565-A569 PolarHBondContact O-N 3.35Å; A566-A569 PolarHBondContact O-N 3.42Å; C567-A569 VanDerWaalsContact C-N 3.3Å; C567-A569 PolarHBondContact O-N 3.48Å; A569-L572 PolarHBondContact O-N 2.84Å; A569-L573 WeakPolarHBondContact O-CB 3.41Å; A569-L573 PolarHBondContact O-N 2.72Å
570	F	98.1	Very high	96.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-45.1	175.3	-84	-68.5	0	0	0	111.8	F306 A508 F526 W529 L533 A566 C567 L573 V574	F306-F570 HydrophobicContact CE2-CD2 4.08Å; F306-F570 HydrophobicContact CE2-CE1 4.33Å; F306-F570 AromaticContact CE2-CE2 3.67Å; F306-F570 HydrophobicContact CE2-CE2 3.67Å; F306-F570 AromaticContact CE2-CZ 3.81Å; F306-F570 HydrophobicContact CE2-CZ 3.81Å; F306-F570 AromaticContact CZ-CD1 3.97Å; F306-F570 HydrophobicContact CZ-CD1 3.97Å; F306-F570 HydrophobicContact CZ-CD2 4.12Å; F306-F570 AromaticContact CZ-CE1 3.81Å; F306-F570 HydrophobicContact CZ-CE1 3.81Å; F306-F570 AromaticContact CZ-CE2 3.92Å; F306-F570 HydrophobicContact CZ-CE2 3.92Å; F306-F570 HydrophobicContact CZ-CG 4.12Å; F306-F570 AromaticContact CZ-CZ 3.77Å; F306-F570 HydrophobicContact CZ-CZ 3.77Å; A508-F570 HydrophobicContact CB-CD1 4.44Å; A508-F570 HydrophobicContact CB-CE1 3.6Å; A508-F570 HydrophobicContact CB-CZ 4.14Å; F526-F570 HydrophobicContact CB-CD1 4.01Å; F526-F570 AromaticContact CD1-CD1 3.73Å; F526-F570 HydrophobicContact CD1-CD1 3.73Å; F526-F570 AromaticContact CD1-CE1 3.81Å; F526-F570 HydrophobicContact CD1-CE1 3.81Å; F526-F570 HydrophobicContact CE1-CD1 4.41Å; F526-F570 HydrophobicContact CE1-CE1 4.22Å; F526-F570 HydrophobicContact CG-CD1 4Å; W529-F570 HydrophobicContact CB-CD1 4.18Å; W529-F570 HydrophobicContact CB-CD2 3.97Å; W529-F570 HydrophobicContact CB-CE1 4.01Å; W529-F570 HydrophobicContact CB-CE2 3.83Å; W529-F570 HydrophobicContact CB-CG 4.17Å; W529-F570 HydrophobicContact CB-CZ 3.85Å; W529-F570 HydrophobicContact CG-CE1 4.38Å; W529-F570 HydrophobicContact CG-CE2 4.41Å; W529-F570 HydrophobicContact CG-CZ 4.09Å; L533-F570 HydrophobicContact CD1-CD2 3.83Å; L533-F570 HydrophobicContact CD1-CE2 3.61Å; A566-F570 WeakPolarHBondContact O-CD2 3.26Å; A566-F570 PolarHBondContact O-N 2.79Å; C567-F570 PolarHBondContact O-N 3.04Å; F570-L573 PolarHBondContact O-N 3.31Å; F570-V574 WeakPolarHBondContact O-CG2 3.28Å; F570-V574 PolarHBondContact O-N 3.44Å
571	V	97.5	Very high	95.8	Very high	63 Å²	63	24.6 Å²	24.6	38%	0.382	13%	0.126	S	C	.	.	H	α-helix	trans	-61.2	-47.2	176.3	173.4	0	0	0	0	110.7	C567 F568 L573 V574 L575	C567-V571 WeakPolarHBondContact O-CG2 3.29Å; C567-V571 PolarHBondContact O-N 3.44Å; F568-V571 PolarHBondContact O-N 3.42Å; V571-L573 VanDerWaalsContact C-N 3.32Å; V571-L573 PolarHBondContact O-N 3.29Å; V571-V574 WeakPolarHBondContact O-CB 3.37Å; V571-V574 PolarHBondContact O-N 2.88Å; V571-L575 HydrophobicContact CG1-CD1 4.4Å; V571-L575 WeakPolarHBondContact O-CG 3.42Å; V571-L575 PolarHBondContact O-N 2.87Å
572	L	96.8	Very high	95.4	Very high	33 Å²	33	27.1 Å²	27.1	17%	0.173	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-40.7	177.4	-178.3	56	0	0	0	111.8	F265 W303 F568 A569 V574 L575 I576	F265-L572 HydrophobicContact CD2-CD2 3.86Å; F265-L572 HydrophobicContact CD2-CG 4.34Å; F265-L572 HydrophobicContact CE1-CG 4.48Å; F265-L572 HydrophobicContact CE2-CD2 3.35Å; F265-L572 HydrophobicContact CE2-CG 4.08Å; F265-L572 HydrophobicContact CZ-CB 4.37Å; F265-L572 HydrophobicContact CZ-CD2 3.74Å; F265-L572 HydrophobicContact CZ-CG 4.17Å; W303-L572 HydrophobicContact CD2-CD2 4.17Å; W303-L572 HydrophobicContact CE3-CD2 3.84Å; W303-L572 HydrophobicContact CH2-CD2 4.03Å; W303-L572 HydrophobicContact CZ2-CD2 4.34Å; W303-L572 HydrophobicContact CZ3-CD2 3.76Å; F568-L572 VanDerWaalsContact O-CB 3.25Å; F568-L572 WeakPolarHBondContact O-CB 3.42Å; F568-L572 PolarHBondContact O-N 3.08Å; A569-L572 PolarHBondContact O-N 2.84Å; L572-V574 VanDerWaalsContact C-N 3.35Å; L572-V574 PolarHBondContact O-N 3.4Å; L572-L575 PolarHBondContact O-N 3.3Å; L572-I576 HydrophobicContact CD1-CD1 3.73Å; L572-I576 HydrophobicContact CD1-CG1 4.03Å; L572-I576 HydrophobicContact CG-CD1 3.8Å; L572-I576 HydrophobicContact CG-CG1 4.45Å; L572-I576 WeakPolarHBondContact O-CG1 3.33Å; L572-I576 PolarHBondContact O-N 3.45Å
573	L	96.1	Very high	95	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-39	176.2	-175.3	62.6	0	0	0	111.5	F265 F306 I307 A508 F526 A569 F570 V571 Y577	F265-L573 HydrophobicContact CD1-CB 4.25Å; F265-L573 HydrophobicContact CD1-CD1 4.01Å; F265-L573 HydrophobicContact CE1-CB 4.15Å; F306-L573 HydrophobicContact CE1-CD2 4.2Å; I307-L573 HydrophobicContact CD1-CD1 4.44Å; A508-L573 HydrophobicContact CB-CD2 4.06Å; F526-L573 HydrophobicContact CD2-CD2 4.06Å; F526-L573 HydrophobicContact CD2-CG 4.12Å; F526-L573 HydrophobicContact CE1-CD2 4.25Å; F526-L573 HydrophobicContact CE2-CD2 3.38Å; F526-L573 HydrophobicContact CE2-CG 3.62Å; F526-L573 HydrophobicContact CZ-CD2 3.47Å; F526-L573 VanDerWaalsContact CZ-CD2 3.47Å; F526-L573 HydrophobicContact CZ-CG 4.22Å; A569-L573 WeakPolarHBondContact O-CB 3.41Å; A569-L573 PolarHBondContact O-N 2.72Å; F570-L573 PolarHBondContact O-N 3.31Å; V571-L573 VanDerWaalsContact C-N 3.32Å; V571-L573 PolarHBondContact O-N 3.29Å; L573-Y577 WeakPolarHBondContact O-CB 3.37Å; L573-Y577 PolarHBondContact O-N 2.92Å
574	V	96.6	Very high	94.4	Very high	17 Å²	17	38.1 Å²	38.1	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-49.8	172.3	168.5	0	0	0	0	110.9	I523 F526 L527 F570 V571 L572 I576 Y577 Y578	I523-V574 HydrophobicContact CG2-CG1 3.88Å; F526-V574 HydrophobicContact CB-CG2 3.34Å; F526-V574 HydrophobicContact CD2-CG2 3.88Å; F526-V574 HydrophobicContact CG-CG2 4.14Å; L527-V574 HydrophobicContact CD2-CG2 4.31Å; L527-V574 HydrophobicContact CG-CG2 4.3Å; F570-V574 WeakPolarHBondContact O-CG2 3.28Å; F570-V574 PolarHBondContact O-N 3.44Å; V571-V574 WeakPolarHBondContact O-CB 3.37Å; V571-V574 PolarHBondContact O-N 2.88Å; L572-V574 VanDerWaalsContact C-N 3.35Å; L572-V574 PolarHBondContact O-N 3.4Å; V574-I576 PolarHBondContact O-N 3.37Å; V574-Y577 PolarHBondContact O-N 3.24Å; V574-Y578 WeakPolarHBondContact O-CB 3.35Å; V574-Y578 PolarHBondContact O-N 2.86Å
575	L	96.1	Very high	93.7	Very high	102 Å²	102	46.3 Å²	46.3	53%	0.534	22%	0.218	S	C	.	.	H	α-helix	trans	-60	-48	-179	-66.2	174.1	0	0	0	111.4	V571 L572 T579	V571-L575 HydrophobicContact CG1-CD1 4.4Å; V571-L575 WeakPolarHBondContact O-CG 3.42Å; V571-L575 PolarHBondContact O-N 2.87Å; L572-L575 PolarHBondContact O-N 3.3Å; L575-T579 WeakPolarHBondContact O-CB 3.33Å; L575-T579 WeakPolarHBondContact O-CG2 3.41Å; L575-T579 PolarHBondContact O-N 3.34Å; L575-T579 PolarHBondContact O-OG1 3.14Å
576	I	94.9	Very high	92.9	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-70	-43.6	-178.7	-64.4	174.2	0	0	0	111.1	S261 T264 F265 I268 L572 V574 T579 I580	S261-I576 WeakPolarHBondContact O-CG2 3.19Å; T264-I576 HydrophobicContact CG2-CG2 4.41Å; F265-I576 HydrophobicContact CB-CD1 3.7Å; F265-I576 HydrophobicContact CD2-CD1 4.27Å; F265-I576 HydrophobicContact CG-CD1 3.94Å; I268-I576 HydrophobicContact CD1-CD1 3.8Å; L572-I576 HydrophobicContact CD1-CD1 3.73Å; L572-I576 HydrophobicContact CD1-CG1 4.03Å; L572-I576 HydrophobicContact CG-CD1 3.8Å; L572-I576 HydrophobicContact CG-CG1 4.45Å; L572-I576 WeakPolarHBondContact O-CG1 3.33Å; L572-I576 PolarHBondContact O-N 3.45Å; V574-I576 PolarHBondContact O-N 3.37Å; I576-T579 PolarHBondContact O-OG1 2.67Å; I576-I580 HydrophobicContact CG2-CD1 3.58Å; I576-I580 HydrophobicContact CG2-CG1 4.41Å; I576-I580 WeakPolarHBondContact O-CB 3.29Å; I576-I580 WeakPolarHBondContact O-CG1 3.18Å; I576-I580 PolarHBondContact O-N 2.82Å
577	Y	94.2	Very high	92	Very high	16 Å²	16	52.9 Å²	52.9	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-46.8	178.3	176.5	-104.5	0	0	0	111.7	L512 P519 V522 I523 L573 V574 D581 V582	L512-Y577 HydrophobicContact CD2-CD2 4.13Å; L512-Y577 HydrophobicContact CD2-CE2 3.87Å; P519-Y577 HydrophobicContact CB-CE1 4.1Å; V522-Y577 HydrophobicContact CB-CE1 4.18Å; V522-Y577 HydrophobicContact CG1-CD1 4.26Å; V522-Y577 HydrophobicContact CG1-CE1 3.91Å; I523-Y577 HydrophobicContact CD1-CD1 4.48Å; I523-Y577 HydrophobicContact CG1-CD1 4.08Å; I523-Y577 HydrophobicContact CG1-CE1 4.26Å; L573-Y577 WeakPolarHBondContact O-CB 3.37Å; L573-Y577 PolarHBondContact O-N 2.92Å; V574-Y577 PolarHBondContact O-N 3.24Å; Y577-D581 HydrophobicContact CD2-CB 4.02Å; Y577-D581 HydrophobicContact CE2-CB 4.03Å; Y577-D581 PolarHBondContact O-N 2.85Å; Y577-V582 HydrophobicContact CD1-CG2 4Å; Y577-V582 HydrophobicContact CE1-CG2 3.63Å; Y577-V582 PolarHBondContact O-N 2.86Å
578	Y	93.9	Very high	91.2	Very high	83 Å²	83	52 Å²	52	33%	0.325	25%	0.246	S	C	.	.	I	π-helix	trans	-63.2	-46.8	178.5	-178.9	-100.6	0	0	0	112	I523 V574 V582 K583 W585	I523-Y578 HydrophobicContact CD1-CD2 3.81Å; V574-Y578 WeakPolarHBondContact O-CB 3.35Å; V574-Y578 PolarHBondContact O-N 2.86Å; Y578-V582 HydrophobicContact CD2-CB 4.2Å; Y578-V582 HydrophobicContact CD2-CG1 4.18Å; Y578-V582 HydrophobicContact CE2-CG1 4.36Å; Y578-V582 WeakPolarHBondContact O-CB 3.32Å; Y578-K583 HydrophobicContact CD1-CG 4.11Å; Y578-K583 HydrophobicContact CD2-CG 4.5Å; Y578-K583 HydrophobicContact CE1-CG 3.54Å; Y578-K583 HydrophobicContact CE2-CG 4.01Å; Y578-K583 WeakPolarHBondContact O-CB 3.06Å; Y578-K583 PolarHBondContact O-N 2.84Å; Y578-K583 WeakPolarHBondContact OH-CE 3.32Å; Y578-W585 HydrophobicContact CE1-CH2 4.33Å; Y578-W585 HydrophobicContact CE1-CZ3 4.35Å
579	T	91.2	Very high	90.5	Very high	37 Å²	37	48.4 Å²	48.4	23%	0.227	23%	0.232	C	C	.	.	I	π-helix	trans	-69.2	-37	-176.9	52.8	0	0	0	0	113.1	L575 I576 K584 W585	L575-T579 WeakPolarHBondContact O-CB 3.33Å; L575-T579 WeakPolarHBondContact O-CG2 3.41Å; L575-T579 PolarHBondContact O-N 3.34Å; L575-T579 PolarHBondContact O-OG1 3.14Å; I576-T579 PolarHBondContact O-OG1 2.67Å; T579-K584 CarbonylContact O-C 3.58Å; T579-K584 WeakPolarHBondContact O-CA 3.35Å; T579-K584 PolarHBondContact O-N 2.9Å; T579-K584 VanDerWaalsContact O-N 3.13Å; T579-W585 HydrophobicContact CG2-CE3 4.47Å; T579-W585 PolarHBondContact O-N 3.16Å
580	I	88.8	Confident	90	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.036	25%	0.247	C	C	.	.	I	π-helix	trans	-95.7	-50.4	-172.6	-61.1	177.6	0	0	0	112.8	R260 T264 I576 K584 W586	R260-I580 HydrophobicContact CB-CG2 3.7Å; T264-I580 HydrophobicContact CG2-CD1 3.67Å; T264-I580 WeakPolarHBondContact OG1-CD1 3.31Å; I576-I580 HydrophobicContact CG2-CD1 3.58Å; I576-I580 HydrophobicContact CG2-CG1 4.41Å; I576-I580 WeakPolarHBondContact O-CB 3.29Å; I576-I580 WeakPolarHBondContact O-CG1 3.18Å; I576-I580 PolarHBondContact O-N 2.82Å; I580-K584 WeakPolarHBondContact O-CA 3.48Å; I580-K584 WeakPolarHBondContact O-CG 3.47Å; I580-W586 WeakPolarHBondContact CA-O 2.91Å; I580-W586 HydrophobicContact CD1-CD2 4.47Å; I580-W586 HydrophobicContact CD1-CE3 3.69Å; I580-W586 HydrophobicContact CD1-CZ3 3.9Å; I580-W586 HydrophobicContact CG1-CD2 4.46Å; I580-W586 HydrophobicContact CG1-CE3 3.81Å; I580-W586 HydrophobicContact CG1-CZ3 4.48Å
581	D	88.9	Confident	89.7	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.123	26%	0.26	C	S	.	.	I	π-helix	trans	-93.6	-34.4	-170.3	-73.1	-44	0	0	0	112.4	S261 Y577	S261-D581 WeakPolarHBondContact CB-OD2 2.93Å; S261-D581 PolarHBondContact N-OD2 3.38Å; S261-D581 PolarHBondContact OG-OD2 2.96Å; Y577-D581 HydrophobicContact CD2-CB 4.02Å; Y577-D581 HydrophobicContact CE2-CB 4.03Å; Y577-D581 PolarHBondContact O-N 2.85Å
582	V	88.9	Confident	89.3	Confident	54 Å²	54	51.5 Å²	51.5	33%	0.327	25%	0.245	S	C	.	.	I	π-helix	trans	-85.6	-67.8	178.8	-175.8	0	0	0	0	111.7	P519 Y577 Y578	P519-V582 HydrophobicContact CB-CG2 3.85Å; Y577-V582 HydrophobicContact CD1-CG2 4Å; Y577-V582 HydrophobicContact CE1-CG2 3.63Å; Y577-V582 PolarHBondContact O-N 2.86Å; Y578-V582 HydrophobicContact CD2-CB 4.2Å; Y578-V582 HydrophobicContact CD2-CG1 4.18Å; Y578-V582 HydrophobicContact CE2-CG1 4.36Å; Y578-V582 WeakPolarHBondContact O-CB 3.32Å
583	K	87.9	Confident	88.9	Confident	101 Å²	101	50.1 Å²	50.1	44%	0.439	24%	0.237	S	C	.	.	S	Bend	trans	-80.7	-22.5	-176.2	-74.2	-65.6	-172.8	-178.8	0	113.8	Y578 W585	Y578-K583 HydrophobicContact CD1-CG 4.11Å; Y578-K583 HydrophobicContact CD2-CG 4.5Å; Y578-K583 HydrophobicContact CE1-CG 3.54Å; Y578-K583 HydrophobicContact CE2-CG 4.01Å; Y578-K583 WeakPolarHBondContact O-CB 3.06Å; Y578-K583 PolarHBondContact O-N 2.84Å; Y578-K583 WeakPolarHBondContact OH-CE 3.32Å; K583-W585 HydrophobicContact CB-CD2 3.84Å; K583-W585 HydrophobicContact CB-CG 3.88Å; K583-W585 HydrophobicContact CB-CZ2 4.39Å; K583-W585 HydrophobicContact CD-CZ2 4.05Å; K583-W585 HydrophobicContact CG-CD2 4.33Å; K583-W585 HydrophobicContact CG-CZ2 4.04Å; K583-W585 PolarHBondContact O-N 3.05Å
584	K	85.3	Confident	88.7	Confident	136 Å²	136	50.1 Å²	50.1	59%	0.591	24%	0.237	S	C	*	.			trans	52.8	33	-177.5	-56.4	173.7	-175.9	165.8	0	113	T579 I580 W586	T579-K584 CarbonylContact O-C 3.58Å; T579-K584 WeakPolarHBondContact O-CA 3.35Å; T579-K584 PolarHBondContact O-N 2.9Å; T579-K584 VanDerWaalsContact O-N 3.13Å; I580-K584 WeakPolarHBondContact O-CA 3.48Å; I580-K584 WeakPolarHBondContact O-CG 3.47Å; K584-W586 PolarHBondContact O-N 3.39Å
585	W	82.5	Confident	88.4	Confident	186 Å²	186	49.3 Å²	49.3	71%	0.705	23%	0.232	S	C	*	.	S	Bend	trans	-67.7	-31.4	175.7	-70.3	-14.1	0	0	0	111.4	Y578 T579 K583	Y578-W585 HydrophobicContact CE1-CH2 4.33Å; Y578-W585 HydrophobicContact CE1-CZ3 4.35Å; T579-W585 HydrophobicContact CG2-CE3 4.47Å; T579-W585 PolarHBondContact O-N 3.16Å; K583-W585 HydrophobicContact CB-CD2 3.84Å; K583-W585 HydrophobicContact CB-CG 3.88Å; K583-W585 HydrophobicContact CB-CZ2 4.39Å; K583-W585 HydrophobicContact CD-CZ2 4.05Å; K583-W585 HydrophobicContact CG-CD2 4.33Å; K583-W585 HydrophobicContact CG-CZ2 4.04Å; K583-W585 PolarHBondContact O-N 3.05Å
586	W	81.4	Confident	88	Confident	83 Å²	83	45.6 Å²	45.6	31%	0.314	21%	0.213	S	C	.	.			trans	-132.1	144.2	179.8	179.7	47.1	0	0	0	110.5	T264 I268 I580 K584 G588 A589 F591	T264-W586 HydrophobicContact CG2-CH2 3.49Å; T264-W586 VanDerWaalsContact CG2-CH2 3.49Å; T264-W586 HydrophobicContact CG2-CZ2 4.34Å; T264-W586 HydrophobicContact CG2-CZ3 3.61Å; I268-W586 HydrophobicContact CD1-CH2 4.28Å; I580-W586 WeakPolarHBondContact CA-O 2.91Å; I580-W586 HydrophobicContact CD1-CD2 4.47Å; I580-W586 HydrophobicContact CD1-CE3 3.69Å; I580-W586 HydrophobicContact CD1-CZ3 3.9Å; I580-W586 HydrophobicContact CG1-CD2 4.46Å; I580-W586 HydrophobicContact CG1-CE3 3.81Å; I580-W586 HydrophobicContact CG1-CZ3 4.48Å; K584-W586 PolarHBondContact O-N 3.39Å; W586-G588 VanDerWaalsContact C-N 3.31Å; W586-G588 VanDerWaalsContact CE2-CA 3.49Å; W586-A589 VanDerWaalsContact CE2-O 3.31Å; W586-A589 WeakPolarHBondContact CZ2-O 3.3Å; W586-A589 PolarHBondContact NE1-O 3.33Å; W586-F591 AromaticContact CH2-CD2 3.49Å; W586-F591 HydrophobicContact CH2-CD2 3.49Å; W586-F591 VanDerWaalsContact CH2-CD2 3.49Å; W586-F591 AromaticContact CH2-CE2 3.96Å; W586-F591 HydrophobicContact CH2-CE2 3.96Å; W586-F591 AromaticContact CZ2-CD2 3.51Å; W586-F591 HydrophobicContact CZ2-CD2 3.51Å; W586-F591 AromaticContact CZ2-CE2 3.88Å; W586-F591 HydrophobicContact CZ2-CE2 3.88Å
587	S	78.6	Confident	87.8	Confident	56 Å²	56	45.3 Å²	45.3	39%	0.392	21%	0.211	S	C	.	.			trans	-83.1	-7.7	179.7	58.9	0	0	0	0	114	A589	S587-A589 VanDerWaalsContact C-N 3.35Å
588	G	82.9	Confident	87.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.215	C	C	.	.			trans	85.1	2.3	-170.3	0	0	0	0	0	114.7	T264 W586 F591 Y592	T264-G588 WeakPolarHBondContact OG1-CA 3.06Å; W586-G588 VanDerWaalsContact C-N 3.31Å; W586-G588 VanDerWaalsContact CE2-CA 3.49Å; G588-F591 PolarHBondContact O-N 2.86Å; G588-F591 VanDerWaalsContact O-N 3.13Å; G588-Y592 WeakPolarHBondContact O-CD1 3.27Å; G588-Y592 PolarHBondContact O-N 3.05Å
589	A	81.8	Confident	87.4	Confident	10 Å²	10	42.9 Å²	42.9	8%	0.083	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	141.3	179.9	0	0	0	0	0	110.1	M39 W586 S587 Y592 Y593	M39-A589 HydrophobicContact CE-CB 3.88Å; M39-A589 HydrophobicContact SD-CB 3.55Å; M39-A589 VanDerWaalsContact SD-CB 3.55Å; W586-A589 VanDerWaalsContact CE2-O 3.31Å; W586-A589 WeakPolarHBondContact CZ2-O 3.3Å; W586-A589 PolarHBondContact NE1-O 3.33Å; S587-A589 VanDerWaalsContact C-N 3.35Å; A589-Y592 HydrophobicContact CB-CD1 4.15Å; A589-Y592 HydrophobicContact CB-CE1 3.78Å; A589-Y593 HydrophobicContact CB-CE2 4.2Å
590	P	87.1	Confident	87.5	Confident	50 Å²	50	42.5 Å²	42.5	33%	0.325	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.1	-7.2	8.2	34.6	-36.2	0	0	0	114.9	Y592 Y593 P594 V639	P590-Y592 PolarHBondContact O-N 2.84Å; P590-Y593 HydrophobicContact CB-CD2 4.14Å; P590-Y593 HydrophobicContact CB-CE2 4.35Å; P590-Y593 WeakPolarHBondContact O-CB 3.45Å; P590-Y593 WeakPolarHBondContact O-CD2 3.49Å; P590-Y593 PolarHBondContact O-N 2.86Å; P590-Y593 VanDerWaalsContact O-N 3.15Å; P590-P594 WeakPolarHBondContact O-CD 3.27Å; P590-V639 HydrophobicContact CB-CG1 3.75Å; P590-V639 HydrophobicContact CG-CG1 4.19Å
591	F	91.9	Very high	87.7	Confident	60 Å²	60	42.2 Å²	42.2	26%	0.263	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-27.4	-167.5	-53.4	-82.1	0	0	0	115.1	T264 G267 I268 V271 W586 G588 Y593 P594 G595	T264-F591 HydrophobicContact CG2-CB 4.13Å; G267-F591 VanDerWaalsContact CA-O 3.25Å; G267-F591 WeakPolarHBondContact CA-O 3.31Å; I268-F591 HydrophobicContact CG1-CB 3.76Å; I268-F591 HydrophobicContact CG1-CD1 3.87Å; I268-F591 HydrophobicContact CG1-CD2 3.95Å; I268-F591 HydrophobicContact CG1-CE1 4.47Å; I268-F591 HydrophobicContact CG1-CG 3.58Å; V271-F591 HydrophobicContact CB-CD1 4.16Å; V271-F591 HydrophobicContact CB-CE1 4.35Å; V271-F591 HydrophobicContact CG1-CD1 4.38Å; V271-F591 HydrophobicContact CG1-CE1 4.09Å; V271-F591 HydrophobicContact CG2-CD1 4Å; V271-F591 HydrophobicContact CG2-CE1 4.5Å; W586-F591 AromaticContact CH2-CD2 3.49Å; W586-F591 HydrophobicContact CH2-CD2 3.49Å; W586-F591 VanDerWaalsContact CH2-CD2 3.49Å; W586-F591 AromaticContact CH2-CE2 3.96Å; W586-F591 HydrophobicContact CH2-CE2 3.96Å; W586-F591 AromaticContact CZ2-CD2 3.51Å; W586-F591 HydrophobicContact CZ2-CD2 3.51Å; W586-F591 AromaticContact CZ2-CE2 3.88Å; W586-F591 HydrophobicContact CZ2-CE2 3.88Å; G588-F591 PolarHBondContact O-N 2.86Å; G588-F591 VanDerWaalsContact O-N 3.13Å; F591-Y593 PolarHBondContact O-N 3.07Å; F591-Y593 VanDerWaalsContact O-N 3.11Å; F591-P594 WeakPolarHBondContact O-CD 3.27Å; F591-P594 WeakPolarHBondContact O-CG 3.25Å; F591-G595 PolarHBondContact O-N 3.04Å
592	Y	88.8	Confident	87.9	Confident	18 Å²	18	42.3 Å²	42.3	7%	0.071	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-21	176.5	82.4	-104.3	0	0	0	112.9	G588 A589 P590 G595 M596 Y646	G588-Y592 WeakPolarHBondContact O-CD1 3.27Å; G588-Y592 PolarHBondContact O-N 3.05Å; A589-Y592 HydrophobicContact CB-CD1 4.15Å; A589-Y592 HydrophobicContact CB-CE1 3.78Å; P590-Y592 PolarHBondContact O-N 2.84Å; Y592-G595 PolarHBondContact O-N 2.84Å; Y592-M596 HydrophobicContact CD2-CG 4.46Å; Y592-M596 HydrophobicContact CD2-SD 3.81Å; Y592-M596 HydrophobicContact CE2-SD 4.1Å; Y592-M596 VanDerWaalsContact O-CG 3.26Å; Y592-M596 WeakPolarHBondContact O-CG 3.45Å; Y592-M596 PolarHBondContact O-N 3.43Å; Y592-Y646 HydrophobicContact CE2-CD2 4.24Å; Y592-Y646 HydrophobicContact CE2-CE1 4.42Å; Y592-Y646 AromaticContact CE2-CE2 3.77Å; Y592-Y646 HydrophobicContact CE2-CE2 3.77Å; Y592-Y646 AromaticContact CE2-CZ 3.85Å
593	Y	89.4	Confident	88	Confident	5 Å²	5	41.1 Å²	41.1	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-59.8	176.4	-56.7	-53.4	0	0	0	112.7	M39 A589 P590 F591 G595 M596 N597 Y643 Y646	M39-Y593 HydrophobicContact CE-CE2 3.74Å; M39-Y593 WeakPolarHBondContact CE-OH 3.37Å; M39-Y593 HydrophobicContact SD-CE2 4.48Å; A589-Y593 HydrophobicContact CB-CE2 4.2Å; P590-Y593 HydrophobicContact CB-CD2 4.14Å; P590-Y593 HydrophobicContact CB-CE2 4.35Å; P590-Y593 WeakPolarHBondContact O-CB 3.45Å; P590-Y593 WeakPolarHBondContact O-CD2 3.49Å; P590-Y593 PolarHBondContact O-N 2.86Å; P590-Y593 VanDerWaalsContact O-N 3.15Å; F591-Y593 PolarHBondContact O-N 3.07Å; F591-Y593 VanDerWaalsContact O-N 3.11Å; Y593-G595 PolarHBondContact O-N 3.3Å; Y593-M596 PolarHBondContact O-N 2.92Å; Y593-N597 PolarHBondContact O-N 3.34Å; Y593-Y643 HydrophobicContact CD2-CD2 4.04Å; Y593-Y643 HydrophobicContact CE1-CD2 4.18Å; Y593-Y643 AromaticContact CE2-CD2 3.63Å; Y593-Y643 HydrophobicContact CE2-CD2 3.63Å; Y593-Y643 HydrophobicContact CE2-CE2 4.39Å; Y593-Y643 AromaticContact CZ-CD2 3.73Å; Y593-Y646 AromaticContact CD1-CD1 3.74Å; Y593-Y646 HydrophobicContact CD1-CD1 3.74Å; Y593-Y646 AromaticContact CD1-CD2 3.97Å; Y593-Y646 HydrophobicContact CD1-CD2 3.97Å; Y593-Y646 HydrophobicContact CD1-CE1 4.35Å; Y593-Y646 AromaticContact CD1-CG 3.51Å; Y593-Y646 HydrophobicContact CD1-CG 3.51Å; Y593-Y646 AromaticContact CE1-CD1 3.37Å; Y593-Y646 HydrophobicContact CE1-CD1 3.37Å; Y593-Y646 HydrophobicContact CE1-CD2 4.22Å; Y593-Y646 AromaticContact CE1-CE1 3.67Å; Y593-Y646 HydrophobicContact CE1-CE1 3.67Å; Y593-Y646 HydrophobicContact CE1-CE2 4.47Å; Y593-Y646 AromaticContact CE1-CG 3.67Å; Y593-Y646 HydrophobicContact CE1-CG 3.67Å
594	P	91.3	Very high	88.2	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-32.9	175.1	22.4	-32.7	0	0	0	111.8	L270 V271 P590 F591 M596 N597 S598 V601	L270-P594 HydrophobicContact CD2-CB 4.29Å; V271-P594 HydrophobicContact CG2-CB 4.35Å; V271-P594 HydrophobicContact CG2-CG 3.7Å; P590-P594 WeakPolarHBondContact O-CD 3.27Å; F591-P594 WeakPolarHBondContact O-CD 3.27Å; F591-P594 WeakPolarHBondContact O-CG 3.25Å; P594-M596 VanDerWaalsContact C-N 3.3Å; P594-M596 PolarHBondContact O-N 3.16Å; P594-N597 CarbonylContact O-C 3.56Å; P594-N597 PolarHBondContact O-N 3.23Å; P594-N597 VanDerWaalsContact O-N 3.09Å; P594-S598 VanDerWaalsContact O-CA 3.24Å; P594-S598 WeakPolarHBondContact O-CA 3.38Å; P594-S598 PolarHBondContact O-N 2.92Å; P594-V601 HydrophobicContact CB-CG2 4.25Å
595	G	90.2	Very high	88.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-31.8	175.9	0	0	0	0	0	114.7	D263 R266 F591 Y592 Y593 N597	D263-G595 WeakPolarHBondContact O-CA 3.16Å; R266-G595 WeakPolarHBondContact CD-O 3.22Å; R266-G595 PolarHBondContact NH1-O 3.34Å; F591-G595 PolarHBondContact O-N 3.04Å; Y592-G595 PolarHBondContact O-N 2.84Å; Y593-G595 PolarHBondContact O-N 3.3Å; G595-N597 VanDerWaalsContact C-N 3.34Å
596	M	88.3	Confident	88.9	Confident	25 Å²	25	23.8 Å²	23.8	12%	0.123	13%	0.126	C	C	.	.	H	α-helix	trans	-75.9	-21	174.9	-70.2	-179.2	79	0	0	113.5	R258 D263 Y592 Y593 P594 Y646 F651	R258-M596 VanDerWaalsContact NH1-CE 3.27Å; D263-M596 HydrophobicContact CB-CG 4.26Å; Y592-M596 HydrophobicContact CD2-CG 4.46Å; Y592-M596 HydrophobicContact CD2-SD 3.81Å; Y592-M596 HydrophobicContact CE2-SD 4.1Å; Y592-M596 VanDerWaalsContact O-CG 3.26Å; Y592-M596 WeakPolarHBondContact O-CG 3.45Å; Y592-M596 PolarHBondContact O-N 3.43Å; Y593-M596 PolarHBondContact O-N 2.92Å; P594-M596 VanDerWaalsContact C-N 3.3Å; P594-M596 PolarHBondContact O-N 3.16Å; M596-Y646 HydrophobicContact CE-CD2 4.24Å; M596-Y646 HydrophobicContact CE-CE2 4Å; M596-Y646 HydrophobicContact SD-CD2 3.68Å; M596-Y646 HydrophobicContact SD-CE2 3.56Å; M596-Y646 VanDerWaalsContact SD-CE2 3.56Å; M596-F651 HydrophobicContact CB-CD1 4.24Å; M596-F651 HydrophobicContact CB-CE1 4.04Å; M596-F651 HydrophobicContact CE-CD1 4.22Å; M596-F651 HydrophobicContact CE-CE1 3.39Å; M596-F651 HydrophobicContact CE-CZ 3.62Å; M596-F651 HydrophobicContact SD-CE1 4.15Å
597	N	90.3	Very high	89.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.1	37	-176.4	-83	-55.6	0	0	0	111.9	Y593 P594 G595 I599 L600 V601 I650 F651 W652	Y593-N597 PolarHBondContact O-N 3.34Å; P594-N597 CarbonylContact O-C 3.56Å; P594-N597 PolarHBondContact O-N 3.23Å; P594-N597 VanDerWaalsContact O-N 3.09Å; G595-N597 VanDerWaalsContact C-N 3.34Å; N597-I599 VanDerWaalsContact C-N 3.35Å; N597-I599 PolarHBondContact O-N 3.12Å; N597-L600 PolarHBondContact O-N 2.02Å; N597-V601 PolarHBondContact O-N 2.96Å; N597-I650 PolarHBondContact ND2-O 3.31Å; N597-I650 PolarHBondContact OD1-O 3.12Å; N597-F651 VanDerWaalsContact OD1-CA 3.29Å; N597-F651 WeakPolarHBondContact OD1-CA 3.44Å; N597-W652 PolarHBondContact OD1-N 2.86Å
598	S	90.9	Very high	89.9	Confident	22 Å²	22	24.4 Å²	24.4	15%	0.154	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-38.2	-164.6	58	0	0	0	0	114.4	L270 P594 Y602	L270-S598 VanDerWaalsContact CD2-CA 3.46Å; L270-S598 WeakPolarHBondContact CD2-O 3.37Å; P594-S598 VanDerWaalsContact O-CA 3.24Å; P594-S598 WeakPolarHBondContact O-CA 3.38Å; P594-S598 PolarHBondContact O-N 2.92Å; S598-Y602 WeakPolarHBondContact O-CB 3.28Å; S598-Y602 PolarHBondContact O-N 3.37Å
599	I	89	Confident	90	Very high	26 Å²	26	27.2 Å²	27.2	13%	0.133	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-40.7	179.6	-170.4	64.4	0	0	0	111.9	L340 L368 N597 Y602 V603 W652 I654	L340-I599 HydrophobicContact CD1-CD1 3.68Å; L368-I599 HydrophobicContact CD2-CD1 4.36Å; N597-I599 VanDerWaalsContact C-N 3.35Å; N597-I599 PolarHBondContact O-N 3.12Å; I599-Y602 PolarHBondContact O-N 2.94Å; I599-V603 HydrophobicContact CD1-CG2 3.87Å; I599-V603 HydrophobicContact CG1-CG2 4.07Å; I599-V603 WeakPolarHBondContact O-CB 3.19Å; I599-V603 VanDerWaalsContact O-CG2 3.24Å; I599-V603 WeakPolarHBondContact O-CG2 3.47Å; I599-V603 PolarHBondContact O-N 2.01Å; I599-W652 HydrophobicContact CG2-CB 4.45Å; I599-W652 HydrophobicContact CG2-CG 4.45Å; I599-I654 HydrophobicContact CD1-CD1 4.11Å; I599-I654 HydrophobicContact CG1-CD1 3.67Å; I599-I654 HydrophobicContact CG1-CG1 4.36Å
600	L	92.4	Very high	90.2	Very high	29 Å²	29	31.9 Å²	31.9	15%	0.152	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-44.8	-179.9	-176.9	164.1	0	0	0	110.3	N597 G604 W638 L645 W652	N597-L600 PolarHBondContact O-N 2.02Å; L600-G604 WeakPolarHBondContact O-CA 3.42Å; L600-G604 PolarHBondContact O-N 3.48Å; L600-W638 HydrophobicContact CD2-CZ3 4.14Å; L600-L645 HydrophobicContact CD1-CD1 3.58Å; L600-L645 HydrophobicContact CD1-CD2 4.46Å; L600-L645 HydrophobicContact CD2-CD1 3.71Å; L600-L645 HydrophobicContact CG-CD1 4.33Å; L600-W652 HydrophobicContact CB-CB 4.26Å; L600-W652 HydrophobicContact CB-CE3 4.16Å; L600-W652 HydrophobicContact CD1-CB 4.21Å; L600-W652 HydrophobicContact CD1-CE3 3.86Å; L600-W652 HydrophobicContact CG-CE3 3.97Å
601	V	93.6	Very high	90.3	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-43.2	178.4	174.3	0	0	0	0	110.9	L270 V274 P594 N597 H605 W638 S642	L270-V601 HydrophobicContact CD2-CB 3.8Å; L270-V601 HydrophobicContact CD2-CG1 3.85Å; L270-V601 HydrophobicContact CG-CG1 4.09Å; V274-V601 HydrophobicContact CG2-CG1 4.11Å; P594-V601 HydrophobicContact CB-CG2 4.25Å; N597-V601 PolarHBondContact O-N 2.96Å; V601-H605 WeakPolarHBondContact O-CB 3.24Å; V601-H605 PolarHBondContact O-N 2.78Å; V601-W638 HydrophobicContact CB-CE3 4.47Å; V601-W638 HydrophobicContact CG1-CB 4.18Å; V601-W638 HydrophobicContact CG1-CD2 4.43Å; V601-W638 HydrophobicContact CG1-CE3 4.31Å; V601-W638 HydrophobicContact CG1-CG 4.38Å; V601-W638 HydrophobicContact CG2-CE3 4.39Å; V601-S642 WeakPolarHBondContact CG2-OG 3.27Å
602	Y	92.5	Very high	90.1	Very high	24 Å²	24	40.3 Å²	40.3	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-50.8	177.5	-176.8	-93	0	0	0	112.1	L270 M273 L368 S598 I599 G604 H605 E606	L270-Y602 HydrophobicContact CD1-CD2 4.31Å; M273-Y602 HydrophobicContact SD-CD2 3.7Å; M273-Y602 HydrophobicContact SD-CE2 3.67Å; L368-Y602 HydrophobicContact CD1-CD1 4Å; L368-Y602 HydrophobicContact CD1-CE1 3.58Å; L368-Y602 HydrophobicContact CD2-CD1 3.74Å; L368-Y602 HydrophobicContact CD2-CE1 3.63Å; L368-Y602 HydrophobicContact CG-CD1 4.09Å; L368-Y602 HydrophobicContact CG-CE1 3.51Å; S598-Y602 WeakPolarHBondContact O-CB 3.28Å; S598-Y602 PolarHBondContact O-N 3.37Å; I599-Y602 PolarHBondContact O-N 2.94Å; Y602-G604 VanDerWaalsContact C-N 3.3Å; Y602-G604 PolarHBondContact O-N 3.27Å; Y602-H605 WeakPolarHBondContact CA-ND1 3.08Å; Y602-H605 AromaticContact CD2-CE1 3.53Å; Y602-H605 AromaticContact CE2-CE1 3.65Å; Y602-H605 PolarHBondContact O-CE1 3.33Å; Y602-H605 PolarHBondContact O-N 3.12Å; Y602-H605 PolarHBondContact O-ND1 2.83Å; Y602-E606 HydrophobicContact CE1-CG 4.32Å; Y602-E606 WeakPolarHBondContact O-CG 3.39Å; Y602-E606 PolarHBondContact O-N 2.57Å
603	V	91.9	Very high	90	Very high	29 Å²	29	41.8 Å²	41.8	18%	0.176	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-41.4	178.7	171.7	0	0	0	0	110.8	I343 I347 I599 V607	I343-V603 HydrophobicContact CG2-CG2 3.7Å; I347-V603 HydrophobicContact CD1-CB 3.99Å; I347-V603 HydrophobicContact CD1-CG1 3.73Å; I347-V603 HydrophobicContact CD1-CG2 3.66Å; I599-V603 HydrophobicContact CD1-CG2 3.87Å; I599-V603 HydrophobicContact CG1-CG2 4.07Å; I599-V603 WeakPolarHBondContact O-CB 3.19Å; I599-V603 VanDerWaalsContact O-CG2 3.24Å; I599-V603 WeakPolarHBondContact O-CG2 3.47Å; I599-V603 PolarHBondContact O-N 2.01Å; V603-V607 HydrophobicContact CG1-CG2 4.11Å; V603-V607 WeakPolarHBondContact O-CB 3.22Å; V603-V607 VanDerWaalsContact O-CG2 3.23Å; V603-V607 WeakPolarHBondContact O-CG2 3.17Å; V603-V607 PolarHBondContact O-N 2.99Å
604	G	92.4	Very high	90	Very high	7 Å²	7	42.3 Å²	42.3	7%	0.072	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-43.9	-179.6	0	0	0	0	0	112.9	L600 Y602 E606 V607 F608 W638	L600-G604 WeakPolarHBondContact O-CA 3.42Å; L600-G604 PolarHBondContact O-N 3.48Å; Y602-G604 VanDerWaalsContact C-N 3.3Å; Y602-G604 PolarHBondContact O-N 3.27Å; G604-E606 VanDerWaalsContact C-N 3.31Å; G604-E606 PolarHBondContact O-N 3.06Å; G604-V607 PolarHBondContact O-N 3.39Å; G604-F608 WeakPolarHBondContact O-CB 3.32Å; G604-F608 VanDerWaalsContact O-CD2 3.24Å; G604-F608 WeakPolarHBondContact O-CD2 3.34Å; G604-F608 PolarHBondContact O-N 3.13Å; G604-W638 VanDerWaalsContact O-CZ2 3.25Å; G604-W638 WeakPolarHBondContact O-CZ2 3.02Å
605	H	92.4	Very high	89.8	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-66.4	-34.3	-176.6	92.1	-73.6	0	0	0	112.9	V274 N277 Y278 V601 Y602 E609 W638	V274-H605 HydrophobicContact CG1-CB 4Å; V274-H605 HydrophobicContact CG2-CB 4.12Å; N277-H605 PolarHBondContact ND2-NE2 3.27Å; Y278-H605 HydrophobicContact CE2-CB 4.49Å; Y278-H605 WeakPolarHBondContact OH-CB 3.21Å; Y278-H605 PolarHBondContact OH-O 3.44Å; V601-H605 WeakPolarHBondContact O-CB 3.24Å; V601-H605 PolarHBondContact O-N 2.78Å; Y602-H605 WeakPolarHBondContact CA-ND1 3.08Å; Y602-H605 AromaticContact CD2-CE1 3.53Å; Y602-H605 AromaticContact CE2-CE1 3.65Å; Y602-H605 PolarHBondContact O-CE1 3.33Å; Y602-H605 PolarHBondContact O-N 3.12Å; Y602-H605 PolarHBondContact O-ND1 2.83Å; H605-E609 WeakPolarHBondContact O-CA 3.3Å; H605-E609 WeakPolarHBondContact O-CB 3.34Å; H605-E609 PolarHBondContact O-N 3.08Å; H605-W638 HydrophobicContact CB-CD2 4.45Å; H605-W638 HydrophobicContact CB-CZ2 4.28Å; H605-W638 VanDerWaalsContact N-CZ2 3.31Å
606	E	90.3	Very high	89.8	Confident	52 Å²	52	51 Å²	51	24%	0.243	24%	0.241	C	C	.	.	H	α-helix	trans	-72.1	-48.5	175.3	-60.2	-78.7	161.3	0	0	110.7	N277 I347 Y602 G604 F608 E609	N277-E606 PolarHBondContact ND2-OE1 3.46Å; I347-E606 HydrophobicContact CG2-CB 3.54Å; I347-E606 HydrophobicContact CG2-CG 3.85Å; Y602-E606 HydrophobicContact CE1-CG 4.32Å; Y602-E606 WeakPolarHBondContact O-CG 3.39Å; Y602-E606 PolarHBondContact O-N 2.57Å; G604-E606 VanDerWaalsContact C-N 3.31Å; G604-E606 PolarHBondContact O-N 3.06Å; E606-F608 VanDerWaalsContact C-N 3.32Å; E606-F608 PolarHBondContact O-N 2.87Å; E606-E609 WeakPolarHBondContact O-CB 3.33Å; E606-E609 PolarHBondContact O-N 3.32Å
607	V	89.4	Confident	89.7	Confident	54 Å²	54	58.8 Å²	58.8	33%	0.327	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-37.3	-177.6	170.3	0	0	0	0	111.9	I347 V603 G604	I347-V607 HydrophobicContact CG1-CG2 4.48Å; V603-V607 HydrophobicContact CG1-CG2 4.11Å; V603-V607 WeakPolarHBondContact O-CB 3.22Å; V603-V607 VanDerWaalsContact O-CG2 3.23Å; V603-V607 WeakPolarHBondContact O-CG2 3.17Å; V603-V607 PolarHBondContact O-N 2.99Å; G604-V607 PolarHBondContact O-N 3.39Å
608	F	90.1	Very high	89.5	Confident	98 Å²	98	59.9 Å²	59.9	43%	0.43	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	13.9	-178.9	-62.8	-69.6	0	0	0	113.3	G604 E606 D610 Y611 F614 W638	G604-F608 WeakPolarHBondContact O-CB 3.32Å; G604-F608 VanDerWaalsContact O-CD2 3.24Å; G604-F608 WeakPolarHBondContact O-CD2 3.34Å; G604-F608 PolarHBondContact O-N 3.13Å; E606-F608 VanDerWaalsContact C-N 3.32Å; E606-F608 PolarHBondContact O-N 2.87Å; F608-D610 VanDerWaalsContact C-N 3.29Å; F608-D610 PolarHBondContact O-N 3.26Å; F608-Y611 HydrophobicContact CD1-CD2 4.47Å; F608-Y611 PolarHBondContact O-N 3.05Å; F608-Y611 VanDerWaalsContact O-N 3.16Å; F608-F614 HydrophobicContact CB-CD2 3.63Å; F608-F614 HydrophobicContact CB-CE2 3.7Å; F608-F614 HydrophobicContact CG-CE2 4.28Å; F608-F614 WeakPolarHBondContact O-CD2 3.22Å; F608-W638 HydrophobicContact CB-CZ2 4.47Å; F608-W638 HydrophobicContact CD2-CH2 4.1Å; F608-W638 HydrophobicContact CD2-CZ2 4.22Å
609	E	86.2	Confident	89.1	Confident	58 Å²	58	63.8 Å²	63.8	27%	0.271	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-43.2	-175.1	177.9	175.6	-175.5	0	0	112.7	Y278 H605 E606 R615	Y278-E609 HydrophobicContact CD1-CG 4.1Å; Y278-E609 HydrophobicContact CE1-CB 4.18Å; Y278-E609 HydrophobicContact CE1-CG 3.91Å; H605-E609 WeakPolarHBondContact O-CA 3.3Å; H605-E609 WeakPolarHBondContact O-CB 3.34Å; H605-E609 PolarHBondContact O-N 3.08Å; E606-E609 WeakPolarHBondContact O-CB 3.33Å; E606-E609 PolarHBondContact O-N 3.32Å; E609-R615 WeakPolarHBondContact O-CB 3.34Å
610	D	86	Confident	88.8	Confident	108 Å²	108	66.3 Å²	66.3	58%	0.578	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	3.5	-176.2	-69.7	-41.1	0	0	0	114.5	F608 R615	F608-D610 VanDerWaalsContact C-N 3.29Å; F608-D610 PolarHBondContact O-N 3.26Å; D610-R615 WeakPolarHBondContact OD1-CD 3.2Å; D610-R615 IonicContact OD1-CZ 3.99Å; D610-R615 IonicContact OD1-NE 3.95Å; D610-R615 IonicContact OD1-NH1 2.98Å; D610-R615 PolarHBondContact OD1-NH1 3.33Å
611	Y	88.4	Confident	88.2	Confident	118 Å²	118	67.9 Å²	67.9	46%	0.463	34%	0.342	S	S	.	.	S	Bend	trans	-104.8	144.8	-173.7	-66.9	-92	0	0	0	112.3	F608 F614 R615	F608-Y611 HydrophobicContact CD1-CD2 4.47Å; F608-Y611 PolarHBondContact O-N 3.05Å; F608-Y611 VanDerWaalsContact O-N 3.16Å; Y611-F614 WeakPolarHBondContact O-CA 3.28Å; Y611-F614 WeakPolarHBondContact O-CB 3.42Å; Y611-F614 PolarHBondContact O-N 3.39Å; Y611-R615 PolarHBondContact O-N 3.42Å
612	F	87.2	Confident	87.7	Confident	169 Å²	169	70.9 Å²	70.9	74%	0.741	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	137	167.5	-176.4	-91.6	0	0	0	109.8	R615 W616	F612-R615 WeakPolarHBondContact CA-O 3.44Å; F612-R615 PolarHBondContact N-O 2.96Å; F612-W616 HydrophobicContact CD2-CB 4.28Å
613	P	87.5	Confident	87.4	Confident	49 Å²	49	71.1 Å²	71.1	32%	0.318	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.8	9.1	8.9	37.6	-38.9	0	0	0	115.8	L637	P613-L637 HydrophobicContact CB-CD1 3.95Å; P613-L637 HydrophobicContact CG-CD1 3.72Å
614	F	88.9	Confident	87.2	Confident	16 Å²	16	70.1 Å²	70.1	7%	0.07	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-30.3	-176.5	-54.6	-73.4	0	0	0	112.7	F608 Y611 A634 L637 W638 I641	F608-F614 HydrophobicContact CB-CD2 3.63Å; F608-F614 HydrophobicContact CB-CE2 3.7Å; F608-F614 HydrophobicContact CG-CE2 4.28Å; F608-F614 WeakPolarHBondContact O-CD2 3.22Å; Y611-F614 WeakPolarHBondContact O-CA 3.28Å; Y611-F614 WeakPolarHBondContact O-CB 3.42Å; Y611-F614 PolarHBondContact O-N 3.39Å; F614-A634 HydrophobicContact CB-CB 4.25Å; F614-A634 HydrophobicContact CD1-CB 4.19Å; F614-L637 HydrophobicContact CE1-CB 4.06Å; F614-W638 AromaticContact CD1-CD1 3.99Å; F614-W638 AromaticContact CD1-NE1 3.49Å; F614-W638 AromaticContact CE1-CD1 3.72Å; F614-W638 HydrophobicContact CE1-CD2 4.16Å; F614-W638 AromaticContact CE1-CE2 3.52Å; F614-W638 HydrophobicContact CE1-CG 4.24Å; F614-W638 AromaticContact CE1-CZ2 3.91Å; F614-W638 HydrophobicContact CE1-CZ2 3.91Å; F614-W638 AromaticContact CE1-NE1 3.27Å; F614-W638 VanDerWaalsContact CE1-NE1 3.27Å; F614-W638 HydrophobicContact CE2-CZ2 4.06Å; F614-W638 HydrophobicContact CZ-CD2 4.46Å; F614-W638 AromaticContact CZ-CE2 3.71Å; F614-W638 HydrophobicContact CZ-CH2 4.26Å; F614-W638 AromaticContact CZ-CZ2 3.58Å; F614-W638 HydrophobicContact CZ-CZ2 3.58Å; F614-W638 AromaticContact CZ-NE1 3.91Å; F614-I641 HydrophobicContact CE1-CD1 4.32Å; F614-I641 HydrophobicContact CZ-CD1 3.91Å
615	R	88.9	Confident	86.9	Confident	100 Å²	100	70.1 Å²	70.1	38%	0.377	36%	0.355	S	S	.	.			trans	-135.1	137.5	172.1	-174.9	166.9	-159.4	167.4	6.8	110.5	E609 D610 Y611 F612	E609-R615 WeakPolarHBondContact O-CB 3.34Å; D610-R615 WeakPolarHBondContact OD1-CD 3.2Å; D610-R615 IonicContact OD1-CZ 3.99Å; D610-R615 IonicContact OD1-NE 3.95Å; D610-R615 IonicContact OD1-NH1 2.98Å; D610-R615 PolarHBondContact OD1-NH1 3.33Å; Y611-R615 PolarHBondContact O-N 3.42Å; F612-R615 WeakPolarHBondContact CA-O 3.44Å; F612-R615 PolarHBondContact N-O 2.96Å
616	W	89.1	Confident	86.8	Confident	85 Å²	85	72 Å²	72	32%	0.322	36%	0.363	S	S	.	.			trans	-138.6	167.1	174.1	62.6	90.7	0	0	0	110.2	F612 M618 Q630 L633	F612-W616 HydrophobicContact CD2-CB 4.28Å; W616-M618 PolarHBondContact O-N 3.18Å; W616-Q630 HydrophobicContact CD2-CG 4.18Å; W616-Q630 HydrophobicContact CE3-CG 3.86Å; W616-Q630 HydrophobicContact CH2-CB 3.75Å; W616-Q630 HydrophobicContact CH2-CG 3.69Å; W616-Q630 HydrophobicContact CZ2-CB 3.76Å; W616-Q630 HydrophobicContact CZ2-CG 3.94Å; W616-Q630 HydrophobicContact CZ3-CB 4.22Å; W616-Q630 HydrophobicContact CZ3-CG 3.62Å; W616-L633 HydrophobicContact CH2-CB 4.06Å; W616-L633 HydrophobicContact CH2-CD1 3.58Å; W616-L633 HydrophobicContact CH2-CG 4.44Å; W616-L633 HydrophobicContact CZ2-CD1 4.23Å; W616-L633 HydrophobicContact CZ3-CB 4.47Å
617	H	87.1	Confident	86.8	Confident	187 Å²	187	70 Å²	70	87%	0.866	35%	0.354	S	S	*	.			trans	-74.2	118.9	177.3	-165.9	69.4	0	0	0	110
618	M	85	Confident	86.9	Confident	24 Å²	24	67.7 Å²	67.7	12%	0.118	34%	0.339	C	S	.	.			trans	-79.7	147.3	178.4	-81.2	172.5	-78	0	0	111.1	W616 E626 H627	W616-M618 PolarHBondContact O-N 3.18Å; M618-E626 WeakPolarHBondContact CA-OE2 3.07Å; M618-E626 WeakPolarHBondContact CB-OE2 3.39Å; M618-E626 HydrophobicContact CG-CB 4.07Å; M618-E626 HydrophobicContact SD-CB 3.91Å; M618-H627 WeakPolarHBondContact CE-CE1 3.49Å
619	A	82.9	Confident	86.9	Confident	103 Å²	103	64.9 Å²	64.9	85%	0.851	33%	0.329	S	S	*	.	S	Bend	trans	-74.3	-41.6	176.1	0	0	0	0	0	110.4	E626	A619-E626 PolarHBondContact N-OE2 2.71Å
620	N	81.6	Confident	87.1	Confident	79 Å²	79	62.6 Å²	62.6	42%	0.422	32%	0.318	S	S	.	.			trans	-125.4	94.8	172.4	-172.9	2.1	0	0	0	111.5	Q622 S623 E626	N620-Q622 PolarHBondContact O-N 2.87Å; N620-Q622 WeakPolarHBondContact OD1-CB 3.33Å; N620-Q622 PolarHBondContact OD1-N 2.84Å; N620-S623 PolarHBondContact O-N 2.83Å; N620-S623 VanDerWaalsContact O-N 3.1Å; N620-E626 WeakPolarHBondContact CB-OE1 3.18Å; N620-E626 PolarHBondContact N-OE1 3.33Å; N620-E626 PolarHBondContact N-OE2 3.27Å
621	S	79.7	Confident	87.4	Confident	62 Å²	62	57.5 Å²	57.5	43%	0.434	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.8	177.2	68.6	0	0	0	0	115.1	H627	S621-H627 PolarHBondContact O-NE2 3.35Å
622	Q	83.8	Confident	87.6	Confident	65 Å²	65	53.1 Å²	53.1	30%	0.304	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	7.6	176.4	-56.6	-59.7	-40.3	0	0	112.8	M75 N620	M75-Q622 HydrophobicContact CB-CB 4.28Å; M75-Q622 WeakPolarHBondContact CB-O 3.33Å; N620-Q622 PolarHBondContact O-N 2.87Å; N620-Q622 WeakPolarHBondContact OD1-CB 3.33Å; N620-Q622 PolarHBondContact OD1-N 2.84Å
623	S	86.1	Confident	87.7	Confident	30 Å²	30	45.9 Å²	45.9	21%	0.21	24%	0.244	C	C	.	.			trans	-101.1	123.6	178.9	178.2	0	0	0	0	112.4	N620 A625 E626 H627	N620-S623 PolarHBondContact O-N 2.83Å; N620-S623 VanDerWaalsContact O-N 3.1Å; S623-A625 PolarHBondContact O-N 3.13Å; S623-A625 PolarHBondContact OG-N 3.37Å; S623-E626 PolarHBondContact O-N 2.76Å; S623-H627 PolarHBondContact O-CD2 3.09Å; S623-H627 VanDerWaalsContact O-CD2 3.26Å; S623-H627 PolarHBondContact O-N 3.33Å
624	H	87.6	Confident	88	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-56.6	-31.8	170.8	-79.2	-71.1	0	0	0	113.1	M75 D76 E154 G281 R282 Y283 L628	M75-H624 WeakPolarHBondContact CG-NE2 3.35Å; D76-H624 IonicContact OD1-CE1 3.22Å; D76-H624 IonicContact OD1-NE2 2.74Å; D76-H624 PolarHBondContact OD1-NE2 3.15Å; E154-H624 IonicContact OE1-CD2 3.1Å; E154-H624 IonicContact OE2-CD2 3.49Å; E154-H624 PolarHBondContact OE2-CD2 2.72Å; E154-H624 VanDerWaalsContact OE2-CD2 3.32Å; E154-H624 IonicContact OE2-NE2 3.7Å; G281-H624 PolarHBondContact O-ND1 3.32Å; R282-H624 PolarHBondContact O-CE1 2.97Å; Y283-H624 HydrophobicContact CE1-CB 4.29Å; Y283-H624 HydrophobicContact CE2-CB 4.39Å; H624-L628 WeakPolarHBondContact O-CB 3.49Å; H624-L628 PolarHBondContact O-N 2.95Å
625	A	87.5	Confident	88.2	Confident	7 Å²	7	43.3 Å²	43.3	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-45.9	-178.4	0	0	0	0	0	112	P187 S623 L628 I629	P187-A625 HydrophobicContact CB-CB 3.92Å; P187-A625 HydrophobicContact CG-CB 3.8Å; S623-A625 PolarHBondContact O-N 3.13Å; S623-A625 PolarHBondContact OG-N 3.37Å; A625-L628 PolarHBondContact O-N 3.07Å; A625-I629 WeakPolarHBondContact O-CD1 3.39Å; A625-I629 VanDerWaalsContact O-CG1 3.28Å; A625-I629 WeakPolarHBondContact O-CG1 3.47Å; A625-I629 PolarHBondContact O-N 3.28Å
626	E	88.7	Confident	88.3	Confident	41 Å²	41	39.4 Å²	39.4	19%	0.192	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-45.8	-179.8	-71	-170	-147.5	0	0	111.5	M618 A619 N620 S623 L628 I629 Q630	M618-E626 WeakPolarHBondContact CA-OE2 3.07Å; M618-E626 WeakPolarHBondContact CB-OE2 3.39Å; M618-E626 HydrophobicContact CG-CB 4.07Å; M618-E626 HydrophobicContact SD-CB 3.91Å; A619-E626 PolarHBondContact N-OE2 2.71Å; N620-E626 WeakPolarHBondContact CB-OE1 3.18Å; N620-E626 PolarHBondContact N-OE1 3.33Å; N620-E626 PolarHBondContact N-OE2 3.27Å; S623-E626 PolarHBondContact O-N 2.76Å; E626-L628 VanDerWaalsContact C-N 3.3Å; E626-L628 PolarHBondContact O-N 2.91Å; E626-I629 PolarHBondContact O-N 2.79Å; E626-Q630 WeakPolarHBondContact O-CB 3.19Å; E626-Q630 PolarHBondContact O-N 2.92Å
627	H	90.7	Very high	88.5	Confident	9 Å²	9	37.3 Å²	37.3	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-41.3	174.3	-74.9	-74.2	0	0	0	111.7	R282 M618 S621 S623 Q630 N631	R282-H627 PolarHBondContact NE-CE1 3.01Å; R282-H627 VanDerWaalsContact NE-CE1 3.27Å; M618-H627 WeakPolarHBondContact CE-CE1 3.49Å; S621-H627 PolarHBondContact O-NE2 3.35Å; S623-H627 PolarHBondContact O-CD2 3.09Å; S623-H627 VanDerWaalsContact O-CD2 3.26Å; S623-H627 PolarHBondContact O-N 3.33Å; H627-Q630 PolarHBondContact O-N 2.93Å; H627-N631 WeakPolarHBondContact O-CB 3.5Å; H627-N631 PolarHBondContact O-N 3.17Å; H627-N631 PolarHBondContact O-OD1 3.08Å
628	L	91.8	Very high	88.8	Confident	5 Å²	5	29 Å²	29	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-46.4	-179.7	-178.5	65.2	0	0	0	111.6	P187 I188 A191 F275 Y283 H624 A625 E626 Q630 N631 I632	P187-L628 HydrophobicContact CB-CD2 4.12Å; I188-L628 HydrophobicContact CB-CD2 3.99Å; A191-L628 HydrophobicContact CB-CD2 4.2Å; F275-L628 HydrophobicContact CE2-CD1 4.2Å; F275-L628 HydrophobicContact CZ-CD1 3.82Å; Y283-L628 HydrophobicContact CE2-CB 4.45Å; Y283-L628 HydrophobicContact CE2-CD1 4.32Å; Y283-L628 HydrophobicContact CE2-CD2 4.27Å; H624-L628 WeakPolarHBondContact O-CB 3.49Å; H624-L628 PolarHBondContact O-N 2.95Å; A625-L628 PolarHBondContact O-N 3.07Å; E626-L628 VanDerWaalsContact C-N 3.3Å; E626-L628 PolarHBondContact O-N 2.91Å; L628-Q630 VanDerWaalsContact C-N 3.3Å; L628-Q630 PolarHBondContact O-N 2.87Å; L628-N631 PolarHBondContact O-N 2.78Å; L628-I632 HydrophobicContact CD1-CD1 3.74Å; L628-I632 HydrophobicContact CD1-CG1 4.11Å; L628-I632 HydrophobicContact CD2-CD1 4.33Å; L628-I632 HydrophobicContact CG-CD1 3.68Å; L628-I632 HydrophobicContact CG-CG1 4.39Å; L628-I632 WeakPolarHBondContact O-CB 3.38Å; L628-I632 VanDerWaalsContact O-CG1 3.23Å; L628-I632 WeakPolarHBondContact O-CG1 3.36Å; L628-I632 PolarHBondContact O-N 3.29Å
629	I	89.8	Confident	89.2	Confident	40 Å²	40	29 Å²	29	21%	0.205	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-46.6	176.8	-71.7	160.5	0	0	0	109.8	A625 E626 N631 I632 L633	A625-I629 WeakPolarHBondContact O-CD1 3.39Å; A625-I629 VanDerWaalsContact O-CG1 3.28Å; A625-I629 WeakPolarHBondContact O-CG1 3.47Å; A625-I629 PolarHBondContact O-N 3.28Å; E626-I629 PolarHBondContact O-N 2.79Å; I629-N631 PolarHBondContact O-N 3.06Å; I629-I632 PolarHBondContact O-N 3.12Å; I629-L633 HydrophobicContact CG2-CD1 3.71Å; I629-L633 VanDerWaalsContact O-CB 3.31Å; I629-L633 WeakPolarHBondContact O-CB 3.43Å; I629-L633 WeakPolarHBondContact O-CG 3.42Å; I629-L633 PolarHBondContact O-N 3.23Å
630	Q	90.8	Very high	89.5	Confident	9 Å²	9	25.6 Å²	25.6	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-50.5	178	-173.1	-178.6	-48.4	0	0	112.4	W616 E626 H627 L628 I632 L633 A634	W616-Q630 HydrophobicContact CD2-CG 4.18Å; W616-Q630 HydrophobicContact CE3-CG 3.86Å; W616-Q630 HydrophobicContact CH2-CB 3.75Å; W616-Q630 HydrophobicContact CH2-CG 3.69Å; W616-Q630 HydrophobicContact CZ2-CB 3.76Å; W616-Q630 HydrophobicContact CZ2-CG 3.94Å; W616-Q630 HydrophobicContact CZ3-CB 4.22Å; W616-Q630 HydrophobicContact CZ3-CG 3.62Å; E626-Q630 WeakPolarHBondContact O-CB 3.19Å; E626-Q630 PolarHBondContact O-N 2.92Å; H627-Q630 PolarHBondContact O-N 2.93Å; L628-Q630 VanDerWaalsContact C-N 3.3Å; L628-Q630 PolarHBondContact O-N 2.87Å; Q630-I632 PolarHBondContact O-N 3.47Å; Q630-L633 PolarHBondContact O-N 3.11Å; Q630-A634 WeakPolarHBondContact O-CB 3.31Å; Q630-A634 PolarHBondContact O-N 2.87Å
631	N	93.1	Very high	90	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.011	14%	0.136	C	C	.	.	H	α-helix	trans	-69.3	-36	-175.5	-65	0.8	0	0	0	112.4	F275 Y278 G279 G280 G281 H627 L628 I629 T635	F275-N631 HydrophobicContact CD2-CB 3.98Å; F275-N631 HydrophobicContact CE2-CB 3.77Å; Y278-N631 VanDerWaalsContact O-CG 3.32Å; Y278-N631 PolarHBondContact O-ND2 3.23Å; Y278-N631 PolarHBondContact O-OD1 3.2Å; G279-N631 VanDerWaalsContact C-ND2 3.35Å; G280-N631 PolarHBondContact N-ND2 3.12Å; G281-N631 PolarHBondContact N-ND2 2.85Å; H627-N631 WeakPolarHBondContact O-CB 3.5Å; H627-N631 PolarHBondContact O-N 3.17Å; H627-N631 PolarHBondContact O-OD1 3.08Å; L628-N631 PolarHBondContact O-N 2.78Å; I629-N631 PolarHBondContact O-N 3.06Å; N631-T635 VanDerWaalsContact O-CB 3.24Å; N631-T635 WeakPolarHBondContact O-CB 3.47Å; N631-T635 PolarHBondContact O-N 2.94Å; N631-T635 PolarHBondContact O-OG1 3.42Å
632	I	91.2	Very high	90.6	Very high	26 Å²	26	21.5 Å²	21.5	13%	0.133	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-45.2	174.2	-71.1	172.6	0	0	0	110.4	A191 F195 F275 L628 I629 Q630 S636	A191-I632 HydrophobicContact CB-CD1 4Å; F195-I632 HydrophobicContact CE2-CD1 4.22Å; F195-I632 HydrophobicContact CE2-CG2 3.84Å; F195-I632 HydrophobicContact CZ-CG2 3.6Å; F275-I632 HydrophobicContact CE2-CG1 3.81Å; L628-I632 HydrophobicContact CD1-CD1 3.74Å; L628-I632 HydrophobicContact CD1-CG1 4.11Å; L628-I632 HydrophobicContact CD2-CD1 4.33Å; L628-I632 HydrophobicContact CG-CD1 3.68Å; L628-I632 HydrophobicContact CG-CG1 4.39Å; L628-I632 WeakPolarHBondContact O-CB 3.38Å; L628-I632 VanDerWaalsContact O-CG1 3.23Å; L628-I632 WeakPolarHBondContact O-CG1 3.36Å; L628-I632 PolarHBondContact O-N 3.29Å; I629-I632 PolarHBondContact O-N 3.12Å; Q630-I632 PolarHBondContact O-N 3.47Å; I632-S636 VanDerWaalsContact O-CB 3.24Å; I632-S636 WeakPolarHBondContact O-CB 3.48Å; I632-S636 PolarHBondContact O-N 3.36Å; I632-S636 PolarHBondContact O-OG 3.49Å
633	L	91.1	Very high	90.8	Very high	17 Å²	17	19 Å²	19	9%	0.089	10%	0.103	C	C	.	.	H	α-helix	trans	-62.8	-51.6	178.3	-83.3	169.4	0	0	0	111.2	A50 V51 W616 I629 Q630 T635 S636 L637	A50-L633 HydrophobicContact CB-CD1 4.46Å; A50-L633 HydrophobicContact CB-CD2 3.25Å; A50-L633 HydrophobicContact CB-CG 3.76Å; V51-L633 HydrophobicContact CG2-CD2 4.16Å; W616-L633 HydrophobicContact CH2-CB 4.06Å; W616-L633 HydrophobicContact CH2-CD1 3.58Å; W616-L633 HydrophobicContact CH2-CG 4.44Å; W616-L633 HydrophobicContact CZ2-CD1 4.23Å; W616-L633 HydrophobicContact CZ3-CB 4.47Å; I629-L633 HydrophobicContact CG2-CD1 3.71Å; I629-L633 VanDerWaalsContact O-CB 3.31Å; I629-L633 WeakPolarHBondContact O-CB 3.43Å; I629-L633 WeakPolarHBondContact O-CG 3.42Å; I629-L633 PolarHBondContact O-N 3.23Å; Q630-L633 PolarHBondContact O-N 3.11Å; L633-T635 VanDerWaalsContact C-N 3.31Å; L633-T635 PolarHBondContact O-N 3.49Å; L633-S636 PolarHBondContact O-N 3.47Å; L633-S636 VanDerWaalsContact O-N 3.17Å; L633-L637 VanDerWaalsContact O-CG 3.3Å; L633-L637 WeakPolarHBondContact O-CG 3.14Å; L633-L637 PolarHBondContact O-N 3.09Å
634	A	92.1	Very high	91	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-56.7	-45.5	178.8	0	0	0	0	0	111.7	Y278 F614 Q630 L637 W638	Y278-A634 HydrophobicContact CD2-CB 3.82Å; Y278-A634 HydrophobicContact CE2-CB 3.59Å; F614-A634 HydrophobicContact CB-CB 4.25Å; F614-A634 HydrophobicContact CD1-CB 4.19Å; Q630-A634 WeakPolarHBondContact O-CB 3.31Å; Q630-A634 PolarHBondContact O-N 2.87Å; A634-L637 PolarHBondContact O-N 3.48Å; A634-W638 VanDerWaalsContact O-CD1 3.3Å; A634-W638 PolarHBondContact O-N 3.04Å
635	T	93.5	Very high	91.1	Very high	10 Å²	10	22 Å²	22	6%	0.061	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-41.8	178	-57.6	0	0	0	0	111.8	V271 V274 F275 N631 L633 L637 W638 V639	V271-T635 HydrophobicContact CG1-CG2 3.8Å; V274-T635 HydrophobicContact CG1-CG2 4.42Å; F275-T635 WeakPolarHBondContact CA-OG1 3.32Å; F275-T635 HydrophobicContact CB-CG2 4.16Å; N631-T635 VanDerWaalsContact O-CB 3.24Å; N631-T635 WeakPolarHBondContact O-CB 3.47Å; N631-T635 PolarHBondContact O-N 2.94Å; N631-T635 PolarHBondContact O-OG1 3.42Å; L633-T635 VanDerWaalsContact C-N 3.31Å; L633-T635 PolarHBondContact O-N 3.49Å; T635-L637 VanDerWaalsContact C-N 3.32Å; T635-L637 PolarHBondContact O-N 3.45Å; T635-W638 PolarHBondContact O-N 3.46Å; T635-V639 PolarHBondContact O-N 2.76Å
636	S	91	Very high	91	Very high	19 Å²	19	24.3 Å²	24.3	13%	0.133	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-40.1	177.1	-62.6	0	0	0	0	111.4	I632 L633 W638 V639 V640	I632-S636 VanDerWaalsContact O-CB 3.24Å; I632-S636 WeakPolarHBondContact O-CB 3.48Å; I632-S636 PolarHBondContact O-N 3.36Å; I632-S636 PolarHBondContact O-OG 3.49Å; L633-S636 PolarHBondContact O-N 3.47Å; L633-S636 VanDerWaalsContact O-N 3.17Å; S636-W638 VanDerWaalsContact C-N 3.35Å; S636-W638 PolarHBondContact O-N 3.21Å; S636-V639 WeakPolarHBondContact O-CB 3.46Å; S636-V639 PolarHBondContact O-N 3.28Å; S636-V639 VanDerWaalsContact O-N 3.13Å; S636-V640 WeakPolarHBondContact O-CG2 3.36Å; S636-V640 PolarHBondContact O-N 2.86Å
637	L	93.2	Very high	90.9	Very high	40 Å²	40	28.4 Å²	28.4	21%	0.209	14%	0.138	C	C	.	.	H	α-helix	trans	-59.9	-42.6	175.4	-71.4	171.7	0	0	0	111.8	P613 F614 L633 A634 T635 V639 V640 I641	P613-L637 HydrophobicContact CB-CD1 3.95Å; P613-L637 HydrophobicContact CG-CD1 3.72Å; F614-L637 HydrophobicContact CE1-CB 4.06Å; L633-L637 VanDerWaalsContact O-CG 3.3Å; L633-L637 WeakPolarHBondContact O-CG 3.14Å; L633-L637 PolarHBondContact O-N 3.09Å; A634-L637 PolarHBondContact O-N 3.48Å; T635-L637 VanDerWaalsContact C-N 3.32Å; T635-L637 PolarHBondContact O-N 3.45Å; L637-V639 VanDerWaalsContact C-N 3.3Å; L637-V639 PolarHBondContact O-N 3.23Å; L637-V640 WeakPolarHBondContact O-CB 2.95Å; L637-V640 PolarHBondContact O-N 3.17Å; L637-V640 VanDerWaalsContact O-N 3.11Å; L637-I641 VanDerWaalsContact O-CG1 3.28Å; L637-I641 WeakPolarHBondContact O-CG1 3.48Å; L637-I641 PolarHBondContact O-N 3.37Å
638	W	94.5	Very high	90.8	Very high	12 Å²	12	35.2 Å²	35.2	5%	0.045	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-35.7	174.4	-80.7	112.7	0	0	0	113.5	Y278 L600 V601 G604 H605 F608 F614 A634 T635 S636 I641 S642	Y278-W638 PolarHBondContact OH-NE1 3.23Å; L600-W638 HydrophobicContact CD2-CZ3 4.14Å; V601-W638 HydrophobicContact CB-CE3 4.47Å; V601-W638 HydrophobicContact CG1-CB 4.18Å; V601-W638 HydrophobicContact CG1-CD2 4.43Å; V601-W638 HydrophobicContact CG1-CE3 4.31Å; V601-W638 HydrophobicContact CG1-CG 4.38Å; V601-W638 HydrophobicContact CG2-CE3 4.39Å; G604-W638 VanDerWaalsContact O-CZ2 3.25Å; G604-W638 WeakPolarHBondContact O-CZ2 3.02Å; H605-W638 HydrophobicContact CB-CD2 4.45Å; H605-W638 HydrophobicContact CB-CZ2 4.28Å; H605-W638 VanDerWaalsContact N-CZ2 3.31Å; F608-W638 HydrophobicContact CB-CZ2 4.47Å; F608-W638 HydrophobicContact CD2-CH2 4.1Å; F608-W638 HydrophobicContact CD2-CZ2 4.22Å; F614-W638 AromaticContact CD1-CD1 3.99Å; F614-W638 AromaticContact CD1-NE1 3.49Å; F614-W638 AromaticContact CE1-CD1 3.72Å; F614-W638 HydrophobicContact CE1-CD2 4.16Å; F614-W638 AromaticContact CE1-CE2 3.52Å; F614-W638 HydrophobicContact CE1-CG 4.24Å; F614-W638 AromaticContact CE1-CZ2 3.91Å; F614-W638 HydrophobicContact CE1-CZ2 3.91Å; F614-W638 AromaticContact CE1-NE1 3.27Å; F614-W638 VanDerWaalsContact CE1-NE1 3.27Å; F614-W638 HydrophobicContact CE2-CZ2 4.06Å; F614-W638 HydrophobicContact CZ-CD2 4.46Å; F614-W638 AromaticContact CZ-CE2 3.71Å; F614-W638 HydrophobicContact CZ-CH2 4.26Å; F614-W638 AromaticContact CZ-CZ2 3.58Å; F614-W638 HydrophobicContact CZ-CZ2 3.58Å; F614-W638 AromaticContact CZ-NE1 3.91Å; A634-W638 VanDerWaalsContact O-CD1 3.3Å; A634-W638 PolarHBondContact O-N 3.04Å; T635-W638 PolarHBondContact O-N 3.46Å; S636-W638 VanDerWaalsContact C-N 3.35Å; S636-W638 PolarHBondContact O-N 3.21Å; W638-I641 HydrophobicContact CD2-CD1 4.44Å; W638-I641 HydrophobicContact CE3-CB 4.46Å; W638-I641 HydrophobicContact CE3-CD1 4.08Å; W638-I641 HydrophobicContact CE3-CG2 4.35Å; W638-I641 HydrophobicContact CZ3-CD1 4.18Å; W638-I641 HydrophobicContact CZ3-CG2 4.27Å; W638-S642 WeakPolarHBondContact O-CB 3.44Å; W638-S642 PolarHBondContact O-N 3.36Å; W638-S642 PolarHBondContact O-OG 3.46Å
639	V	91.8	Very high	90.6	Very high	25 Å²	25	45 Å²	45	15%	0.152	20%	0.204	C	C	.	.	H	α-helix	trans	-66.6	-40.7	173.1	177.5	0	0	0	0	111	V271 P590 T635 S636 L637 S642 Y643	V271-V639 HydrophobicContact CG1-CG2 4.49Å; V271-V639 HydrophobicContact CG2-CG2 3.73Å; P590-V639 HydrophobicContact CB-CG1 3.75Å; P590-V639 HydrophobicContact CG-CG1 4.19Å; T635-V639 PolarHBondContact O-N 2.76Å; S636-V639 WeakPolarHBondContact O-CB 3.46Å; S636-V639 PolarHBondContact O-N 3.28Å; S636-V639 VanDerWaalsContact O-N 3.13Å; L637-V639 VanDerWaalsContact C-N 3.3Å; L637-V639 PolarHBondContact O-N 3.23Å; V639-S642 WeakPolarHBondContact O-CB 3.44Å; V639-S642 PolarHBondContact O-N 3.02Å; V639-Y643 PolarHBondContact O-N 3.35Å
640	V	90.6	Very high	90.5	Very high	31 Å²	31	47.1 Å²	47.1	19%	0.188	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-46.3	175.5	176.4	0	0	0	0	111.6	A43 V47 S636 L637 S642 Y643 I644	A43-V640 HydrophobicContact CB-CG2 4.05Å; V47-V640 HydrophobicContact CG2-CG2 4.28Å; S636-V640 WeakPolarHBondContact O-CG2 3.36Å; S636-V640 PolarHBondContact O-N 2.86Å; L637-V640 WeakPolarHBondContact O-CB 2.95Å; L637-V640 PolarHBondContact O-N 3.17Å; L637-V640 VanDerWaalsContact O-N 3.11Å; V640-S642 VanDerWaalsContact C-N 3.28Å; V640-S642 PolarHBondContact O-N 3.18Å; V640-Y643 WeakPolarHBondContact O-CA 3.49Å; V640-Y643 WeakPolarHBondContact O-CB 3.34Å; V640-Y643 PolarHBondContact O-N 3.25Å; V640-Y643 VanDerWaalsContact O-N 3.08Å; V640-I644 HydrophobicContact CG1-CD1 4Å; V640-I644 HydrophobicContact CG1-CG1 4.47Å; V640-I644 WeakPolarHBondContact O-CG1 3.17Å; V640-I644 PolarHBondContact O-N 2.02Å
641	I	92.1	Very high	90.2	Very high	55 Å²	55	50 Å²	50	28%	0.282	23%	0.227	S	C	.	.	H	α-helix	trans	-57	-46.1	175.3	-69.7	164.9	0	0	0	109.7	F614 L637 W638 Y643 I644 L645	F614-I641 HydrophobicContact CE1-CD1 4.32Å; F614-I641 HydrophobicContact CZ-CD1 3.91Å; L637-I641 VanDerWaalsContact O-CG1 3.28Å; L637-I641 WeakPolarHBondContact O-CG1 3.48Å; L637-I641 PolarHBondContact O-N 3.37Å; W638-I641 HydrophobicContact CD2-CD1 4.44Å; W638-I641 HydrophobicContact CE3-CB 4.46Å; W638-I641 HydrophobicContact CE3-CD1 4.08Å; W638-I641 HydrophobicContact CE3-CG2 4.35Å; W638-I641 HydrophobicContact CZ3-CD1 4.18Å; W638-I641 HydrophobicContact CZ3-CG2 4.27Å; I641-Y643 VanDerWaalsContact C-N 3.3Å; I641-Y643 PolarHBondContact O-N 3.36Å; I641-I644 PolarHBondContact O-N 3.08Å; I641-I644 VanDerWaalsContact O-N 3.16Å; I641-L645 HydrophobicContact CG2-CD1 3.96Å; I641-L645 HydrophobicContact CG2-CG 4.42Å; I641-L645 VanDerWaalsContact O-CG 3.3Å; I641-L645 WeakPolarHBondContact O-CG 3.43Å; I641-L645 PolarHBondContact O-N 2.95Å
642	S	91.4	Very high	89.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-39	176.2	-60.8	0	0	0	0	112.8	V601 W638 V639 V640 Y646	V601-S642 WeakPolarHBondContact CG2-OG 3.27Å; W638-S642 WeakPolarHBondContact O-CB 3.44Å; W638-S642 PolarHBondContact O-N 3.36Å; W638-S642 PolarHBondContact O-OG 3.46Å; V639-S642 WeakPolarHBondContact O-CB 3.44Å; V639-S642 PolarHBondContact O-N 3.02Å; V640-S642 VanDerWaalsContact C-N 3.28Å; V640-S642 PolarHBondContact O-N 3.18Å; S642-Y646 WeakPolarHBondContact O-CB 3.41Å; S642-Y646 PolarHBondContact O-N 3.09Å
643	Y	88.4	Confident	88.8	Confident	14 Å²	14	62.6 Å²	62.6	6%	0.055	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-44.3	173.9	171.3	-96.4	0	0	0	112	Q36 M39 F40 Y593 V639 V640 I641 Y646 R647	Q36-Y643 PolarHBondContact O-OH 3.18Å; M39-Y643 HydrophobicContact CE-CE2 4.35Å; F40-Y643 HydrophobicContact CB-CE1 4.35Å; F40-Y643 AromaticContact CD2-CE1 3.97Å; F40-Y643 HydrophobicContact CD2-CE1 3.97Å; Y593-Y643 HydrophobicContact CD2-CD2 4.04Å; Y593-Y643 HydrophobicContact CE1-CD2 4.18Å; Y593-Y643 AromaticContact CE2-CD2 3.63Å; Y593-Y643 HydrophobicContact CE2-CD2 3.63Å; Y593-Y643 HydrophobicContact CE2-CE2 4.39Å; Y593-Y643 AromaticContact CZ-CD2 3.73Å; V639-Y643 PolarHBondContact O-N 3.35Å; V640-Y643 WeakPolarHBondContact O-CA 3.49Å; V640-Y643 WeakPolarHBondContact O-CB 3.34Å; V640-Y643 PolarHBondContact O-N 3.25Å; V640-Y643 VanDerWaalsContact O-N 3.08Å; I641-Y643 VanDerWaalsContact C-N 3.3Å; I641-Y643 PolarHBondContact O-N 3.36Å; Y643-Y646 WeakPolarHBondContact O-CB 3.48Å; Y643-Y646 PolarHBondContact O-N 3.32Å; Y643-R647 HydrophobicContact CD1-CG 4.24Å; Y643-R647 HydrophobicContact CE1-CG 3.74Å; Y643-R647 HydrophobicContact CE2-CG 4.13Å; Y643-R647 WeakPolarHBondContact O-CG 3.3Å; Y643-R647 PolarHBondContact O-N 2.92Å; Y643-R647 PolarHBondContact OH-NH1 3.39Å
644	I	89.9	Confident	87.7	Confident	75 Å²	75	63.9 Å²	63.9	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-46.5	177.7	-66.9	167	0	0	0	110.4	V640 I641 Y646 R647 K648	V640-I644 HydrophobicContact CG1-CD1 4Å; V640-I644 HydrophobicContact CG1-CG1 4.47Å; V640-I644 WeakPolarHBondContact O-CG1 3.17Å; V640-I644 PolarHBondContact O-N 2.02Å; I641-I644 PolarHBondContact O-N 3.08Å; I641-I644 VanDerWaalsContact O-N 3.16Å; I644-Y646 VanDerWaalsContact C-N 3.31Å; I644-Y646 PolarHBondContact O-N 3.17Å; I644-R647 WeakPolarHBondContact O-CB 3.28Å; I644-R647 PolarHBondContact O-N 3.05Å; I644-R647 VanDerWaalsContact O-N 3.12Å; I644-K648 PolarHBondContact O-N 3Å
645	L	89.3	Confident	87.5	Confident	26 Å²	26	67.1 Å²	67.1	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-43.4	176.3	-69.9	169	0	0	0	111.4	L600 I641 R647 K648 R649 I650	L600-L645 HydrophobicContact CD1-CD1 3.58Å; L600-L645 HydrophobicContact CD1-CD2 4.46Å; L600-L645 HydrophobicContact CD2-CD1 3.71Å; L600-L645 HydrophobicContact CG-CD1 4.33Å; I641-L645 HydrophobicContact CG2-CD1 3.96Å; I641-L645 HydrophobicContact CG2-CG 4.42Å; I641-L645 VanDerWaalsContact O-CG 3.3Å; I641-L645 WeakPolarHBondContact O-CG 3.43Å; I641-L645 PolarHBondContact O-N 2.95Å; L645-R647 PolarHBondContact O-N 2.85Å; L645-K648 CarbonylContact O-C 3.37Å; L645-K648 PolarHBondContact O-N 2.85Å; L645-R649 PolarHBondContact O-N 2.92Å; L645-I650 HydrophobicContact CD2-CB 4.03Å; L645-I650 HydrophobicContact CD2-CD1 4.32Å; L645-I650 HydrophobicContact CD2-CG2 4.02Å; L645-I650 PolarHBondContact O-N 3.45Å
646	Y	86.6	Confident	87.2	Confident	54 Å²	54	70.1 Å²	70.1	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-42.9	174.2	176.8	-94.2	0	0	0	112.2	Y592 Y593 M596 S642 Y643 I644 K648 R649 F651	Y592-Y646 HydrophobicContact CE2-CD2 4.24Å; Y592-Y646 HydrophobicContact CE2-CE1 4.42Å; Y592-Y646 AromaticContact CE2-CE2 3.77Å; Y592-Y646 HydrophobicContact CE2-CE2 3.77Å; Y592-Y646 AromaticContact CE2-CZ 3.85Å; Y593-Y646 AromaticContact CD1-CD1 3.74Å; Y593-Y646 HydrophobicContact CD1-CD1 3.74Å; Y593-Y646 AromaticContact CD1-CD2 3.97Å; Y593-Y646 HydrophobicContact CD1-CD2 3.97Å; Y593-Y646 HydrophobicContact CD1-CE1 4.35Å; Y593-Y646 AromaticContact CD1-CG 3.51Å; Y593-Y646 HydrophobicContact CD1-CG 3.51Å; Y593-Y646 AromaticContact CE1-CD1 3.37Å; Y593-Y646 HydrophobicContact CE1-CD1 3.37Å; Y593-Y646 HydrophobicContact CE1-CD2 4.22Å; Y593-Y646 AromaticContact CE1-CE1 3.67Å; Y593-Y646 HydrophobicContact CE1-CE1 3.67Å; Y593-Y646 HydrophobicContact CE1-CE2 4.47Å; Y593-Y646 AromaticContact CE1-CG 3.67Å; Y593-Y646 HydrophobicContact CE1-CG 3.67Å; M596-Y646 HydrophobicContact CE-CD2 4.24Å; M596-Y646 HydrophobicContact CE-CE2 4Å; M596-Y646 HydrophobicContact SD-CD2 3.68Å; M596-Y646 HydrophobicContact SD-CE2 3.56Å; M596-Y646 VanDerWaalsContact SD-CE2 3.56Å; S642-Y646 WeakPolarHBondContact O-CB 3.41Å; S642-Y646 PolarHBondContact O-N 3.09Å; Y643-Y646 WeakPolarHBondContact O-CB 3.48Å; Y643-Y646 PolarHBondContact O-N 3.32Å; I644-Y646 VanDerWaalsContact C-N 3.31Å; I644-Y646 PolarHBondContact O-N 3.17Å; Y646-K648 VanDerWaalsContact C-N 3.34Å; Y646-K648 PolarHBondContact O-N 2.86Å; Y646-R649 PolarHBondContact O-N 3.05Å; Y646-R649 VanDerWaalsContact O-N 3.08Å; Y646-F651 HydrophobicContact CD2-CE1 4Å; Y646-F651 AromaticContact CD2-CZ 3.94Å; Y646-F651 HydrophobicContact CD2-CZ 3.94Å; Y646-F651 HydrophobicContact CE2-CZ 4.35Å
647	R	85.8	Confident	87	Confident	128 Å²	128	72.9 Å²	72.9	48%	0.483	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-39.7	176.6	-74.7	-69.9	-63.5	-126.1	2.8	112.2	Y643 I644 L645 R649	Y643-R647 HydrophobicContact CD1-CG 4.24Å; Y643-R647 HydrophobicContact CE1-CG 3.74Å; Y643-R647 HydrophobicContact CE2-CG 4.13Å; Y643-R647 WeakPolarHBondContact O-CG 3.3Å; Y643-R647 PolarHBondContact O-N 2.92Å; Y643-R647 PolarHBondContact OH-NH1 3.39Å; I644-R647 WeakPolarHBondContact O-CB 3.28Å; I644-R647 PolarHBondContact O-N 3.05Å; I644-R647 VanDerWaalsContact O-N 3.12Å; L645-R647 PolarHBondContact O-N 2.85Å; R647-R649 PolarHBondContact O-N 2.94Å
648	K	89.4	Confident	86.6	Confident	152 Å²	152	74.8 Å²	74.8	66%	0.661	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.4	174.9	-65.5	-161.6	177.5	-172.3	0	113.6	I644 L645 Y646 I650	I644-K648 PolarHBondContact O-N 3Å; L645-K648 CarbonylContact O-C 3.37Å; L645-K648 PolarHBondContact O-N 2.85Å; Y646-K648 VanDerWaalsContact C-N 3.34Å; Y646-K648 PolarHBondContact O-N 2.86Å; K648-I650 HydrophobicContact CB-CD1 3.82Å; K648-I650 HydrophobicContact CB-CG1 3.95Å; K648-I650 HydrophobicContact CD-CD1 4.32Å; K648-I650 PolarHBondContact O-N 3.35Å
649	R	87.7	Confident	86.1	Confident	210 Å²	210	78.8 Å²	78.8	79%	0.792	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	30	-175.8	-57.7	-173.2	178.1	-178.7	3	113.8	L645 Y646 R647 F651	L645-R649 PolarHBondContact O-N 2.92Å; Y646-R649 PolarHBondContact O-N 3.05Å; Y646-R649 VanDerWaalsContact O-N 3.08Å; R647-R649 PolarHBondContact O-N 2.94Å; R649-F651 HydrophobicContact CB-CE2 4.26Å; R649-F651 WeakPolarHBondContact O-CD2 3.44Å
650	I	86.1	Confident	85.7	Confident	84 Å²	84	82.3 Å²	82.3	43%	0.431	36%	0.356	S	S	.	.			trans	-87.3	119.1	174.9	-59.7	170.8	0	0	0	107.1	N597 L645 K648	N597-I650 PolarHBondContact ND2-O 3.31Å; N597-I650 PolarHBondContact OD1-O 3.12Å; L645-I650 HydrophobicContact CD2-CB 4.03Å; L645-I650 HydrophobicContact CD2-CD1 4.32Å; L645-I650 HydrophobicContact CD2-CG2 4.02Å; L645-I650 PolarHBondContact O-N 3.45Å; K648-I650 HydrophobicContact CB-CD1 3.82Å; K648-I650 HydrophobicContact CB-CG1 3.95Å; K648-I650 HydrophobicContact CD-CD1 4.32Å; K648-I650 PolarHBondContact O-N 3.35Å
651	F	86.3	Confident	85.4	Confident	71 Å²	71	86 Å²	86	31%	0.311	37%	0.368	S	S	.	.			trans	-127.1	105.3	178.2	-61	-71.6	0	0	0	110.2	M596 N597 Y646 R649 K653	M596-F651 HydrophobicContact CB-CD1 4.24Å; M596-F651 HydrophobicContact CB-CE1 4.04Å; M596-F651 HydrophobicContact CE-CD1 4.22Å; M596-F651 HydrophobicContact CE-CE1 3.39Å; M596-F651 HydrophobicContact CE-CZ 3.62Å; M596-F651 HydrophobicContact SD-CE1 4.15Å; N597-F651 VanDerWaalsContact OD1-CA 3.29Å; N597-F651 WeakPolarHBondContact OD1-CA 3.44Å; Y646-F651 HydrophobicContact CD2-CE1 4Å; Y646-F651 AromaticContact CD2-CZ 3.94Å; Y646-F651 HydrophobicContact CD2-CZ 3.94Å; Y646-F651 HydrophobicContact CE2-CZ 4.35Å; R649-F651 HydrophobicContact CB-CE2 4.26Å; R649-F651 WeakPolarHBondContact O-CD2 3.44Å; F651-K653 PolarHBondContact O-N 3.35Å
652	W	79	Confident	84.8	Confident	153 Å²	153	88.4 Å²	88.4	58%	0.58	38%	0.375	S	S	*	.			trans	-79.2	115.8	174.2	-161.6	-18.4	0	0	0	109	N597 I599 L600	N597-W652 PolarHBondContact OD1-N 2.86Å; I599-W652 HydrophobicContact CG2-CB 4.45Å; I599-W652 HydrophobicContact CG2-CG 4.45Å; L600-W652 HydrophobicContact CB-CB 4.26Å; L600-W652 HydrophobicContact CB-CE3 4.16Å; L600-W652 HydrophobicContact CD1-CB 4.21Å; L600-W652 HydrophobicContact CD1-CE3 3.86Å; L600-W652 HydrophobicContact CG-CE3 3.97Å
653	K	75.8	Confident	84.3	Confident	139 Å²	139	95.8 Å²	95.8	60%	0.604	41%	0.406	S	S	*	.			trans	-124.8	144.6	173.1	-59.7	179.3	-173.8	173.6	0	109.1	F651	F651-K653 PolarHBondContact O-N 3.35Å
654	I	67.3	Low	83.9	Confident	43 Å²	43	103.2 Å²	103.2	22%	0.221	44%	0.438	C	S	.	.			trans	-99.9	0	169.6	-55.6	-178.2	0	0	0	108.1	R336 Q339 I343 I599	R336-I654 HydrophobicContact CB-CG2 4.45Å; R336-I654 VanDerWaalsContact CD-O 3.24Å; R336-I654 WeakPolarHBondContact CD-O 3.26Å; R336-I654 HydrophobicContact CG-CB 4.35Å; R336-I654 HydrophobicContact CG-CG2 3.96Å; R336-I654 VanDerWaalsContact CZ-O 3.3Å; R336-I654 PolarHBondContact NH1-O 3.44Å; Q339-I654 HydrophobicContact CB-CG2 3.5Å; Q339-I654 VanDerWaalsContact CB-CG2 3.5Å; Q339-I654 HydrophobicContact CG-CG2 4.22Å; I343-I654 HydrophobicContact CD1-CD1 3.51Å; I599-I654 HydrophobicContact CD1-CD1 4.11Å; I599-I654 HydrophobicContact CG1-CD1 3.67Å; I599-I654 HydrophobicContact CG1-CG1 4.36Å

Retrieved 654 of 654 residues in 2722.6 ms (Link to these results)

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