A0A096NYB4_PAPAN Loading...

Phosphodiesterase

Plays a role in signal transduction by regulating the intracellular concentration of cyclic nucleotides. This phosphodiesterase catalyzes the specific hydrolysis of cGMP to 5'-GMP. Specifically regulates nitric-oxide-generated cGMP.

AlphaFold DB , UniProt , Accession A0A096NYB4, Species PAPAN (Papio anubis, Olive baboon), Gene PDE5A, Length 875 aa.

						>A0A096NYB4_PAPAN|A0A096NYB4|PDE5A
MERAGPSFGRQRQQQQPQQQKQQQRDQDSVEAWLDDHWDFTFSYFVRKATREMVNAWFAERVHTIPVCKEGIRGHTESCSCPLQQSPRADNSAPGTPTRKISASEFDRPLRPIVVKDSEGTVSFLSDSEKKEQMPLTPPRFDHDEGDQCSRLLELVKDISSHLDVTALCHKIFLHIHGLISADRYSLFLVCEDSSNDKFLISRLFDVAEGSTLEEASNNCIRLEWNKGIVGHVAALGEPLNIKDAYEDPRFNAEVDQITGYKTQSILCMPIKNHREEVVGVAQAINKKSGNGGTFTEKDEKDFAAYLAFCGIVLHNAQLYETSLLENKRNQVLLDLASLIFEEQQSLEVILKKIAATIISFMQVQKCTIFIVDEDCSDSFSSVFHMECEELEKSSDMLTREHDANKINYMYAQYVKNTMEPLNIPDVSKDKRFPWTTENTGNVSQQCIRSLLCTPIKNGKKNKVIGVCQLVNKMEENTGKVKPFNRNDEQFLEAFVIFCGLGIQNTQMYEAVERAMAKQMVTLEVLSYHASAAEEETRELQSLAAAVVPSAQTLKITDFSFSDFELSDLETALCTIRMFTDLNLVQNFQMKHEVLCRWILSVKKNYRKNVAYHNWRHAFNTAQCMFAALKAGKIQNKLTDLEILALLIAALSHDLDHRGVNNSYIQRSEHPLAQLYCHSIMEHHHFDQCLMILNSPGNQILSGLSIEEYKTTLKIIKQAILATDLALYIKRRGEFFELIRKNQFNLEDPHQKELFLAMLMTACDLSAITKPWPIQQRIAELVASEFFDQGDRERKELNIEPTDLMNREKKNKIPSMQVGFIDAICLQLYEALTHVSEDCFPLLDGCRKNRQKWQALAEQQEKMLINGESGQAKRN
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	36.7	Very low	230 Å²	230	153 Å²	153	100%	1.133	83%	0.828	S	S	*	*				0	98.6	0	-79.4	172	159.3	0	0	106
2	E	36.1	Very low	36.7	Very low	152 Å²	152	158.7 Å²	158.7	71%	0.71	83%	0.829	S	S	*	*				61.5	130.3	100.3	-76.5	-161.6	130.8	0	0	111.7
3	R	36.4	Very low	37.1	Very low	211 Å²	211	159.9 Å²	159.9	80%	0.796	83%	0.828	S	S	*	*			cis	-170.3	156.6	16	-108.5	173.3	-163.9	-166.6	6.3	109.5
4	A	40	Very low	37.3	Very low	109 Å²	109	159.9 Å²	159.9	90%	0.901	82%	0.822	S	S	*	*			trans	70.6	115.1	142.8	0	0	0	0	0	122.9
5	G	30.4	Very low	37.3	Very low	72 Å²	72	156.3 Å²	156.3	74%	0.742	80%	0.8	S	S	*	*			trans	-143.9	139.1	149.6	0	0	0	0	0	109.2
6	P	41.4	Very low	37.8	Very low	122 Å²	122	155.1 Å²	155.1	79%	0.792	79%	0.79	S	S	*	*			trans	-89.2	148.9	-154.6	35.2	-35.5	0	0	0	114.7	F8	P6-F8 PolarHBondContact O-N 3.24Å
7	S	37.5	Very low	38.2	Very low	118 Å²	118	150.6 Å²	150.6	83%	0.825	77%	0.774	S	S	*	*			trans	-72.8	104.2	174.6	61.4	0	0	0	0	112.6
8	F	37.6	Very low	38.6	Very low	205 Å²	205	150.1 Å²	150.1	90%	0.899	77%	0.767	S	S	*	*			trans	-129.3	96.3	157.9	-95.9	-88.3	0	0	0	107.6	P6	P6-F8 PolarHBondContact O-N 3.24Å
9	G	39.6	Very low	39.1	Very low	63 Å²	63	148.5 Å²	148.5	65%	0.649	76%	0.757	S	S	*	*	S	Bend	trans	178.4	-22.3	178.8	0	0	0	0	0	115.6
10	R	35	Very low	39.7	Very low	235 Å²	235	148.1 Å²	148.1	89%	0.887	75%	0.752	S	S	*	*	S	Bend	trans	-91.3	-2.6	-177.6	-87.7	-172.7	179.3	-174.2	0.2	116.5
11	Q	36.4	Very low	40.3	Very low	166 Å²	166	148.1 Å²	148.1	78%	0.776	75%	0.746	S	S	*	*	S	Bend	trans	-95.4	-8.9	-179.2	-88	-178.9	-16.8	0	0	115.5
12	R	36.6	Very low	41.6	Very low	221 Å²	221	141.8 Å²	141.8	83%	0.834	71%	0.714	S	S	*	*	S	Bend	trans	-90.1	-16.1	179.6	-93.5	-174.3	175.5	-172.9	-1.3	115.6
13	Q	41.5	Very low	42.9	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	71%	0.709	S	S	*	*	S	Bend	trans	-96.2	-2.7	-177.2	-89.2	177.3	-8.3	0	0	115.2
14	Q	39.5	Very low	44.1	Very low	159 Å²	159	136 Å²	136	74%	0.743	70%	0.696	S	S	*	*	S	Bend	trans	-101.8	-6.8	171.8	-75.8	-177.5	-5.2	0	0	113.8
15	Q	37.9	Very low	45.4	Very low	107 Å²	107	138.3 Å²	138.3	50%	0.5	68%	0.682	S	S	.	*	S	Bend	trans	-90.3	-23	-177	-76	-177.6	-4.2	0	0	114.8	Q18 Q19	Q15-Q18 PolarHBondContact O-N 3.38Å; Q15-Q19 WeakPolarHBondContact O-CB 3.26Å; Q15-Q19 PolarHBondContact O-N 3.35Å
16	Q	45.6	Very low	47.2	Very low	136 Å²	136	138.9 Å²	138.9	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-67.2	-43.3	-175.6	-83.1	179.7	-15.5	0	0	114.8	Q18 Q19 Q20	Q16-Q18 VanDerWaalsContact C-N 3.31Å; Q16-Q18 PolarHBondContact O-N 2.9Å; Q16-Q19 PolarHBondContact O-N 2.92Å; Q16-Q20 PolarHBondContact O-N 3.4Å; Q16-Q20 VanDerWaalsContact O-N 3.12Å
17	P	43.4	Very low	48.5	Very low	79 Å²	79	138.4 Å²	138.4	51%	0.513	66%	0.655	S	S	.	*	H	α-helix	trans	-70.7	-28.5	177.2	-16.7	30.4	0	0	0	112.7	K21	P17-K21 WeakPolarHBondContact O-CB 3.39Å; P17-K21 PolarHBondContact O-N 3.17Å
18	Q	45.3	Very low	50.1	Low	141 Å²	141	136.7 Å²	136.7	66%	0.659	64%	0.637	S	S	*	*	H	α-helix	trans	-73.9	-36.3	174.1	-82.1	-177.8	-14	0	0	111.7	Q15 Q16 Q22	Q15-Q18 PolarHBondContact O-N 3.38Å; Q16-Q18 VanDerWaalsContact C-N 3.31Å; Q16-Q18 PolarHBondContact O-N 2.9Å; Q18-Q22 VanDerWaalsContact O-CB 3.22Å; Q18-Q22 WeakPolarHBondContact O-CB 3.1Å; Q18-Q22 PolarHBondContact O-N 3.07Å
19	Q	49.8	Very low	52	Low	121 Å²	121	130.6 Å²	130.6	57%	0.565	62%	0.619	S	S	*	*	H	α-helix	trans	-66.7	-40.9	174.5	-90.2	179.3	-15.6	0	0	112.9	Q15 Q16 Q22 Q23	Q15-Q19 WeakPolarHBondContact O-CB 3.26Å; Q15-Q19 PolarHBondContact O-N 3.35Å; Q16-Q19 PolarHBondContact O-N 2.92Å; Q19-Q22 PolarHBondContact O-N 3.04Å; Q19-Q23 WeakPolarHBondContact O-CB 3.32Å; Q19-Q23 PolarHBondContact O-N 3.06Å
20	Q	49.9	Very low	53.7	Low	140 Å²	140	131.6 Å²	131.6	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-66.9	-41.6	174.6	-85.7	178.5	-17.5	0	0	112.3	Q16 Q22 Q23 Q24	Q16-Q20 PolarHBondContact O-N 3.4Å; Q16-Q20 VanDerWaalsContact O-N 3.12Å; Q20-Q22 VanDerWaalsContact C-N 3.26Å; Q20-Q22 PolarHBondContact O-N 2.8Å; Q20-Q23 PolarHBondContact O-N 2.77Å; Q20-Q24 WeakPolarHBondContact O-CB 3.39Å; Q20-Q24 PolarHBondContact O-N 2.95Å
21	K	52.8	Low	55.6	Low	148 Å²	148	125.8 Å²	125.8	64%	0.643	60%	0.595	S	S	*	*	H	α-helix	trans	-68.7	-22.3	173.9	-80	-173.6	175.7	-176	0	113.9	P17 R25	P17-K21 WeakPolarHBondContact O-CB 3.39Å; P17-K21 PolarHBondContact O-N 3.17Å; K21-R25 WeakPolarHBondContact O-CB 3.43Å; K21-R25 PolarHBondContact O-N 2.7Å; K21-R25 PolarHBondContact O-NE 2.84Å
22	Q	60.7	Low	57.7	Low	97 Å²	97	120.2 Å²	120.2	45%	0.453	58%	0.578	S	S	.	*	H	α-helix	trans	-80.9	-44	173.1	-167.9	67.9	37.9	0	0	110.3	Q18 Q19 Q20 Q24 R25 D26	Q18-Q22 VanDerWaalsContact O-CB 3.22Å; Q18-Q22 WeakPolarHBondContact O-CB 3.1Å; Q18-Q22 PolarHBondContact O-N 3.07Å; Q19-Q22 PolarHBondContact O-N 3.04Å; Q20-Q22 VanDerWaalsContact C-N 3.26Å; Q20-Q22 PolarHBondContact O-N 2.8Å; Q22-Q24 PolarHBondContact O-N 2.91Å; Q22-R25 PolarHBondContact O-N 2.73Å; Q22-D26 PolarHBondContact NE2-OD1 3.33Å; Q22-D26 VanDerWaalsContact NE2-OD1 3.13Å; Q22-D26 WeakPolarHBondContact O-CB 3.34Å; Q22-D26 PolarHBondContact O-N 2.93Å
23	Q	63.6	Low	60.2	Low	129 Å²	129	115.4 Å²	115.4	60%	0.603	56%	0.56	S	S	*	*	H	α-helix	trans	-59.7	-44.6	174.3	-91.7	177.9	-23.5	0	0	112.4	Q19 Q20 R25 D26 Q27	Q19-Q23 WeakPolarHBondContact O-CB 3.32Å; Q19-Q23 PolarHBondContact O-N 3.06Å; Q20-Q23 PolarHBondContact O-N 2.77Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 2.98Å; Q23-D26 PolarHBondContact O-N 3.35Å; Q23-Q27 WeakPolarHBondContact O-CB 3.35Å; Q23-Q27 PolarHBondContact O-N 3.12Å
24	Q	61.4	Low	62	Low	114 Å²	114	109.5 Å²	109.5	53%	0.533	53%	0.534	S	S	.	.	H	α-helix	trans	-61.2	-44.2	176.3	-158.1	82.1	35.5	0	0	111.1	Q20 Q22 Q27 D28	Q20-Q24 WeakPolarHBondContact O-CB 3.39Å; Q20-Q24 PolarHBondContact O-N 2.95Å; Q22-Q24 PolarHBondContact O-N 2.91Å; Q24-Q27 PolarHBondContact O-N 3.49Å; Q24-D28 WeakPolarHBondContact O-CB 3.21Å; Q24-D28 PolarHBondContact O-N 3.4Å
25	R	66.7	Low	63.6	Low	157 Å²	157	108 Å²	108	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-66.6	-37.4	177.2	-92.9	-171.6	-86.1	-169	-6	113.4	K21 Q22 Q23 Q27 S29	K21-R25 WeakPolarHBondContact O-CB 3.43Å; K21-R25 PolarHBondContact O-N 2.7Å; K21-R25 PolarHBondContact O-NE 2.84Å; Q22-R25 PolarHBondContact O-N 2.73Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 2.98Å; R25-Q27 VanDerWaalsContact C-N 3.32Å; R25-S29 WeakPolarHBondContact O-CB 3.22Å; R25-S29 PolarHBondContact O-N 3.38Å
26	D	69.9	Low	65.7	Low	84 Å²	84	109.4 Å²	109.4	45%	0.449	54%	0.542	S	S	.	.	H	α-helix	trans	-69.7	-35.1	176.5	-66.2	-12.9	0	0	0	110	Q22 Q23 S29 V30	Q22-D26 PolarHBondContact NE2-OD1 3.33Å; Q22-D26 VanDerWaalsContact NE2-OD1 3.13Å; Q22-D26 WeakPolarHBondContact O-CB 3.34Å; Q22-D26 PolarHBondContact O-N 2.93Å; Q23-D26 PolarHBondContact O-N 3.35Å; D26-S29 PolarHBondContact O-N 3.17Å; D26-V30 WeakPolarHBondContact O-CB 3.08Å; D26-V30 WeakPolarHBondContact O-CG2 3.37Å; D26-V30 PolarHBondContact O-N 3.25Å
27	Q	66.9	Low	67.2	Low	112 Å²	112	106.9 Å²	106.9	52%	0.523	53%	0.53	S	S	.	.	H	α-helix	trans	-70.7	-46.4	177.1	-160.7	165.6	2.4	0	0	111.5	Q23 Q24 R25 S29 V30 E31	Q23-Q27 WeakPolarHBondContact O-CB 3.35Å; Q23-Q27 PolarHBondContact O-N 3.12Å; Q24-Q27 PolarHBondContact O-N 3.49Å; R25-Q27 VanDerWaalsContact C-N 3.32Å; Q27-S29 VanDerWaalsContact C-N 3.28Å; Q27-S29 PolarHBondContact O-N 2.99Å; Q27-V30 PolarHBondContact O-N 3.47Å; Q27-V30 VanDerWaalsContact O-N 3.15Å; Q27-E31 PolarHBondContact O-N 3.3Å
28	D	72.3	Confident	68.6	Low	82 Å²	82	111.1 Å²	111.1	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-37.1	173.4	-62.1	-17.4	0	0	0	111.1	Q24 A32	Q24-D28 WeakPolarHBondContact O-CB 3.21Å; Q24-D28 PolarHBondContact O-N 3.4Å; D28-A32 WeakPolarHBondContact O-CB 3.26Å; D28-A32 PolarHBondContact O-N 3.37Å
29	S	76.9	Confident	70	Confident	77 Å²	77	110.3 Å²	110.3	54%	0.538	54%	0.536	S	S	.	.	H	α-helix	trans	-70.2	-32.2	175.7	-177.2	0	0	0	0	112.7	R25 D26 Q27 W33	R25-S29 WeakPolarHBondContact O-CB 3.22Å; R25-S29 PolarHBondContact O-N 3.38Å; D26-S29 PolarHBondContact O-N 3.17Å; Q27-S29 VanDerWaalsContact C-N 3.28Å; Q27-S29 PolarHBondContact O-N 2.99Å; S29-W33 VanDerWaalsContact O-CB 3.28Å; S29-W33 WeakPolarHBondContact O-CB 3.04Å; S29-W33 PolarHBondContact O-N 3.43Å; S29-W33 VanDerWaalsContact O-N 3.1Å
30	V	75.5	Confident	71.8	Confident	83 Å²	83	109 Å²	109	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-73.6	-41.9	175.1	166.8	0	0	0	0	110.2	D26 Q27 W33 L34	D26-V30 WeakPolarHBondContact O-CB 3.08Å; D26-V30 WeakPolarHBondContact O-CG2 3.37Å; D26-V30 PolarHBondContact O-N 3.25Å; Q27-V30 PolarHBondContact O-N 3.47Å; Q27-V30 VanDerWaalsContact O-N 3.15Å; V30-W33 PolarHBondContact O-N 3.07Å; V30-L34 HydrophobicContact CG1-CD1 3.89Å; V30-L34 HydrophobicContact CG1-CG 4.33Å; V30-L34 WeakPolarHBondContact O-CB 3.22Å; V30-L34 VanDerWaalsContact O-CG 3.22Å; V30-L34 WeakPolarHBondContact O-CG 3.33Å; V30-L34 PolarHBondContact O-N 2.81Å
31	E	74.9	Confident	73.4	Confident	113 Å²	113	104.4 Å²	104.4	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-49.7	174.8	-76	-174.5	176.2	0	0	111.4	Q27 W33 L34 D35	Q27-E31 PolarHBondContact O-N 3.3Å; E31-W33 VanDerWaalsContact C-N 3.27Å; E31-W33 PolarHBondContact O-N 2.77Å; E31-L34 PolarHBondContact O-N 3.27Å; E31-L34 VanDerWaalsContact O-N 3.09Å; E31-D35 PolarHBondContact O-N 3.46Å
32	A	80.4	Confident	74.2	Confident	50 Å²	50	102.9 Å²	102.9	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-58.8	-38.8	175.9	0	0	0	0	0	112.4	D28 D35 D36	D28-A32 WeakPolarHBondContact O-CB 3.26Å; D28-A32 PolarHBondContact O-N 3.37Å; A32-D35 PolarHBondContact O-N 3.34Å; A32-D36 WeakPolarHBondContact O-CB 3.34Å; A32-D36 PolarHBondContact O-N 2.99Å
33	W	89.8	Confident	75	Confident	120 Å²	120	100.4 Å²	100.4	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-68.3	-38.8	175.9	-172.4	90.2	0	0	0	112.5	S29 V30 E31 D35 D36 H37 F40	S29-W33 VanDerWaalsContact O-CB 3.28Å; S29-W33 WeakPolarHBondContact O-CB 3.04Å; S29-W33 PolarHBondContact O-N 3.43Å; S29-W33 VanDerWaalsContact O-N 3.1Å; V30-W33 PolarHBondContact O-N 3.07Å; E31-W33 VanDerWaalsContact C-N 3.27Å; E31-W33 PolarHBondContact O-N 2.77Å; W33-D35 VanDerWaalsContact C-N 3.34Å; W33-D36 PolarHBondContact O-N 2.82Å; W33-H37 AromaticContact CD1-CE1 3.55Å; W33-H37 AromaticContact CD1-ND1 3.7Å; W33-H37 AromaticContact CD2-ND1 3.69Å; W33-H37 AromaticContact CE2-CE1 3.62Å; W33-H37 AromaticContact CE2-CG 3.76Å; W33-H37 AromaticContact CE2-ND1 3.5Å; W33-H37 AromaticContact CE2-NE2 3.9Å; W33-H37 HydrophobicContact CE3-CB 4.41Å; W33-H37 AromaticContact CG-ND1 3.83Å; W33-H37 HydrophobicContact CH2-CB 4.2Å; W33-H37 HydrophobicContact CZ2-CB 4.33Å; W33-H37 AromaticContact CZ2-CD2 3.8Å; W33-H37 AromaticContact CZ2-CG 3.79Å; W33-H37 HydrophobicContact CZ3-CB 4.24Å; W33-H37 AromaticContact NE1-CE1 3.19Å; W33-H37 PolarHBondContact NE1-CE1 2.98Å; W33-H37 AromaticContact NE1-ND1 3.5Å; W33-H37 PolarHBondContact NE1-ND1 2.87Å; W33-H37 AromaticContact NE1-NE2 3.64Å; W33-H37 WeakPolarHBondContact O-CB 3.24Å; W33-H37 PolarHBondContact O-N 3.46Å; W33-H37 PolarHBondContact O-ND1 3.45Å; W33-F40 AromaticContact CH2-CD1 3.98Å; W33-F40 HydrophobicContact CH2-CD1 3.98Å; W33-F40 HydrophobicContact CH2-CE1 4.31Å; W33-F40 HydrophobicContact CH2-CG 4.18Å; W33-F40 AromaticContact CZ3-CD1 3.58Å; W33-F40 HydrophobicContact CZ3-CD1 3.58Å; W33-F40 AromaticContact CZ3-CE1 3.83Å; W33-F40 HydrophobicContact CZ3-CE1 3.83Å; W33-F40 HydrophobicContact CZ3-CG 4.23Å
34	L	77.9	Confident	75.6	Confident	50 Å²	50	100.3 Å²	100.3	26%	0.262	49%	0.492	S	S	.	.	H	α-helix	trans	-67.1	-35.2	176.2	-72.8	170.7	0	0	0	112	V30 E31 H37 F40 T41	V30-L34 HydrophobicContact CG1-CD1 3.89Å; V30-L34 HydrophobicContact CG1-CG 4.33Å; V30-L34 WeakPolarHBondContact O-CB 3.22Å; V30-L34 VanDerWaalsContact O-CG 3.22Å; V30-L34 WeakPolarHBondContact O-CG 3.33Å; V30-L34 PolarHBondContact O-N 2.81Å; E31-L34 PolarHBondContact O-N 3.27Å; E31-L34 VanDerWaalsContact O-N 3.09Å; L34-H37 CarbonylContact O-C 3.56Å; L34-H37 PolarHBondContact O-N 2.72Å; L34-F40 HydrophobicContact CD2-CD1 4.09Å; L34-F40 HydrophobicContact CD2-CE1 4.13Å; L34-T41 WeakPolarHBondContact CA-OG1 3.35Å; L34-T41 HydrophobicContact CB-CG2 4.27Å; L34-T41 WeakPolarHBondContact CB-OG1 3.15Å; L34-T41 HydrophobicContact CD2-CG2 4.38Å; L34-T41 VanDerWaalsContact CD2-OG1 3.31Å; L34-T41 WeakPolarHBondContact CD2-OG1 3.35Å; L34-T41 PolarHBondContact O-OG1 3.16Å
35	D	74.5	Confident	76.3	Confident	128 Å²	128	100.7 Å²	100.7	68%	0.684	49%	0.492	S	S	*	.	H	α-helix	trans	-67.5	-42.6	174.3	-73.4	-18.6	0	0	0	111.3	E31 A32 W33 H37	E31-D35 PolarHBondContact O-N 3.46Å; A32-D35 PolarHBondContact O-N 3.34Å; W33-D35 VanDerWaalsContact C-N 3.34Å; D35-H37 VanDerWaalsContact C-N 3.28Å; D35-H37 PolarHBondContact O-N 2.84Å
36	D	80.9	Confident	76.5	Confident	137 Å²	137	98 Å²	98	73%	0.733	49%	0.493	S	S	*	.	H	α-helix	trans	-72.5	-17.6	177	-77.9	-15.3	0	0	0	113.5	A32 W33	A32-D36 WeakPolarHBondContact O-CB 3.34Å; A32-D36 PolarHBondContact O-N 2.99Å; W33-D36 PolarHBondContact O-N 2.82Å
37	H	77.8	Confident	76.8	Confident	83 Å²	83	101.8 Å²	101.8	38%	0.384	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	54.3	-178.1	-61.7	74.2	0	0	0	111.9	W33 L34 D35 D39 F40 T41	W33-H37 AromaticContact CD1-CE1 3.55Å; W33-H37 AromaticContact CD1-ND1 3.7Å; W33-H37 AromaticContact CD2-ND1 3.69Å; W33-H37 AromaticContact CE2-CE1 3.62Å; W33-H37 AromaticContact CE2-CG 3.76Å; W33-H37 AromaticContact CE2-ND1 3.5Å; W33-H37 AromaticContact CE2-NE2 3.9Å; W33-H37 HydrophobicContact CE3-CB 4.41Å; W33-H37 AromaticContact CG-ND1 3.83Å; W33-H37 HydrophobicContact CH2-CB 4.2Å; W33-H37 HydrophobicContact CZ2-CB 4.33Å; W33-H37 AromaticContact CZ2-CD2 3.8Å; W33-H37 AromaticContact CZ2-CG 3.79Å; W33-H37 HydrophobicContact CZ3-CB 4.24Å; W33-H37 AromaticContact NE1-CE1 3.19Å; W33-H37 PolarHBondContact NE1-CE1 2.98Å; W33-H37 AromaticContact NE1-ND1 3.5Å; W33-H37 PolarHBondContact NE1-ND1 2.87Å; W33-H37 AromaticContact NE1-NE2 3.64Å; W33-H37 WeakPolarHBondContact O-CB 3.24Å; W33-H37 PolarHBondContact O-N 3.46Å; W33-H37 PolarHBondContact O-ND1 3.45Å; L34-H37 CarbonylContact O-C 3.56Å; L34-H37 PolarHBondContact O-N 2.72Å; D35-H37 VanDerWaalsContact C-N 3.28Å; D35-H37 PolarHBondContact O-N 2.84Å; H37-D39 VanDerWaalsContact C-N 3.28Å; H37-D39 PolarHBondContact O-N 2.81Å; H37-D39 VanDerWaalsContact O-N 3.14Å; H37-F40 HydrophobicContact CB-CB 4.37Å; H37-F40 WeakPolarHBondContact O-CB 3.49Å; H37-F40 PolarHBondContact O-N 2.86Å; H37-T41 PolarHBondContact O-N 2.84Å; H37-T41 VanDerWaalsContact O-N 3.09Å; H37-T41 PolarHBondContact O-OG1 2.81Å
38	W	73.1	Confident	77.1	Confident	167 Å²	167	102.8 Å²	102.8	63%	0.633	50%	0.503	S	S	*	.	H	α-helix	trans	-48.9	-41.3	-176.2	-179.3	86.9	0	0	0	114.5	F40 T41 F42	W38-F40 VanDerWaalsContact C-N 3.34Å; W38-F40 PolarHBondContact O-N 2.84Å; W38-T41 PolarHBondContact O-N 3.02Å; W38-F42 HydrophobicContact CH2-CG 4.36Å; W38-F42 HydrophobicContact CZ2-CB 4.43Å; W38-F42 HydrophobicContact CZ2-CD2 4.09Å; W38-F42 HydrophobicContact CZ2-CG 4.27Å; W38-F42 VanDerWaalsContact O-CB 3.24Å; W38-F42 WeakPolarHBondContact O-CB 3.28Å; W38-F42 PolarHBondContact O-N 3.39Å
39	D	74.5	Confident	77.1	Confident	124 Å²	124	100.3 Å²	100.3	66%	0.663	50%	0.495	S	S	*	.	H	α-helix	trans	-62.2	-40.2	179.5	-72.1	-39.4	0	0	0	112.6	H37 S43	H37-D39 VanDerWaalsContact C-N 3.28Å; H37-D39 PolarHBondContact O-N 2.81Å; H37-D39 VanDerWaalsContact O-N 3.14Å; D39-S43 WeakPolarHBondContact O-CB 3.46Å; D39-S43 PolarHBondContact O-N 3.43Å
40	F	88.2	Confident	76.9	Confident	95 Å²	95	99.7 Å²	99.7	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-69.5	-46.4	176.3	174.6	-91.2	0	0	0	110.4	W33 L34 H37 W38 S43 Y44	W33-F40 AromaticContact CH2-CD1 3.98Å; W33-F40 HydrophobicContact CH2-CD1 3.98Å; W33-F40 HydrophobicContact CH2-CE1 4.31Å; W33-F40 HydrophobicContact CH2-CG 4.18Å; W33-F40 AromaticContact CZ3-CD1 3.58Å; W33-F40 HydrophobicContact CZ3-CD1 3.58Å; W33-F40 AromaticContact CZ3-CE1 3.83Å; W33-F40 HydrophobicContact CZ3-CE1 3.83Å; W33-F40 HydrophobicContact CZ3-CG 4.23Å; L34-F40 HydrophobicContact CD2-CD1 4.09Å; L34-F40 HydrophobicContact CD2-CE1 4.13Å; H37-F40 HydrophobicContact CB-CB 4.37Å; H37-F40 WeakPolarHBondContact O-CB 3.49Å; H37-F40 PolarHBondContact O-N 2.86Å; W38-F40 VanDerWaalsContact C-N 3.34Å; W38-F40 PolarHBondContact O-N 2.84Å; F40-S43 PolarHBondContact O-N 3.01Å; F40-Y44 HydrophobicContact CZ-CD2 4.42Å; F40-Y44 VanDerWaalsContact O-CB 3.25Å; F40-Y44 WeakPolarHBondContact O-CB 3.46Å; F40-Y44 PolarHBondContact O-N 3.24Å
41	T	83.4	Confident	75.9	Confident	42 Å²	42	104.7 Å²	104.7	26%	0.258	50%	0.497	S	S	.	.	H	α-helix	trans	-61.3	-46.3	-179.4	-56.8	0	0	0	0	111.5	L34 H37 W38 Y44 F45	L34-T41 WeakPolarHBondContact CA-OG1 3.35Å; L34-T41 HydrophobicContact CB-CG2 4.27Å; L34-T41 WeakPolarHBondContact CB-OG1 3.15Å; L34-T41 HydrophobicContact CD2-CG2 4.38Å; L34-T41 VanDerWaalsContact CD2-OG1 3.31Å; L34-T41 WeakPolarHBondContact CD2-OG1 3.35Å; L34-T41 PolarHBondContact O-OG1 3.16Å; H37-T41 PolarHBondContact O-N 2.84Å; H37-T41 VanDerWaalsContact O-N 3.09Å; H37-T41 PolarHBondContact O-OG1 2.81Å; W38-T41 PolarHBondContact O-N 3.02Å; T41-Y44 PolarHBondContact O-N 3.06Å; T41-F45 VanDerWaalsContact O-CB 3.26Å; T41-F45 WeakPolarHBondContact O-CB 3.32Å; T41-F45 PolarHBondContact O-N 3.16Å
42	F	69.6	Low	75.4	Confident	117 Å²	117	105.1 Å²	105.1	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-48.4	174.7	-176.6	-98.3	0	0	0	111.3	W38 Y44 F45 V46	W38-F42 HydrophobicContact CH2-CG 4.36Å; W38-F42 HydrophobicContact CZ2-CB 4.43Å; W38-F42 HydrophobicContact CZ2-CD2 4.09Å; W38-F42 HydrophobicContact CZ2-CG 4.27Å; W38-F42 VanDerWaalsContact O-CB 3.24Å; W38-F42 WeakPolarHBondContact O-CB 3.28Å; W38-F42 PolarHBondContact O-N 3.39Å; F42-Y44 VanDerWaalsContact C-N 3.34Å; F42-Y44 PolarHBondContact O-N 3.39Å; F42-F45 PolarHBondContact O-N 3.46Å; F42-V46 HydrophobicContact CD1-CG2 4.32Å; F42-V46 HydrophobicContact CE1-CG2 4.02Å; F42-V46 HydrophobicContact CE2-CG2 4.41Å; F42-V46 HydrophobicContact CZ-CG2 4.07Å; F42-V46 WeakPolarHBondContact O-CB 3.33Å; F42-V46 VanDerWaalsContact O-CG2 3.25Å; F42-V46 WeakPolarHBondContact O-CG2 3.32Å; F42-V46 PolarHBondContact O-N 2.76Å
43	S	75.9	Confident	74.6	Confident	45 Å²	45	108.2 Å²	108.2	32%	0.315	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-35.3	179	-172.8	0	0	0	0	113.3	D39 F40 R47	D39-S43 WeakPolarHBondContact O-CB 3.46Å; D39-S43 PolarHBondContact O-N 3.43Å; F40-S43 PolarHBondContact O-N 3.01Å; S43-R47 WeakPolarHBondContact O-CB 3.38Å; S43-R47 VanDerWaalsContact O-CG 3.31Å; S43-R47 WeakPolarHBondContact O-CG 2.89Å; S43-R47 PolarHBondContact O-N 3.13Å; S43-R47 PolarHBondContact O-NE 3.41Å; S43-R47 PolarHBondContact OG-NE 3.46Å; S43-R47 PolarHBondContact OG-NH2 3.33Å
44	Y	76.1	Confident	73.1	Confident	127 Å²	127	104.5 Å²	104.5	50%	0.498	50%	0.497	S	S	.	.	H	α-helix	trans	-71.7	-44.6	176.8	-175.8	-95.7	0	0	0	111	F40 T41 F42 R47 K48	F40-Y44 HydrophobicContact CZ-CD2 4.42Å; F40-Y44 VanDerWaalsContact O-CB 3.25Å; F40-Y44 WeakPolarHBondContact O-CB 3.46Å; F40-Y44 PolarHBondContact O-N 3.24Å; T41-Y44 PolarHBondContact O-N 3.06Å; F42-Y44 VanDerWaalsContact C-N 3.34Å; F42-Y44 PolarHBondContact O-N 3.39Å; Y44-R47 PolarHBondContact O-N 3Å; Y44-R47 VanDerWaalsContact O-N 3.13Å; Y44-K48 HydrophobicContact CD2-CG 4.38Å; Y44-K48 HydrophobicContact CE1-CB 4.29Å; Y44-K48 HydrophobicContact CE1-CG 4.3Å; Y44-K48 HydrophobicContact CE2-CG 4.02Å; Y44-K48 WeakPolarHBondContact O-CB 3.36Å; Y44-K48 PolarHBondContact O-N 3.21Å
45	F	77.7	Confident	71.9	Confident	122 Å²	122	106.6 Å²	106.6	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-47.7	177.4	-169.9	-94.4	0	0	0	111.6	T41 F42 R47 K48 A49 V54	T41-F45 VanDerWaalsContact O-CB 3.26Å; T41-F45 WeakPolarHBondContact O-CB 3.32Å; T41-F45 PolarHBondContact O-N 3.16Å; F42-F45 PolarHBondContact O-N 3.46Å; F45-R47 PolarHBondContact O-N 3.06Å; F45-R47 VanDerWaalsContact O-N 3.16Å; F45-K48 PolarHBondContact O-N 2.73Å; F45-A49 HydrophobicContact CD1-CB 3.92Å; F45-A49 HydrophobicContact CD2-CB 3.95Å; F45-A49 HydrophobicContact CE1-CB 3.74Å; F45-A49 HydrophobicContact CE2-CB 3.77Å; F45-A49 HydrophobicContact CG-CB 4.02Å; F45-A49 HydrophobicContact CZ-CB 3.67Å; F45-A49 WeakPolarHBondContact O-CB 3.38Å; F45-A49 PolarHBondContact O-N 3.45Å; F45-V54 HydrophobicContact CE1-CG2 4.45Å; F45-V54 HydrophobicContact CZ-CG2 4.11Å
46	V	70.8	Confident	71	Confident	100 Å²	100	103.2 Å²	103.2	61%	0.606	50%	0.499	S	S	*	.	H	α-helix	trans	-58.4	-30.4	176	170.9	0	0	0	0	112.4	F42	F42-V46 HydrophobicContact CD1-CG2 4.32Å; F42-V46 HydrophobicContact CE1-CG2 4.02Å; F42-V46 HydrophobicContact CE2-CG2 4.41Å; F42-V46 HydrophobicContact CZ-CG2 4.07Å; F42-V46 WeakPolarHBondContact O-CB 3.33Å; F42-V46 VanDerWaalsContact O-CG2 3.25Å; F42-V46 WeakPolarHBondContact O-CG2 3.32Å; F42-V46 PolarHBondContact O-N 2.76Å
47	R	76.1	Confident	69.7	Low	163 Å²	163	102.5 Å²	102.5	62%	0.615	49%	0.486	S	S	*	.	H	α-helix	trans	-87	-23.5	-179.3	-76.4	-177	-83.1	173.7	-6.8	114.4	S43 Y44 F45	S43-R47 WeakPolarHBondContact O-CB 3.38Å; S43-R47 VanDerWaalsContact O-CG 3.31Å; S43-R47 WeakPolarHBondContact O-CG 2.89Å; S43-R47 PolarHBondContact O-N 3.13Å; S43-R47 PolarHBondContact O-NE 3.41Å; S43-R47 PolarHBondContact OG-NE 3.46Å; S43-R47 PolarHBondContact OG-NH2 3.33Å; Y44-R47 PolarHBondContact O-N 3Å; Y44-R47 VanDerWaalsContact O-N 3.13Å; F45-R47 PolarHBondContact O-N 3.06Å; F45-R47 VanDerWaalsContact O-N 3.16Å
48	K	73.3	Confident	68	Low	133 Å²	133	103.4 Å²	103.4	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-127.1	-19.1	-166.6	-66.5	-63.7	-173.4	179.7	0	115.1	Y44 F45 T50	Y44-K48 HydrophobicContact CD2-CG 4.38Å; Y44-K48 HydrophobicContact CE1-CB 4.29Å; Y44-K48 HydrophobicContact CE1-CG 4.3Å; Y44-K48 HydrophobicContact CE2-CG 4.02Å; Y44-K48 WeakPolarHBondContact O-CB 3.36Å; Y44-K48 PolarHBondContact O-N 3.21Å; F45-K48 PolarHBondContact O-N 2.73Å; K48-T50 PolarHBondContact O-N 3.39Å
49	A	71.8	Confident	66.8	Low	31 Å²	31	98.6 Å²	98.6	26%	0.256	48%	0.484	S	S	.	.			trans	-69.7	119.1	176.5	0	0	0	0	0	109.7	F45 V54	F45-A49 HydrophobicContact CD1-CB 3.92Å; F45-A49 HydrophobicContact CD2-CB 3.95Å; F45-A49 HydrophobicContact CE1-CB 3.74Å; F45-A49 HydrophobicContact CE2-CB 3.77Å; F45-A49 HydrophobicContact CG-CB 4.02Å; F45-A49 HydrophobicContact CZ-CB 3.67Å; F45-A49 WeakPolarHBondContact O-CB 3.38Å; F45-A49 PolarHBondContact O-N 3.45Å; A49-V54 HydrophobicContact CB-CG2 4.15Å
50	T	73.4	Confident	65.2	Low	64 Å²	64	99.9 Å²	99.9	39%	0.393	49%	0.487	S	S	.	.			trans	-85.4	158.8	172.7	69.5	0	0	0	0	110.4	K48 E52 M53 V54	K48-T50 PolarHBondContact O-N 3.39Å; T50-E52 WeakPolarHBondContact CB-OE2 3.47Å; T50-E52 PolarHBondContact O-N 2.99Å; T50-E52 PolarHBondContact OG1-OE2 3.49Å; T50-M53 PolarHBondContact O-N 2.93Å; T50-M53 VanDerWaalsContact O-N 3.12Å; T50-M53 WeakPolarHBondContact OG1-CG 3.42Å; T50-M53 PolarHBondContact OG1-N 2.53Å; T50-V54 WeakPolarHBondContact O-CG2 3.36Å; T50-V54 PolarHBondContact O-N 2.92Å; T50-V54 VanDerWaalsContact O-N 3.12Å
51	R	54	Low	63.1	Low	187 Å²	187	103.3 Å²	103.3	71%	0.706	50%	0.497	S	S	*	.	H	α-helix	trans	-59.5	-33.1	178.8	-166.2	169.3	69.1	162.4	3.4	111.7	N55	R51-N55 VanDerWaalsContact O-CB 3.23Å; R51-N55 WeakPolarHBondContact O-CB 3.39Å; R51-N55 PolarHBondContact O-N 3.45Å; R51-N55 PolarHBondContact O-ND2 3.31Å; R51-N55 PolarHBondContact O-OD1 3.35Å
52	E	63.6	Low	60.8	Low	123 Å²	123	105.9 Å²	105.9	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-68.2	-40.2	176.4	-61.7	71.8	-148.4	0	0	112.3	T50 N55 A56	T50-E52 WeakPolarHBondContact CB-OE2 3.47Å; T50-E52 PolarHBondContact O-N 2.99Å; T50-E52 PolarHBondContact OG1-OE2 3.49Å; E52-N55 PolarHBondContact O-N 2.94Å; E52-A56 WeakPolarHBondContact O-CB 3.47Å; E52-A56 PolarHBondContact O-N 2.72Å
53	M	64.4	Low	59.1	Low	115 Å²	115	108.2 Å²	108.2	57%	0.567	52%	0.524	S	S	*	.	H	α-helix	trans	-64.2	-43	176.1	-70	172.5	67.3	0	0	111.4	T50 W57	T50-M53 PolarHBondContact O-N 2.93Å; T50-M53 VanDerWaalsContact O-N 3.12Å; T50-M53 WeakPolarHBondContact OG1-CG 3.42Å; T50-M53 PolarHBondContact OG1-N 2.53Å; M53-W57 WeakPolarHBondContact O-CB 3.38Å; M53-W57 PolarHBondContact O-N 3.28Å; M53-W57 VanDerWaalsContact O-N 3.12Å
54	V	58.6	Low	56.8	Low	42 Å²	42	112.4 Å²	112.4	26%	0.255	55%	0.548	S	S	.	.	H	α-helix	trans	-67.3	-43.9	178	177.9	0	0	0	0	110.4	F45 A49 T50 W57 F58	F45-V54 HydrophobicContact CE1-CG2 4.45Å; F45-V54 HydrophobicContact CZ-CG2 4.11Å; A49-V54 HydrophobicContact CB-CG2 4.15Å; T50-V54 WeakPolarHBondContact O-CG2 3.36Å; T50-V54 PolarHBondContact O-N 2.92Å; T50-V54 VanDerWaalsContact O-N 3.12Å; V54-W57 WeakPolarHBondContact O-CB 3.3Å; V54-W57 PolarHBondContact O-N 2.96Å; V54-F58 HydrophobicContact CG1-CD2 3.72Å; V54-F58 HydrophobicContact CG1-CE2 3.82Å; V54-F58 WeakPolarHBondContact O-CD2 3.22Å; V54-F58 PolarHBondContact O-N 2.82Å
55	N	51.2	Low	54.5	Low	93 Å²	93	112.7 Å²	112.7	50%	0.497	56%	0.557	S	S	.	*	H	α-helix	trans	-66.3	-38.2	178.9	-73	-11.4	0	0	0	113	R51 E52 F58 A59	R51-N55 VanDerWaalsContact O-CB 3.23Å; R51-N55 WeakPolarHBondContact O-CB 3.39Å; R51-N55 PolarHBondContact O-N 3.45Å; R51-N55 PolarHBondContact O-ND2 3.31Å; R51-N55 PolarHBondContact O-OD1 3.35Å; E52-N55 PolarHBondContact O-N 2.94Å; N55-F58 PolarHBondContact O-N 2.82Å; N55-A59 VanDerWaalsContact O-CB 3.25Å; N55-A59 WeakPolarHBondContact O-CB 3.41Å; N55-A59 PolarHBondContact O-N 3.01Å
56	A	56.6	Low	52	Low	58 Å²	58	112.2 Å²	112.2	48%	0.479	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-44	174	0	0	0	0	0	111.1	E52 F58 A59 E60	E52-A56 WeakPolarHBondContact O-CB 3.47Å; E52-A56 PolarHBondContact O-N 2.72Å; A56-F58 VanDerWaalsContact C-N 3.33Å; A56-F58 PolarHBondContact O-N 2.93Å; A56-A59 PolarHBondContact O-N 3.34Å; A56-E60 PolarHBondContact O-N 2.99Å
57	W	53.9	Low	49.9	Very low	121 Å²	121	113.6 Å²	113.6	46%	0.458	58%	0.575	S	S	.	*	H	α-helix	trans	-63.3	-35.4	176	-174	91.5	0	0	0	113.2	M53 V54 R61	M53-W57 WeakPolarHBondContact O-CB 3.38Å; M53-W57 PolarHBondContact O-N 3.28Å; M53-W57 VanDerWaalsContact O-N 3.12Å; V54-W57 WeakPolarHBondContact O-CB 3.3Å; V54-W57 PolarHBondContact O-N 2.96Å; W57-R61 WeakPolarHBondContact O-CG 3.26Å
58	F	42.4	Very low	47.3	Very low	103 Å²	103	111.5 Å²	111.5	45%	0.452	58%	0.584	S	S	.	*	H	α-helix	trans	-75.3	-38	173.8	-92.4	-80.7	0	0	0	113	V54 N55 A56 E60 R61 V62	V54-F58 HydrophobicContact CG1-CD2 3.72Å; V54-F58 HydrophobicContact CG1-CE2 3.82Å; V54-F58 WeakPolarHBondContact O-CD2 3.22Å; V54-F58 PolarHBondContact O-N 2.82Å; N55-F58 PolarHBondContact O-N 2.82Å; A56-F58 VanDerWaalsContact C-N 3.33Å; A56-F58 PolarHBondContact O-N 2.93Å; F58-E60 VanDerWaalsContact C-N 3.3Å; F58-E60 PolarHBondContact O-N 3.42Å; F58-R61 PolarHBondContact O-N 2.85Å; F58-V62 HydrophobicContact CD1-CG2 4.42Å; F58-V62 PolarHBondContact O-N 3.25Å
59	A	47.1	Very low	45.2	Very low	65 Å²	65	114.8 Å²	114.8	54%	0.537	60%	0.598	S	S	.	*	H	α-helix	trans	-65.1	-31.9	-179.3	0	0	0	0	0	112.8	N55 A56 R61	N55-A59 VanDerWaalsContact O-CB 3.25Å; N55-A59 WeakPolarHBondContact O-CB 3.41Å; N55-A59 PolarHBondContact O-N 3.01Å; A56-A59 PolarHBondContact O-N 3.34Å; A59-R61 PolarHBondContact O-N 3.37Å
60	E	41.1	Very low	43	Very low	152 Å²	152	122 Å²	122	71%	0.71	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-18.4	172.1	-78.5	-179.4	170.6	0	0	113.7	A56 F58	A56-E60 PolarHBondContact O-N 2.99Å; F58-E60 VanDerWaalsContact C-N 3.3Å; F58-E60 PolarHBondContact O-N 3.42Å
61	R	44.8	Very low	40.7	Very low	166 Å²	166	122.7 Å²	122.7	63%	0.626	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	-12	-170.5	-66.9	-176.3	178.2	-150.3	-0.4	114.5	W57 F58 A59	W57-R61 WeakPolarHBondContact O-CG 3.26Å; F58-R61 PolarHBondContact O-N 2.85Å; A59-R61 PolarHBondContact O-N 3.37Å
62	V	34.6	Very low	39.3	Very low	96 Å²	96	121.5 Å²	121.5	58%	0.582	65%	0.652	S	S	*	*			trans	-112.4	99.3	178.1	-176.8	0	0	0	0	109.4	F58	F58-V62 HydrophobicContact CD1-CG2 4.42Å; F58-V62 PolarHBondContact O-N 3.25Å
63	H	33.4	Very low	37.5	Very low	167 Å²	167	127.7 Å²	127.7	77%	0.773	67%	0.67	S	S	*	*			trans	-108.5	135.4	162	-73.1	-19.5	0	0	0	110.3
64	T	28.7	Very low	35.5	Very low	133 Å²	133	124.9 Å²	124.9	82%	0.816	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-57.5	128.6	-170.6	-20.8	0	0	0	0	112.4	P66	T64-P66 WeakPolarHBondContact O-CD 3.45Å
65	I	26.2	Very low	33.8	Very low	133 Å²	133	131.7 Å²	131.7	68%	0.682	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63	120.1	174	-59.3	166.7	0	0	0	109.2	V67	I65-V67 PolarHBondContact O-N 3.04Å
66	P	26.1	Very low	32.6	Very low	112 Å²	112	133.6 Å²	133.6	73%	0.727	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-76.8	120.7	164.8	-0.2	17.8	0	0	0	108.4	T64 C68	T64-P66 WeakPolarHBondContact O-CD 3.45Å; P66-C68 PolarHBondContact O-N 2.93Å
67	V	25.6	Very low	31	Very low	129 Å²	129	140 Å²	140	78%	0.782	73%	0.734	S	S	*	*			trans	-62.4	107.5	169	177.1	0	0	0	0	108.6	I65 K69	I65-V67 PolarHBondContact O-N 3.04Å; V67-K69 PolarHBondContact O-N 3.47Å
68	C	23	Very low	29.6	Very low	119 Å²	119	139.7 Å²	139.7	80%	0.804	75%	0.751	S	S	*	*			trans	-62.1	111.5	167.6	-86.3	0	0	0	0	109.7	P66 E70	P66-C68 PolarHBondContact O-N 2.93Å; C68-E70 PolarHBondContact O-N 3.49Å
69	K	27.4	Very low	28.6	Very low	201 Å²	201	141.2 Å²	141.2	87%	0.874	77%	0.773	S	S	*	*			trans	-83.1	106.1	158.7	-79.6	-175.4	175.3	-179.7	0	107.7	V67 G71	V67-K69 PolarHBondContact O-N 3.47Å; K69-G71 PolarHBondContact O-N 2.78Å
70	E	27.5	Very low	27.4	Very low	183 Å²	183	143.4 Å²	143.4	86%	0.855	78%	0.784	S	S	*	*			trans	-58.8	132.8	169.9	-74.3	-179.3	148.1	0	0	110.7	C68 I72	C68-E70 PolarHBondContact O-N 3.49Å; E70-I72 PolarHBondContact O-N 2.93Å
71	G	23.9	Very low	26.4	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	79%	0.791	S	S	*	*			trans	-76.9	117.5	175.6	0	0	0	0	0	111.2	K69	K69-G71 PolarHBondContact O-N 2.78Å
72	I	25.8	Very low	25.4	Very low	161 Å²	161	140.4 Å²	140.4	83%	0.826	80%	0.801	S	S	*	*			trans	-92.2	110.8	166.2	-62.4	174.1	0	0	0	107.8	E70	E70-I72 PolarHBondContact O-N 2.93Å
73	R	24.6	Very low	24.8	Very low	253 Å²	253	144.1 Å²	144.1	96%	0.955	82%	0.817	S	S	*	*			trans	-80.1	125.5	156.1	-84.5	-177	172.7	-170.5	-1.1	107.7
74	G	22.6	Very low	24.4	Very low	56 Å²	56	145.4 Å²	145.4	58%	0.577	82%	0.823	S	S	*	*			trans	160	109.5	165.9	0	0	0	0	0	115.3
75	H	23.4	Very low	24.1	Very low	186 Å²	186	148.2 Å²	148.2	86%	0.861	83%	0.827	S	S	*	*			trans	69.6	115.6	147.7	-66.5	-74.2	0	0	0	121.4
76	T	25.9	Very low	23.9	Very low	132 Å²	132	147.5 Å²	147.5	81%	0.81	83%	0.834	S	S	*	*			trans	-48.9	121	154.4	41.9	0	0	0	0	112
77	E	23.3	Very low	24	Very low	192 Å²	192	148.1 Å²	148.1	90%	0.897	84%	0.838	S	S	*	*			trans	-152.7	132.4	149	-112.8	171.4	-154.7	0	0	110.5
78	S	23.9	Very low	23.8	Very low	116 Å²	116	153.2 Å²	153.2	81%	0.811	84%	0.843	S	S	*	*			trans	-68.3	128.7	-176	49.5	0	0	0	0	112.4
79	C	22.2	Very low	23.9	Very low	134 Å²	134	152.4 Å²	152.4	91%	0.905	85%	0.845	S	S	*	*			trans	-142.2	105.6	158.9	-129.2	0	0	0	0	111
80	S	21.3	Very low	23.6	Very low	111 Å²	111	149.9 Å²	149.9	78%	0.776	84%	0.841	S	S	*	*			trans	-78.8	128.5	173.3	41.1	0	0	0	0	111.5
81	C	21.1	Very low	23.5	Very low	127 Å²	127	149.4 Å²	149.4	86%	0.858	84%	0.844	S	S	*	*			trans	-149.3	146.7	153.1	-89.4	0	0	0	0	110.3
82	P	22.8	Very low	23.5	Very low	128 Å²	128	151.5 Å²	151.5	83%	0.831	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-97.3	140.6	-159.8	26.9	-12.7	0	0	0	113.8
83	L	23	Very low	23.5	Very low	174 Å²	174	148.2 Å²	148.2	91%	0.911	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-90.2	125.6	173.5	-86.5	149.1	0	0	0	111
84	Q	24.9	Very low	23.6	Very low	194 Å²	194	142.6 Å²	142.6	91%	0.907	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-70.9	135.5	166.7	-84.2	173.3	-36.1	0	0	111
85	Q	22.3	Very low	23.7	Very low	192 Å²	192	143.4 Å²	143.4	90%	0.897	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-88.7	140.6	173.3	-70.5	175.3	-15.8	0	0	111.7
86	S	21.9	Very low	23.8	Very low	118 Å²	118	140.8 Å²	140.8	83%	0.825	85%	0.845	S	S	*	*			trans	-171.1	167.6	137.7	67.8	0	0	0	0	109.3
87	P	27.7	Very low	23.8	Very low	125 Å²	125	140.3 Å²	140.3	81%	0.812	84%	0.844	S	S	*	*				-119.5	170.3	-96.1	24.3	-2.4	0	0	0	115.9
88	R	22.1	Very low	23.8	Very low	237 Å²	237	137.7 Å²	137.7	89%	0.894	84%	0.841	S	S	*	*			trans	-33.4	139.9	176.9	-64.2	173.5	175.5	173.9	-3	117.7
89	A	23.9	Very low	24	Very low	102 Å²	102	143.1 Å²	143.1	84%	0.843	84%	0.844	S	S	*	*			trans	-128.8	127.5	145.6	0	0	0	0	0	108.5
90	D	21.9	Very low	24.2	Very low	148 Å²	148	146.7 Å²	146.7	79%	0.791	84%	0.844	S	S	*	*			trans	-69	137.9	-179.8	-71.2	-46.2	0	0	0	111.9
91	N	25.1	Very low	24.6	Very low	172 Å²	172	146.5 Å²	146.5	92%	0.92	83%	0.833	S	S	*	*			trans	-155.7	116.9	148.3	-100.6	-21.1	0	0	0	110
92	S	23.2	Very low	25	Very low	124 Å²	124	143.9 Å²	143.9	87%	0.867	82%	0.817	S	S	*	*			trans	-85.5	123.1	-179.2	50.6	0	0	0	0	111.8
93	A	26.3	Very low	25.5	Very low	92 Å²	92	142 Å²	142	76%	0.76	81%	0.812	S	S	*	*			trans	-143.8	137.4	156.6	0	0	0	0	0	108.9	G95	A93-G95 PolarHBondContact O-N 2.66Å
94	P	27.8	Very low	25.9	Very low	135 Å²	135	138 Å²	138	88%	0.877	80%	0.798	S	S	*	*			trans	-81.4	107.7	-175.4	30.7	-29.7	0	0	0	110.4
95	G	24.8	Very low	26.4	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	79%	0.786	S	S	*	*			trans	-90.3	126.7	171.6	0	0	0	0	0	111.7	A93	A93-G95 PolarHBondContact O-N 2.66Å
96	T	24.9	Very low	27.2	Very low	131 Å²	131	132.6 Å²	132.6	80%	0.804	77%	0.771	S	S	*	*			trans	-62.5	134.7	173.4	-28.1	0	0	0	0	111	T98	T96-T98 PolarHBondContact O-N 2.94Å
97	P	24.8	Very low	27.4	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	77%	0.772	S	S	*	*			trans	-80.1	106.4	-179.9	29.3	-30.6	0	0	0	111.3	R99	P97-R99 PolarHBondContact O-N 2.91Å
98	T	25	Very low	27.6	Very low	137 Å²	137	139.2 Å²	139.2	84%	0.84	77%	0.774	S	S	*	*			trans	-73.3	108.4	164.6	38	0	0	0	0	110.2	T96	T96-T98 PolarHBondContact O-N 2.94Å
99	R	27.1	Very low	27.9	Very low	231 Å²	231	133.9 Å²	133.9	87%	0.872	77%	0.77	S	S	*	*			trans	-75.9	119	169.2	-160.5	178.3	-172.7	-176	0.3	108.7	P97 I101	P97-R99 PolarHBondContact O-N 2.91Å; R99-I101 PolarHBondContact O-N 2.77Å
100	K	26.2	Very low	28.4	Very low	208 Å²	208	136.1 Å²	136.1	90%	0.904	77%	0.767	S	S	*	*			trans	-75.8	115.8	169.5	-72.4	-177	177.5	-179.5	0	108.4
101	I	30.8	Very low	28.8	Very low	108 Å²	108	139.4 Å²	139.4	55%	0.554	77%	0.768	S	S	*	*			trans	-88.4	131.3	174.8	-54.1	175.3	0	0	0	107.7	R99 E105	R99-I101 PolarHBondContact O-N 2.77Å; I101-E105 VanDerWaalsContact CG2-OE2 3.24Å; I101-E105 WeakPolarHBondContact CG2-OE2 3.34Å
102	S	29	Very low	29.2	Very low	72 Å²	72	137.4 Å²	137.4	50%	0.503	76%	0.764	S	S	.	*			trans	-81.8	143.8	-179.9	173.5	0	0	0	0	110.5	S104 E105	S102-S104 PolarHBondContact O-N 3.31Å; S102-S104 PolarHBondContact OG-OG 3.11Å; S102-S104 VanDerWaalsContact OG-OG 3.08Å; S102-E105 PolarHBondContact O-N 3.4Å
103	A	32.1	Very low	30.3	Very low	88 Å²	88	136.7 Å²	136.7	73%	0.727	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-59.1	-3.7	179.2	0	0	0	0	0	115.2
104	S	32.3	Very low	30.7	Very low	90 Å²	90	136.5 Å²	136.5	63%	0.629	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-85.9	-5.9	-179.8	54.7	0	0	0	0	114.8	S102	S102-S104 PolarHBondContact O-N 3.31Å; S102-S104 PolarHBondContact OG-OG 3.11Å; S102-S104 VanDerWaalsContact OG-OG 3.08Å
105	E	35.3	Very low	31.2	Very low	140 Å²	140	133.4 Å²	133.4	65%	0.654	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-85.2	-6.7	178.5	-72.8	-176.5	174.2	0	0	113.8	I101 S102	I101-E105 VanDerWaalsContact CG2-OE2 3.24Å; I101-E105 WeakPolarHBondContact CG2-OE2 3.34Å; S102-E105 PolarHBondContact O-N 3.4Å
106	F	38.2	Very low	31.8	Very low	132 Å²	132	135.2 Å²	135.2	58%	0.579	71%	0.705	S	S	*	*			trans	-88.7	-0.9	-172	-65.1	-81.6	0	0	0	115.6	R108	F106-R108 PolarHBondContact O-N 3.46Å
107	D	26.9	Very low	32.3	Very low	159 Å²	159	131.6 Å²	131.6	85%	0.85	68%	0.681	S	S	*	*			trans	-96.4	25.7	-167.7	-107	-11.4	0	0	0	115.1
108	R	32.2	Very low	32.7	Very low	224 Å²	224	132 Å²	132	85%	0.845	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-98.8	133.7	179.6	-70.5	-173.5	-178.3	-176.5	2.7	112.2	F106	F106-R108 PolarHBondContact O-N 3.46Å
109	P	28.5	Very low	33.1	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-68.8	135.9	-179.8	26.8	-32	0	0	0	111.8
110	L	33.7	Very low	33.4	Very low	148 Å²	148	123.1 Å²	123.1	78%	0.775	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-65	130	-176.6	-62.8	162	0	0	0	111.7	I113	L110-I113 HydrophobicContact CD2-CD1 4.17Å
111	R	31.7	Very low	34	Very low	218 Å²	218	115.7 Å²	115.7	82%	0.823	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-98	159.1	162.6	-74.1	-171	-177.5	-172.3	2.2	109.4	I113	R111-I113 VanDerWaalsContact O-CG1 3.22Å; R111-I113 WeakPolarHBondContact O-CG1 3.44Å; R111-I113 PolarHBondContact O-N 2.91Å
112	P	31.9	Very low	34.3	Very low	129 Å²	129	112.9 Å²	112.9	84%	0.838	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-59.6	124.6	-175.5	-16.6	29.2	0	0	0	110.8
113	I	46.3	Very low	34.8	Very low	110 Å²	110	110.8 Å²	110.8	56%	0.564	59%	0.594	S	S	*	*			trans	-89.3	0.7	-165.2	-60.6	-179	0	0	0	112.6	L110 R111	L110-I113 HydrophobicContact CD2-CD1 4.17Å; R111-I113 VanDerWaalsContact O-CG1 3.22Å; R111-I113 WeakPolarHBondContact O-CG1 3.44Å; R111-I113 PolarHBondContact O-N 2.91Å
114	V	36.4	Very low	35.1	Very low	87 Å²	87	113.2 Å²	113.2	53%	0.527	59%	0.588	S	S	.	*			trans	-143.2	133.1	-168.6	-175.4	0	0	0	0	112	V122	V114-V122 HydrophobicContact CG1-CG1 3.15Å
115	V	37.9	Very low	35.2	Very low	70 Å²	70	114.1 Å²	114.1	42%	0.424	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.3	140.5	168.8	-174	0	0	0	0	109.6	S126	V115-S126 WeakPolarHBondContact CG2-OG 3.47Å
116	K	36.1	Very low	35.1	Very low	111 Å²	111	110.1 Å²	110.1	48%	0.483	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.1	136.3	179.5	-62.1	-172.2	177	-148.6	0	110.5	E476 N477	K116-E476 WeakPolarHBondContact CE-OE2 3.38Å; K116-E476 IonicContact NZ-OE2 3.67Å; K116-E476 PolarHBondContact NZ-OE2 3.27Å; K116-N477 PolarHBondContact NZ-OD1 2.94Å
117	D	37.2	Very low	34.9	Very low	55 Å²	55	111.3 Å²	111.3	29%	0.294	59%	0.585	S	S	.	*			trans	-75.3	175	169.3	63.8	28.4	0	0	0	112	E119 G120 T121	D117-E119 PolarHBondContact O-N 3.49Å; D117-E119 VanDerWaalsContact O-N 3.11Å; D117-E119 PolarHBondContact OD1-N 2.82Å; D117-E119 VanDerWaalsContact OD1-N 3.09Å; D117-G120 PolarHBondContact O-N 3.48Å; D117-G120 PolarHBondContact OD1-N 3.38Å; D117-T121 PolarHBondContact N-O 3.23Å; D117-T121 PolarHBondContact OD1-N 2.73Å; D117-T121 WeakPolarHBondContact OD2-CB 3.35Å
118	S	31.8	Very low	35.1	Very low	131 Å²	131	108.5 Å²	108.5	92%	0.916	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-12.2	-178.4	47.5	0	0	0	0	114.6
119	E	32.8	Very low	35.1	Very low	169 Å²	169	106.4 Å²	106.4	79%	0.79	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-0.1	175.8	-62.6	-169.1	166.8	0	0	112.3	D117 T121	D117-E119 PolarHBondContact O-N 3.49Å; D117-E119 VanDerWaalsContact O-N 3.11Å; D117-E119 PolarHBondContact OD1-N 2.82Å; D117-E119 VanDerWaalsContact OD1-N 3.09Å; E119-T121 VanDerWaalsContact C-N 3.31Å
120	G	35	Very low	35.1	Very low	12 Å²	12	110.3 Å²	110.3	12%	0.124	58%	0.582	C	S	.	*	S	Bend	trans	76.1	18.2	178.2	0	0	0	0	0	114.4	D117 N477	D117-G120 PolarHBondContact O-N 3.48Å; D117-G120 PolarHBondContact OD1-N 3.38Å; G120-N477 VanDerWaalsContact CA-ND2 3.32Å; G120-N477 WeakPolarHBondContact CA-ND2 3.22Å
121	T	37.5	Very low	35.1	Very low	51 Å²	51	109.9 Å²	109.9	31%	0.313	57%	0.574	S	S	.	*			trans	-84.1	139.6	168.9	-61.3	0	0	0	0	109	D117 E119 S123	D117-T121 PolarHBondContact N-O 3.23Å; D117-T121 PolarHBondContact OD1-N 2.73Å; D117-T121 WeakPolarHBondContact OD2-CB 3.35Å; E119-T121 VanDerWaalsContact C-N 3.31Å; T121-S123 PolarHBondContact O-N 3.19Å; T121-S123 VanDerWaalsContact O-N 3.07Å
122	V	37.9	Very low	35.1	Very low	49 Å²	49	107.7 Å²	107.7	30%	0.297	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.9	103	172.6	-162.1	0	0	0	0	107.9	V114 E476	V114-V122 HydrophobicContact CG1-CG1 3.15Å; V122-E476 HydrophobicContact CG2-CG 3.73Å; V122-E476 WeakPolarHBondContact CG2-OE1 3.43Å; V122-E476 WeakPolarHBondContact CG2-OE2 3.48Å
123	S	38.5	Very low	34.9	Very low	29 Å²	29	109.6 Å²	109.6	20%	0.203	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	157.3	-179.2	109.4	0	0	0	0	109.6	T121 L125	T121-S123 PolarHBondContact O-N 3.19Å; T121-S123 VanDerWaalsContact O-N 3.07Å; S123-L125 PolarHBondContact O-N 3.09Å; S123-L125 PolarHBondContact OG-N 3.46Å
124	F	38.8	Very low	34.3	Very low	139 Å²	139	112 Å²	112	61%	0.61	58%	0.581	S	S	*	*	S	Bend	trans	-69.2	8.9	-178.8	-72.3	-83.8	0	0	0	114.1
125	L	34.5	Very low	34.1	Very low	108 Å²	108	113.4 Å²	113.4	57%	0.565	59%	0.592	S	S	*	*			trans	-124.9	115.2	-161.4	-60.6	173.8	0	0	0	112.6	S123 L325	S123-L125 PolarHBondContact O-N 3.09Å; S123-L125 PolarHBondContact OG-N 3.46Å; L125-L325 HydrophobicContact CD2-CD2 4.13Å
126	S	32.4	Very low	33.9	Very low	57 Å²	57	113.8 Å²	113.8	40%	0.399	59%	0.592	S	S	.	*			trans	-137	127.6	133.5	75.1	0	0	0	0	109.4	V115 S128	V115-S126 WeakPolarHBondContact CG2-OG 3.47Å; S126-S128 PolarHBondContact O-N 2.76Å; S126-S128 PolarHBondContact OG-OG 2.99Å; S126-S128 VanDerWaalsContact OG-OG 3.13Å
127	D	35	Very low	33.9	Very low	156 Å²	156	114.2 Å²	114.2	83%	0.834	60%	0.604	S	S	*	*			trans	-62.8	97.4	156.5	-85.1	-29.4	0	0	0	108
128	S	31.4	Very low	34.1	Very low	100 Å²	100	115.7 Å²	115.7	70%	0.699	62%	0.616	S	S	*	*			trans	-125.8	50.9	164.1	34.5	0	0	0	0	110.2	S126	S126-S128 PolarHBondContact O-N 2.76Å; S126-S128 PolarHBondContact OG-OG 2.99Å; S126-S128 VanDerWaalsContact OG-OG 3.13Å
129	E	31.2	Very low	34.6	Very low	181 Å²	181	112.7 Å²	112.7	85%	0.846	59%	0.594	S	S	*	*	S	Bend	trans	-107.6	135.9	154.4	-67.1	-165.9	160.6	0	0	108.8	K131	E129-K131 PolarHBondContact O-N 3.24Å; E129-K131 VanDerWaalsContact O-N 3.11Å
130	K	30	Very low	34.9	Very low	207 Å²	207	116.2 Å²	116.2	90%	0.9	60%	0.6	S	S	*	*			trans	-50.6	116.2	-172.2	-71	174.1	175.2	178	0	110.6	E132	K130-E132 PolarHBondContact O-N 2.82Å; K130-E132 VanDerWaalsContact O-N 3.08Å
131	K	32.7	Very low	35.4	Very low	138 Å²	138	120.2 Å²	120.2	60%	0.6	61%	0.614	S	S	*	*			trans	-62.7	108.6	165.8	-70.6	-176.3	177.3	-177	0	108.3	E129 Q133	E129-K131 PolarHBondContact O-N 3.24Å; E129-K131 VanDerWaalsContact O-N 3.11Å; K131-Q133 PolarHBondContact O-N 3.14Å
132	E	31.1	Very low	35.6	Very low	172 Å²	172	124.5 Å²	124.5	80%	0.804	64%	0.635	S	S	*	*			trans	-66.9	120.8	166.8	-78.5	-173.1	155.5	0	0	108.7	K130 M134	K130-E132 PolarHBondContact O-N 2.82Å; K130-E132 VanDerWaalsContact O-N 3.08Å; E132-M134 PolarHBondContact O-N 2.96Å
133	Q	28.6	Very low	35.8	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	66%	0.664	S	S	*	*			trans	-70.7	108	170.1	-81.4	178.7	-22.5	0	0	108.9	K131	K131-Q133 PolarHBondContact O-N 3.14Å
134	M	34.2	Very low	35.9	Very low	160 Å²	160	136.2 Å²	136.2	79%	0.788	69%	0.687	S	S	*	*			trans	-91	123.7	169.6	-66.8	-163.5	85.2	0	0	110.2	E132	E132-M134 PolarHBondContact O-N 2.96Å
135	P	31.4	Very low	36.2	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	71%	0.705	S	S	*	*			trans	-67.9	139.9	174.5	-15.4	28.9	0	0	0	111.9	T137	P135-T137 PolarHBondContact O-N 2.91Å
136	L	34.2	Very low	37	Very low	78 Å²	78	136.5 Å²	136.5	41%	0.408	70%	0.699	S	S	.	*			trans	-72.4	108.8	172.9	-72.4	156.4	0	0	0	110	L174	L136-L174 HydrophobicContact CD2-CD2 4.48Å
137	T	36.5	Very low	38.5	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	71%	0.708	S	S	*	*			trans	-131.9	114.3	156.6	-27.6	0	0	0	0	107.7	P135	P135-T137 PolarHBondContact O-N 2.91Å
138	P	39.7	Very low	39.9	Very low	86 Å²	86	137.3 Å²	137.3	56%	0.558	70%	0.695	S	S	*	*			trans	-61.3	142.1	172.7	24.4	-30.5	0	0	0	108.9	R140	P138-R140 PolarHBondContact O-N 2.88Å
139	P	43	Very low	41.6	Very low	68 Å²	68	136 Å²	136	44%	0.442	69%	0.685	S	S	.	*			trans	-57.1	124.9	170.6	-14.4	26.4	0	0	0	108.2	F141	P139-F141 HydrophobicContact CB-CD2 4.48Å; P139-F141 HydrophobicContact CB-CE1 4.12Å; P139-F141 HydrophobicContact CB-CE2 3.86Å; P139-F141 HydrophobicContact CB-CZ 3.67Å; P139-F141 HydrophobicContact CG-CE2 4.15Å; P139-F141 HydrophobicContact CG-CZ 3.91Å; P139-F141 WeakPolarHBondContact O-CD2 3.44Å; P139-F141 WeakPolarHBondContact O-CE2 3.36Å; P139-F141 PolarHBondContact O-N 3.03Å
140	R	40.3	Very low	43.7	Very low	242 Å²	242	130.3 Å²	130.3	91%	0.913	67%	0.665	S	S	*	*			trans	-73.8	111.4	170.9	-78.6	-173.3	177.1	-179.1	-0.3	107.7	P138	P138-R140 PolarHBondContact O-N 2.88Å
141	F	45.7	Very low	45.8	Very low	96 Å²	96	124.8 Å²	124.8	42%	0.421	64%	0.638	S	S	.	*			trans	-91.4	105.6	175.8	-62.6	-75.1	0	0	0	109.2	P139	P139-F141 HydrophobicContact CB-CD2 4.48Å; P139-F141 HydrophobicContact CB-CE1 4.12Å; P139-F141 HydrophobicContact CB-CE2 3.86Å; P139-F141 HydrophobicContact CB-CZ 3.67Å; P139-F141 HydrophobicContact CG-CE2 4.15Å; P139-F141 HydrophobicContact CG-CZ 3.91Å; P139-F141 WeakPolarHBondContact O-CD2 3.44Å; P139-F141 WeakPolarHBondContact O-CE2 3.36Å; P139-F141 PolarHBondContact O-N 3.03Å
142	D	40.4	Very low	47.9	Very low	142 Å²	142	119.9 Å²	119.9	76%	0.759	62%	0.619	S	S	*	*			trans	-70.4	136.7	168.7	-80	-31.9	0	0	0	110.1	D144 R151	D142-D144 VanDerWaalsContact C-N 3.29Å; D142-D144 PolarHBondContact O-N 2.85Å; D142-R151 PolarHBondContact O-NH2 2.78Å; D142-R151 VanDerWaalsContact O-NH2 3.16Å
143	H	41.5	Very low	50.2	Low	195 Å²	195	116.1 Å²	116.1	90%	0.903	60%	0.604	S	S	*	*			trans	-73.6	79.4	176	-84.7	-74.7	0	0	0	110.1
144	D	40.6	Very low	52.8	Low	129 Å²	129	114.8 Å²	114.8	69%	0.69	60%	0.597	S	S	*	*			trans	-113.6	127.8	165.3	-144.2	4	0	0	0	109.5	D142 G146 R151	D142-D144 VanDerWaalsContact C-N 3.29Å; D142-D144 PolarHBondContact O-N 2.85Å; D144-G146 PolarHBondContact O-N 2.86Å; D144-R151 PolarHBondContact O-NH2 3.37Å
145	E	45.8	Very low	55.1	Low	210 Å²	210	107.9 Å²	107.9	98%	0.981	56%	0.563	S	S	*	*			trans	-70.9	43.4	-177.4	-69	-163.6	150.1	0	0	112.8
146	G	50.6	Low	57.6	Low	42 Å²	42	103.4 Å²	103.4	43%	0.433	53%	0.534	S	S	.	.			trans	-97.9	116.6	174.4	0	0	0	0	0	112.4	D144	D144-G146 PolarHBondContact O-N 2.86Å
147	D	64.6	Low	59.9	Low	112 Å²	112	107.2 Å²	107.2	60%	0.599	55%	0.547	S	S	*	.			trans	19.6	98.7	168.7	-157.6	4.2	0	0	0	117.8	C149 S150	D147-C149 PolarHBondContact O-N 2.94Å; D147-C149 VanDerWaalsContact OD1-CB 3.28Å; D147-C149 WeakPolarHBondContact OD1-CB 3.12Å; D147-C149 PolarHBondContact OD1-N 2.94Å; D147-S150 WeakPolarHBondContact O-CB 3.43Å; D147-S150 PolarHBondContact O-N 2.72Å; D147-S150 PolarHBondContact O-OG 2.92Å
148	Q	65.4	Low	62.1	Low	118 Å²	118	104.2 Å²	104.2	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-49.1	-28.8	172.9	-173.2	175.7	1.1	0	0	112.8	L152 D302	Q148-L152 PolarHBondContact O-N 3.26Å; Q148-D302 PolarHBondContact NE2-OD1 2.84Å
149	C	66.8	Low	64.3	Low	72 Å²	72	100.1 Å²	100.1	49%	0.486	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-40.2	176.3	-162.3	0	0	0	0	112.6	D147 L152 L153	D147-C149 PolarHBondContact O-N 2.94Å; D147-C149 VanDerWaalsContact OD1-CB 3.28Å; D147-C149 WeakPolarHBondContact OD1-CB 3.12Å; D147-C149 PolarHBondContact OD1-N 2.94Å; C149-L152 PolarHBondContact O-N 2.7Å; C149-L153 WeakPolarHBondContact O-CB 3.42Å; C149-L153 VanDerWaalsContact O-CG 3.27Å; C149-L153 WeakPolarHBondContact O-CG 3.49Å; C149-L153 PolarHBondContact O-N 3.27Å
150	S	74.9	Confident	66.2	Low	62 Å²	62	100.4 Å²	100.4	43%	0.434	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-40.2	179.4	69.9	0	0	0	0	112.4	D147 L153 E154	D147-S150 WeakPolarHBondContact O-CB 3.43Å; D147-S150 PolarHBondContact O-N 2.72Å; D147-S150 PolarHBondContact O-OG 2.92Å; S150-L153 PolarHBondContact O-N 2.88Å; S150-E154 PolarHBondContact O-N 2.81Å; S150-E154 VanDerWaalsContact O-N 3.12Å
151	R	73.8	Confident	68.1	Low	91 Å²	91	92.9 Å²	92.9	34%	0.343	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-45.6	176.7	-62.5	177.7	-179.7	-140.5	-8.2	111.4	D142 D144 L153 E154 L155	D142-R151 PolarHBondContact O-NH2 2.78Å; D142-R151 VanDerWaalsContact O-NH2 3.16Å; D144-R151 PolarHBondContact O-NH2 3.37Å; R151-L153 VanDerWaalsContact C-N 3.32Å; R151-L153 PolarHBondContact O-N 2.87Å; R151-E154 PolarHBondContact O-N 2.86Å; R151-L155 WeakPolarHBondContact O-CG 3.33Å; R151-L155 PolarHBondContact O-N 2.79Å
152	L	77.3	Confident	69.7	Low	36 Å²	36	90.9 Å²	90.9	19%	0.188	48%	0.48	C	S	.	.	H	α-helix	trans	-62.2	-41.7	177.4	-167.9	69.5	0	0	0	111.3	Q148 C149 E154 L155 V156 A305 Y306 F309	Q148-L152 PolarHBondContact O-N 3.26Å; C149-L152 PolarHBondContact O-N 2.7Å; L152-E154 VanDerWaalsContact C-N 3.31Å; L152-E154 PolarHBondContact O-N 2.83Å; L152-L155 PolarHBondContact O-N 2.84Å; L152-V156 VanDerWaalsContact O-CG2 3.26Å; L152-V156 WeakPolarHBondContact O-CG2 3.36Å; L152-V156 PolarHBondContact O-N 3.2Å; L152-A305 HydrophobicContact CD2-CB 4.38Å; L152-Y306 HydrophobicContact CD1-CD2 3.76Å; L152-Y306 HydrophobicContact CD1-CG 4.31Å; L152-F309 HydrophobicContact CD2-CD2 4.35Å; L152-F309 HydrophobicContact CD2-CE2 3.84Å; L152-F309 HydrophobicContact CG-CE2 4.44Å
153	L	79.3	Confident	71.5	Confident	93 Å²	93	88.5 Å²	88.5	49%	0.487	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-34.8	177.2	-74.9	170.6	0	0	0	113.1	C149 S150 R151 K157	C149-L153 WeakPolarHBondContact O-CB 3.42Å; C149-L153 VanDerWaalsContact O-CG 3.27Å; C149-L153 WeakPolarHBondContact O-CG 3.49Å; C149-L153 PolarHBondContact O-N 3.27Å; S150-L153 PolarHBondContact O-N 2.88Å; R151-L153 VanDerWaalsContact C-N 3.32Å; R151-L153 PolarHBondContact O-N 2.87Å; L153-K157 WeakPolarHBondContact O-CG 3.24Å; L153-K157 PolarHBondContact O-N 3.2Å
154	E	82.7	Confident	73.5	Confident	140 Å²	140	83.3 Å²	83.3	65%	0.654	45%	0.446	S	S	*	.	H	α-helix	trans	-66.3	-46.1	175.1	-168.2	175.2	-170.6	0	0	111.5	S150 R151 L152 V156 K157 D158	S150-E154 PolarHBondContact O-N 2.81Å; S150-E154 VanDerWaalsContact O-N 3.12Å; R151-E154 PolarHBondContact O-N 2.86Å; L152-E154 VanDerWaalsContact C-N 3.31Å; L152-E154 PolarHBondContact O-N 2.83Å; E154-V156 VanDerWaalsContact C-N 3.29Å; E154-V156 PolarHBondContact O-N 3.3Å; E154-K157 PolarHBondContact O-N 2.95Å; E154-D158 PolarHBondContact O-N 2.76Å; E154-D158 VanDerWaalsContact O-N 3.11Å
155	L	82.9	Confident	75.6	Confident	15 Å²	15	77.2 Å²	77.2	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-61.4	-37.6	175.9	-61.4	176.5	0	0	0	112.3	R151 L152 I159 H175 L179 Y306	R151-L155 WeakPolarHBondContact O-CG 3.33Å; R151-L155 PolarHBondContact O-N 2.79Å; L152-L155 PolarHBondContact O-N 2.84Å; L155-I159 WeakPolarHBondContact O-CG1 3.22Å; L155-I159 PolarHBondContact O-N 3.02Å; L155-H175 HydrophobicContact CD1-CB 4.45Å; L155-H175 HydrophobicContact CD2-CB 4.22Å; L155-L179 HydrophobicContact CD1-CD1 3.91Å; L155-L179 HydrophobicContact CD1-CD2 3.99Å; L155-L179 HydrophobicContact CD1-CG 4.04Å; L155-Y306 HydrophobicContact CB-CD2 4.44Å; L155-Y306 HydrophobicContact CB-CE2 3.79Å; L155-Y306 HydrophobicContact CD1-CE2 4.43Å
156	V	83.1	Confident	77.2	Confident	24 Å²	24	68.5 Å²	68.5	15%	0.145	37%	0.374	C	S	.	.	H	α-helix	trans	-67.8	-43.2	177	172.4	0	0	0	0	111.4	L152 E154 D158 I159 S160 F309	L152-V156 VanDerWaalsContact O-CG2 3.26Å; L152-V156 WeakPolarHBondContact O-CG2 3.36Å; L152-V156 PolarHBondContact O-N 3.2Å; E154-V156 VanDerWaalsContact C-N 3.29Å; E154-V156 PolarHBondContact O-N 3.3Å; V156-D158 VanDerWaalsContact C-N 3.29Å; V156-D158 PolarHBondContact O-N 2.9Å; V156-I159 VanDerWaalsContact O-CG1 3.25Å; V156-I159 WeakPolarHBondContact O-CG1 3.36Å; V156-I159 PolarHBondContact O-N 3.37Å; V156-S160 WeakPolarHBondContact O-CB 3.34Å; V156-S160 PolarHBondContact O-N 2.88Å; V156-S160 PolarHBondContact O-OG 2.88Å; V156-F309 HydrophobicContact CG1-CB 4.27Å; V156-F309 HydrophobicContact CG1-CD1 4.04Å; V156-F309 HydrophobicContact CG1-CG 4.25Å; V156-F309 HydrophobicContact CG2-CB 3.59Å; V156-F309 HydrophobicContact CG2-CD1 4Å; V156-F309 HydrophobicContact CG2-CD2 3.7Å; V156-F309 HydrophobicContact CG2-CE2 4.38Å; V156-F309 HydrophobicContact CG2-CG 3.48Å; V156-F309 VanDerWaalsContact CG2-CG 3.48Å
157	K	82.7	Confident	78.7	Confident	158 Å²	158	68.1 Å²	68.1	69%	0.687	37%	0.367	S	S	*	.	H	α-helix	trans	-59	-43.1	176.4	-79.3	176.2	-179.6	177.3	0	111.6	L153 E154 S160	L153-K157 WeakPolarHBondContact O-CG 3.24Å; L153-K157 PolarHBondContact O-N 3.2Å; E154-K157 PolarHBondContact O-N 2.95Å; K157-S160 PolarHBondContact O-N 3.23Å; K157-S160 PolarHBondContact O-OG 3.38Å
158	D	83.3	Confident	79.7	Confident	58 Å²	58	62.8 Å²	62.8	31%	0.31	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-50.9	-178.9	-164.2	6.3	0	0	0	111.3	E154 V156 S160 S161 H162 K171 H175	E154-D158 PolarHBondContact O-N 2.76Å; E154-D158 VanDerWaalsContact O-N 3.11Å; V156-D158 VanDerWaalsContact C-N 3.29Å; V156-D158 PolarHBondContact O-N 2.9Å; D158-S160 VanDerWaalsContact C-N 3.33Å; D158-S160 PolarHBondContact O-N 2.97Å; D158-S161 PolarHBondContact O-N 3.15Å; D158-S161 PolarHBondContact O-OG 3.31Å; D158-H162 PolarHBondContact O-CD2 3.44Å; D158-H162 VanDerWaalsContact O-CD2 3.31Å; D158-K171 VanDerWaalsContact OD1-CE 3.28Å; D158-K171 WeakPolarHBondContact OD1-CE 3.5Å; D158-K171 IonicContact OD1-NZ 3.93Å; D158-K171 PolarHBondContact OD1-NZ 3.3Å; D158-K171 WeakPolarHBondContact OD2-CE 3.21Å; D158-K171 IonicContact OD2-NZ 3.8Å; D158-K171 PolarHBondContact OD2-NZ 3.22Å; D158-H175 IonicContact OD2-CE1 2.76Å; D158-H175 IonicContact OD2-NE2 3.19Å; D158-H175 PolarHBondContact OD2-NE2 3.16Å
159	I	85.6	Confident	80.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-31	177.9	63.4	172.6	0	0	0	113.6	L155 V156 S161 H162 L168 K171 I172 Y306 V313	L155-I159 WeakPolarHBondContact O-CG1 3.22Å; L155-I159 PolarHBondContact O-N 3.02Å; V156-I159 VanDerWaalsContact O-CG1 3.25Å; V156-I159 WeakPolarHBondContact O-CG1 3.36Å; V156-I159 PolarHBondContact O-N 3.37Å; I159-S161 PolarHBondContact O-N 3.09Å; I159-S161 VanDerWaalsContact O-N 3.12Å; I159-H162 PolarHBondContact O-N 3.27Å; I159-L168 HydrophobicContact CB-CD1 3.78Å; I159-L168 HydrophobicContact CG2-CD1 4.31Å; I159-K171 HydrophobicContact CG2-CG 4.03Å; I159-I172 HydrophobicContact CG2-CG1 4.09Å; I159-Y306 HydrophobicContact CD1-CE2 4.34Å; I159-Y306 WeakPolarHBondContact CG2-OH 3.5Å; I159-V313 HydrophobicContact CD1-CB 4.48Å; I159-V313 HydrophobicContact CD1-CG2 4.16Å; I159-V313 HydrophobicContact CG1-CG2 4.26Å; I159-V313 WeakPolarHBondContact O-CG1 3.25Å
160	S	82.6	Confident	81.2	Confident	73 Å²	73	55.2 Å²	55.2	51%	0.51	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-16.3	-176.2	71.3	0	0	0	0	114.4	V156 K157 D158	V156-S160 WeakPolarHBondContact O-CB 3.34Å; V156-S160 PolarHBondContact O-N 2.88Å; V156-S160 PolarHBondContact O-OG 2.88Å; K157-S160 PolarHBondContact O-N 3.23Å; K157-S160 PolarHBondContact O-OG 3.38Å; D158-S160 VanDerWaalsContact C-N 3.33Å; D158-S160 PolarHBondContact O-N 2.97Å
161	S	80	Confident	81.6	Confident	84 Å²	84	54.6 Å²	54.6	59%	0.587	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.1	179.8	71.3	0	0	0	0	114.1	D158 I159	D158-S161 PolarHBondContact O-N 3.15Å; D158-S161 PolarHBondContact O-OG 3.31Å; I159-S161 PolarHBondContact O-N 3.09Å; I159-S161 VanDerWaalsContact O-N 3.12Å
162	H	79.8	Confident	82.2	Confident	55 Å²	55	50.2 Å²	50.2	26%	0.255	27%	0.269	S	S	.	.			trans	-100.8	125.1	-175.2	-66.3	-77	0	0	0	111.7	D158 I159 L168	D158-H162 PolarHBondContact O-CD2 3.44Å; D158-H162 VanDerWaalsContact O-CD2 3.31Å; I159-H162 PolarHBondContact O-N 3.27Å; H162-L168 HydrophobicContact CB-CB 4.2Å; H162-L168 HydrophobicContact CB-CD1 4.25Å
163	L	78.1	Confident	82.3	Confident	91 Å²	91	48.8 Å²	48.8	48%	0.476	26%	0.261	S	S	.	.			trans	-105.8	-15.2	176.2	-64.6	174.8	0	0	0	113.3	Y320	L163-Y320 HydrophobicContact CB-CD1 3.99Å; L163-Y320 HydrophobicContact CB-CE1 4.23Å; L163-Y320 HydrophobicContact CD1-CD1 4.36Å; L163-Y320 HydrophobicContact CD1-CE1 4.21Å
164	D	83.4	Confident	82.3	Confident	86 Å²	86	47.5 Å²	47.5	46%	0.46	25%	0.254	S	S	.	.			trans	-77.2	120.3	172.9	-179.5	-86.3	0	0	0	109.7	T166 A167 L168	D164-T166 VanDerWaalsContact C-N 3.3Å; D164-T166 PolarHBondContact O-N 3.09Å; D164-T166 WeakPolarHBondContact OD1-CA 3.44Å; D164-T166 WeakPolarHBondContact OD1-CB 3.41Å; D164-T166 PolarHBondContact OD1-N 2.87Å; D164-A167 HydrophobicContact CB-CB 4.06Å; D164-A167 WeakPolarHBondContact OD1-CB 3.28Å; D164-A167 PolarHBondContact OD1-N 3.29Å; D164-L168 WeakPolarHBondContact O-CB 3.22Å; D164-L168 PolarHBondContact O-N 2.6Å
165	V	84.4	Confident	82.4	Confident	2 Å²	2	41 Å²	41	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-37.7	-174.2	176.5	0	0	0	0	111.4	C169 L189 A317 Q318 E321	V165-C169 WeakPolarHBondContact O-CB 3.47Å; V165-C169 PolarHBondContact O-N 2.84Å; V165-C169 PolarHBondContact O-SG 3.02Å; V165-L189 HydrophobicContact CG1-CD1 3.36Å; V165-A317 HydrophobicContact CG2-CB 3.87Å; V165-Q318 HydrophobicContact CG2-CG 4.21Å; V165-E321 HydrophobicContact CG2-CB 4.42Å; V165-E321 WeakPolarHBondContact CG2-OE2 3.11Å
166	T	81	Confident	82.4	Confident	27 Å²	27	40.4 Å²	40.4	17%	0.166	22%	0.221	C	C	.	.	H	α-helix	trans	-71.7	-47.2	-176.8	-53.1	0	0	0	0	111.2	D164 L168 C169 H170	D164-T166 VanDerWaalsContact C-N 3.3Å; D164-T166 PolarHBondContact O-N 3.09Å; D164-T166 WeakPolarHBondContact OD1-CA 3.44Å; D164-T166 WeakPolarHBondContact OD1-CB 3.41Å; D164-T166 PolarHBondContact OD1-N 2.87Å; T166-L168 VanDerWaalsContact C-N 3.34Å; T166-C169 PolarHBondContact O-N 3.4Å; T166-H170 PolarHBondContact O-N 3.14Å
167	A	80.6	Confident	82.3	Confident	33 Å²	33	41.8 Å²	41.8	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-63.9	-40.2	175.5	0	0	0	0	0	111.6	D164 H170 K171	D164-A167 HydrophobicContact CB-CB 4.06Å; D164-A167 WeakPolarHBondContact OD1-CB 3.28Å; D164-A167 PolarHBondContact OD1-N 3.29Å; A167-H170 WeakPolarHBondContact O-CB 3.44Å; A167-H170 PolarHBondContact O-N 2.91Å; A167-K171 WeakPolarHBondContact O-CB 3.18Å; A167-K171 PolarHBondContact O-N 3.24Å
168	L	85.7	Confident	82	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-46.3	175.4	175.7	61.2	0	0	0	111.5	I159 H162 D164 T166 H170 K171 I172 V313 L314 A317	I159-L168 HydrophobicContact CB-CD1 3.78Å; I159-L168 HydrophobicContact CG2-CD1 4.31Å; H162-L168 HydrophobicContact CB-CB 4.2Å; H162-L168 HydrophobicContact CB-CD1 4.25Å; D164-L168 WeakPolarHBondContact O-CB 3.22Å; D164-L168 PolarHBondContact O-N 2.6Å; T166-L168 VanDerWaalsContact C-N 3.34Å; L168-H170 VanDerWaalsContact C-N 3.3Å; L168-H170 PolarHBondContact O-N 3.18Å; L168-K171 PolarHBondContact O-N 3.29Å; L168-I172 HydrophobicContact CD1-CD1 3.91Å; L168-I172 HydrophobicContact CD1-CG1 4.18Å; L168-I172 HydrophobicContact CG-CD1 3.85Å; L168-I172 VanDerWaalsContact O-CG1 3.27Å; L168-I172 WeakPolarHBondContact O-CG1 3.28Å; L168-I172 PolarHBondContact O-N 2.99Å; L168-V313 HydrophobicContact CD1-CG1 3.8Å; L168-V313 HydrophobicContact CD2-CG1 3.74Å; L168-V313 HydrophobicContact CG-CG1 4.44Å; L168-L314 HydrophobicContact CD2-CD2 3.72Å; L168-L314 HydrophobicContact CD2-CG 4.13Å; L168-L314 HydrophobicContact CG-CD2 3.97Å; L168-A317 HydrophobicContact CD2-CB 3.66Å
169	C	84.6	Confident	81.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54.5	-50	174.1	-73.6	0	0	0	0	110.2	V165 T166 K171 I172 F173 L187 L204	V165-C169 WeakPolarHBondContact O-CB 3.47Å; V165-C169 PolarHBondContact O-N 2.84Å; V165-C169 PolarHBondContact O-SG 3.02Å; T166-C169 PolarHBondContact O-N 3.4Å; C169-K171 VanDerWaalsContact C-N 3.32Å; C169-K171 PolarHBondContact O-N 3.08Å; C169-I172 WeakPolarHBondContact O-CB 3.39Å; C169-I172 PolarHBondContact O-N 2.6Å; C169-F173 WeakPolarHBondContact O-CD2 3.41Å; C169-F173 PolarHBondContact O-N 3.42Å; C169-L187 HydrophobicContact CB-CD2 3.64Å; C169-L187 WeakPolarHBondContact SG-CD2 2.92Å; C169-L204 HydrophobicContact CB-CD1 3.72Å; C169-L204 HydrophobicContact CB-CG 4.46Å
170	H	79.3	Confident	81.7	Confident	31 Å²	31	36.4 Å²	36.4	14%	0.144	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-41.9	179.4	-178.5	-109	0	0	0	112.6	T166 A167 L168 F173 L174 L204 L213	T166-H170 PolarHBondContact O-N 3.14Å; A167-H170 WeakPolarHBondContact O-CB 3.44Å; A167-H170 PolarHBondContact O-N 2.91Å; L168-H170 VanDerWaalsContact C-N 3.3Å; L168-H170 PolarHBondContact O-N 3.18Å; H170-F173 WeakPolarHBondContact O-CB 3.3Å; H170-F173 PolarHBondContact O-N 3.01Å; H170-L174 PolarHBondContact O-N 2.66Å; H170-L174 VanDerWaalsContact O-N 3.16Å; H170-L204 HydrophobicContact CB-CD1 3.75Å; H170-L213 HydrophobicContact CB-CD1 3.45Å; H170-L213 VanDerWaalsContact CB-CD1 3.45Å
171	K	82.8	Confident	81.8	Confident	49 Å²	49	36 Å²	36	21%	0.213	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-42.3	178	-167	66.4	170.7	177.3	0	112.4	D158 I159 A167 L168 C169 F173 L174 H175	D158-K171 VanDerWaalsContact OD1-CE 3.28Å; D158-K171 WeakPolarHBondContact OD1-CE 3.5Å; D158-K171 IonicContact OD1-NZ 3.93Å; D158-K171 PolarHBondContact OD1-NZ 3.3Å; D158-K171 WeakPolarHBondContact OD2-CE 3.21Å; D158-K171 IonicContact OD2-NZ 3.8Å; D158-K171 PolarHBondContact OD2-NZ 3.22Å; I159-K171 HydrophobicContact CG2-CG 4.03Å; A167-K171 WeakPolarHBondContact O-CB 3.18Å; A167-K171 PolarHBondContact O-N 3.24Å; L168-K171 PolarHBondContact O-N 3.29Å; C169-K171 VanDerWaalsContact C-N 3.32Å; C169-K171 PolarHBondContact O-N 3.08Å; K171-F173 VanDerWaalsContact C-N 3.26Å; K171-F173 PolarHBondContact O-N 2.82Å; K171-L174 PolarHBondContact O-N 3.01Å; K171-H175 VanDerWaalsContact CE-NE2 3.35Å; K171-H175 WeakPolarHBondContact CE-NE2 3.38Å; K171-H175 PolarHBondContact O-CD2 3.28Å; K171-H175 PolarHBondContact O-N 3.31Å; K171-H175 VanDerWaalsContact O-N 3.17Å
172	I	86.3	Confident	82.1	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.7	-42	174.3	-71.2	166.5	0	0	0	110.2	I159 L168 C169 H175 I176 Y306 C310 L314	I159-I172 HydrophobicContact CG2-CG1 4.09Å; L168-I172 HydrophobicContact CD1-CD1 3.91Å; L168-I172 HydrophobicContact CD1-CG1 4.18Å; L168-I172 HydrophobicContact CG-CD1 3.85Å; L168-I172 VanDerWaalsContact O-CG1 3.27Å; L168-I172 WeakPolarHBondContact O-CG1 3.28Å; L168-I172 PolarHBondContact O-N 2.99Å; C169-I172 WeakPolarHBondContact O-CB 3.39Å; C169-I172 PolarHBondContact O-N 2.6Å; I172-H175 PolarHBondContact O-N 2.88Å; I172-I176 HydrophobicContact CG2-CD1 3.64Å; I172-I176 HydrophobicContact CG2-CG1 4.29Å; I172-I176 VanDerWaalsContact O-CG1 3.24Å; I172-I176 WeakPolarHBondContact O-CG1 2.96Å; I172-I176 PolarHBondContact O-N 3.27Å; I172-Y306 HydrophobicContact CG2-CE1 4.27Å; I172-C310 HydrophobicContact CD1-CB 3.96Å; I172-C310 HydrophobicContact CG1-CB 4.37Å; I172-C310 HydrophobicContact CG2-CB 4.43Å; I172-L314 HydrophobicContact CD1-CD1 3.67Å; I172-L314 HydrophobicContact CD1-CD2 3.86Å; I172-L314 HydrophobicContact CD1-CG 3.62Å
173	F	80.4	Confident	82.3	Confident	6 Å²	6	32 Å²	32	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-47.7	174.8	-80.6	-71.8	0	0	0	113.9	C169 H170 K171 H175 I176 H177 Y185 S186 L187 L204	C169-F173 WeakPolarHBondContact O-CD2 3.41Å; C169-F173 PolarHBondContact O-N 3.42Å; H170-F173 WeakPolarHBondContact O-CB 3.3Å; H170-F173 PolarHBondContact O-N 3.01Å; K171-F173 VanDerWaalsContact C-N 3.26Å; K171-F173 PolarHBondContact O-N 2.82Å; F173-H175 PolarHBondContact O-N 3.22Å; F173-I176 PolarHBondContact O-N 3.41Å; F173-I176 VanDerWaalsContact O-N 3.14Å; F173-H177 PolarHBondContact O-N 2.69Å; F173-Y185 VanDerWaalsContact CD1-CB 3.5Å; F173-Y185 HydrophobicContact CD1-CG 4.44Å; F173-S186 VanDerWaalsContact CE1-C 3.47Å; F173-S186 VanDerWaalsContact CZ-C 3.48Å; F173-L187 HydrophobicContact CD2-CB 4.41Å; F173-L187 HydrophobicContact CE1-CB 3.81Å; F173-L187 HydrophobicContact CE2-CB 3.29Å; F173-L187 HydrophobicContact CE2-CD2 3.89Å; F173-L187 HydrophobicContact CE2-CG 4.23Å; F173-L187 HydrophobicContact CZ-CB 3.02Å; F173-L187 HydrophobicContact CZ-CD2 4.45Å; F173-L187 HydrophobicContact CZ-CG 4.32Å; F173-L204 HydrophobicContact CD2-CB 4.18Å; F173-L204 HydrophobicContact CD2-CD1 3.45Å; F173-L204 VanDerWaalsContact CD2-CD1 3.45Å; F173-L204 HydrophobicContact CD2-CG 4.44Å; F173-L204 HydrophobicContact CE2-CB 3.46Å; F173-L204 VanDerWaalsContact CE2-CB 3.46Å; F173-L204 HydrophobicContact CE2-CD1 3.46Å; F173-L204 VanDerWaalsContact CE2-CD1 3.46Å; F173-L204 HydrophobicContact CE2-CG 4.04Å; F173-L204 HydrophobicContact CZ-CB 3.94Å
174	L	79.4	Confident	82.6	Confident	65 Å²	65	30.5 Å²	30.5	34%	0.34	17%	0.173	S	C	.	.	H	α-helix	trans	-57.8	-36.4	179.4	-69.3	173.4	0	0	0	111.3	L136 H170 K171 G178	L136-L174 HydrophobicContact CD2-CD2 4.48Å; H170-L174 PolarHBondContact O-N 2.66Å; H170-L174 VanDerWaalsContact O-N 3.16Å; K171-L174 PolarHBondContact O-N 3.01Å; L174-G178 PolarHBondContact O-N 3.2Å
175	H	84.4	Confident	82.6	Confident	3 Å²	3	26.8 Å²	26.8	1%	0.014	15%	0.153	C	C	.	.	H	α-helix	trans	-73.3	-42	177	-63.4	179	0	0	0	112.2	L155 D158 K171 I172 F173 H177 G178 L179 Y306	L155-H175 HydrophobicContact CD1-CB 4.45Å; L155-H175 HydrophobicContact CD2-CB 4.22Å; D158-H175 IonicContact OD2-CE1 2.76Å; D158-H175 IonicContact OD2-NE2 3.19Å; D158-H175 PolarHBondContact OD2-NE2 3.16Å; K171-H175 VanDerWaalsContact CE-NE2 3.35Å; K171-H175 WeakPolarHBondContact CE-NE2 3.38Å; K171-H175 PolarHBondContact O-CD2 3.28Å; K171-H175 PolarHBondContact O-N 3.31Å; K171-H175 VanDerWaalsContact O-N 3.17Å; I172-H175 PolarHBondContact O-N 2.88Å; F173-H175 PolarHBondContact O-N 3.22Å; H175-H177 VanDerWaalsContact C-N 3.28Å; H175-H177 PolarHBondContact O-N 3.07Å; H175-G178 PolarHBondContact O-N 3.09Å; H175-G178 VanDerWaalsContact O-N 3.13Å; H175-L179 VanDerWaalsContact O-CG 3.29Å; H175-L179 WeakPolarHBondContact O-CG 3.45Å; H175-L179 PolarHBondContact O-N 2.86Å; H175-Y306 HydrophobicContact CB-CE1 3.65Å; H175-Y306 HydrophobicContact CB-CE2 4.38Å; H175-Y306 WeakPolarHBondContact CB-OH 3.46Å; H175-Y306 AromaticContact ND1-CZ 3.7Å; H175-Y306 PolarHBondContact ND1-OH 3.01Å
176	I	83.1	Confident	82.7	Confident	3 Å²	3	27 Å²	27	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-42.1	175	-66.1	164.4	0	0	0	110.5	I172 F173 G178 L179 I180 Y185 A282 F303 Y306 L307	I172-I176 HydrophobicContact CG2-CD1 3.64Å; I172-I176 HydrophobicContact CG2-CG1 4.29Å; I172-I176 VanDerWaalsContact O-CG1 3.24Å; I172-I176 WeakPolarHBondContact O-CG1 2.96Å; I172-I176 PolarHBondContact O-N 3.27Å; F173-I176 PolarHBondContact O-N 3.41Å; F173-I176 VanDerWaalsContact O-N 3.14Å; I176-G178 VanDerWaalsContact C-N 3.31Å; I176-G178 PolarHBondContact O-N 3.35Å; I176-L179 PolarHBondContact O-N 3.42Å; I176-L179 VanDerWaalsContact O-N 3.14Å; I176-I180 HydrophobicContact CG2-CD1 4.31Å; I176-I180 PolarHBondContact O-N 3.49Å; I176-Y185 HydrophobicContact CG2-CD1 3.51Å; I176-Y185 HydrophobicContact CG2-CE1 3.58Å; I176-Y185 HydrophobicContact CG2-CG 4.41Å; I176-A282 HydrophobicContact CD1-CB 4.46Å; I176-F303 HydrophobicContact CB-CE2 4.34Å; I176-F303 HydrophobicContact CD1-CE2 3.71Å; I176-F303 HydrophobicContact CD1-CZ 4.28Å; I176-F303 HydrophobicContact CG1-CD2 4.47Å; I176-F303 HydrophobicContact CG1-CE2 3.74Å; I176-F303 HydrophobicContact CG2-CD2 4.38Å; I176-F303 HydrophobicContact CG2-CE2 3.6Å; I176-F303 HydrophobicContact CG2-CZ 3.84Å; I176-Y306 HydrophobicContact CG1-CD1 4.02Å; I176-Y306 HydrophobicContact CG1-CE1 4.02Å; I176-L307 HydrophobicContact CD1-CD2 4.18Å
177	H	80.1	Confident	83.1	Confident	54 Å²	54	25.8 Å²	25.8	25%	0.25	15%	0.147	C	C	.	.	H	α-helix	trans	-60	-38.8	175.9	176.7	88.5	0	0	0	112.8	F173 H175 Y185 E209	F173-H177 PolarHBondContact O-N 2.69Å; H175-H177 VanDerWaalsContact C-N 3.28Å; H175-H177 PolarHBondContact O-N 3.07Å; H177-Y185 HydrophobicContact CB-CD2 4.38Å; H177-Y185 HydrophobicContact CB-CE2 3.79Å; H177-Y185 AromaticContact ND1-CE2 3.54Å; H177-E209 IonicContact CE1-OE2 3.41Å
178	G	76.7	Confident	83.5	Confident	42 Å²	42	24.4 Å²	24.4	43%	0.433	14%	0.135	S	C	.	.	H	α-helix	trans	-73	-25.4	175.5	0	0	0	0	0	114.2	L174 H175 I176	L174-G178 PolarHBondContact O-N 3.2Å; H175-G178 PolarHBondContact O-N 3.09Å; H175-G178 VanDerWaalsContact O-N 3.13Å; I176-G178 VanDerWaalsContact C-N 3.31Å; I176-G178 PolarHBondContact O-N 3.35Å
179	L	80.1	Confident	83.7	Confident	60 Å²	60	24.6 Å²	24.6	31%	0.314	14%	0.135	S	C	.	.	H	α-helix	trans	-88.6	-38.7	-177.9	-72.9	170.6	0	0	0	113	L155 H175 I176 Y306	L155-L179 HydrophobicContact CD1-CD1 3.91Å; L155-L179 HydrophobicContact CD1-CD2 3.99Å; L155-L179 HydrophobicContact CD1-CG 4.04Å; H175-L179 VanDerWaalsContact O-CG 3.29Å; H175-L179 WeakPolarHBondContact O-CG 3.45Å; H175-L179 PolarHBondContact O-N 2.86Å; I176-L179 PolarHBondContact O-N 3.42Å; I176-L179 VanDerWaalsContact O-N 3.14Å; L179-Y306 HydrophobicContact CD1-CD1 3.66Å; L179-Y306 HydrophobicContact CD1-CD2 4.08Å; L179-Y306 HydrophobicContact CD1-CE1 4.34Å; L179-Y306 HydrophobicContact CD1-CG 3.52Å
180	I	83.7	Confident	83.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-123.6	124.6	-175.7	-56.6	172	0	0	0	107.4	I176 A182 Y185 L267 F295 F303	I176-I180 HydrophobicContact CG2-CD1 4.31Å; I176-I180 PolarHBondContact O-N 3.49Å; I180-A182 HydrophobicContact CG2-CB 4.49Å; I180-A182 PolarHBondContact O-N 3.06Å; I180-A182 VanDerWaalsContact O-N 3.09Å; I180-Y185 PolarHBondContact O-OH 3.31Å; I180-L267 HydrophobicContact CD1-CD2 4.38Å; I180-F295 HydrophobicContact CG2-CD1 4.02Å; I180-F295 HydrophobicContact CG2-CE1 3.73Å; I180-F303 HydrophobicContact CD1-CB 3.42Å; I180-F303 VanDerWaalsContact CD1-CB 3.42Å; I180-F303 HydrophobicContact CD1-CD1 3.37Å; I180-F303 HydrophobicContact CD1-CD2 3.58Å; I180-F303 HydrophobicContact CD1-CE1 3.91Å; I180-F303 HydrophobicContact CD1-CE2 4.08Å; I180-F303 HydrophobicContact CD1-CG 3.19Å; I180-F303 HydrophobicContact CD1-CZ 4.23Å
181	S	83.7	Confident	84.1	Confident	64 Å²	64	25.4 Å²	25.4	45%	0.448	14%	0.144	S	C	.	.			trans	-81.8	86.9	175.1	-44.3	0	0	0	0	111.5	K287 K288	S181-K287 CarbonylContact O-C 3.55Å; S181-K287 VanDerWaalsContact O-CD 3.22Å; S181-K287 WeakPolarHBondContact O-CD 3.45Å; S181-K287 WeakPolarHBondContact O-CE 3.5Å; S181-K288 PolarHBondContact O-N 2.81Å
182	A	86	Confident	83.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	164.6	172.1	0	0	0	0	0	111.9	I180 Y185 A284 I285 N286 K288 F295	I180-A182 HydrophobicContact CG2-CB 4.49Å; I180-A182 PolarHBondContact O-N 3.06Å; I180-A182 VanDerWaalsContact O-N 3.09Å; A182-Y185 WeakPolarHBondContact CA-OH 3.39Å; A182-Y185 HydrophobicContact CB-CE1 3.69Å; A182-Y185 WeakPolarHBondContact CB-OH 3.41Å; A182-Y185 PolarHBondContact N-OH 3.46Å; A182-Y185 PolarHBondContact O-OH 3.1Å; A182-A284 HydrophobicContact CB-CB 3.97Å; A182-I285 WeakPolarHBondContact CB-O 3.46Å; A182-N286 CarbonylContact C-O 3.55Å; A182-N286 WeakPolarHBondContact CA-O 3.46Å; A182-K288 VanDerWaalsContact O-CE 3.3Å; A182-K288 WeakPolarHBondContact O-CE 3.4Å; A182-F295 HydrophobicContact CB-CE1 3.94Å; A182-F295 HydrophobicContact CB-CZ 3.93Å
183	D	83.8	Confident	83.1	Confident	56 Å²	56	30.8 Å²	30.8	30%	0.299	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-45.1	-178.2	-163.9	38.2	0	0	0	112.1	Y261 I285 N286	D183-Y261 WeakPolarHBondContact OD2-CE2 3.37Å; D183-Y261 PolarHBondContact OD2-OH 3.04Å; D183-I285 PolarHBondContact N-O 3.3Å; D183-N286 HydrophobicContact CB-CB 3.7Å; D183-N286 PolarHBondContact N-O 3.24Å
184	R	84.4	Confident	82	Confident	59 Å²	59	33.3 Å²	33.3	22%	0.223	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.6	179.5	-50.5	-169.9	-178.7	-167.1	-6.9	112.4	D206 Y261 I285	R184-D206 WeakPolarHBondContact CD-OD1 3.37Å; R184-D206 IonicContact CZ-OD1 3.82Å; R184-D206 IonicContact CZ-OD2 3.94Å; R184-D206 IonicContact NE-OD1 3.33Å; R184-D206 IonicContact NH1-OD1 3.11Å; R184-D206 PolarHBondContact NH1-OD1 3Å; R184-D206 IonicContact NH1-OD2 3.9Å; R184-D206 PolarHBondContact NH1-OD2 3.17Å; R184-Y261 VanDerWaalsContact NE-CE2 3.27Å; R184-I285 HydrophobicContact CB-CD1 3.96Å; R184-I285 HydrophobicContact CB-CG1 3.74Å; R184-I285 HydrophobicContact CG-CG1 4.48Å; R184-I285 PolarHBondContact N-O 3.18Å; R184-I285 PolarHBondContact O-N 3.2Å
185	Y	85.1	Confident	81.1	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.035	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.3	178.3	-52	-87.3	0	0	0	111.6	F173 I176 H177 I180 A182 V207 Q283 A284	F173-Y185 VanDerWaalsContact CD1-CB 3.5Å; F173-Y185 HydrophobicContact CD1-CG 4.44Å; I176-Y185 HydrophobicContact CG2-CD1 3.51Å; I176-Y185 HydrophobicContact CG2-CE1 3.58Å; I176-Y185 HydrophobicContact CG2-CG 4.41Å; H177-Y185 HydrophobicContact CB-CD2 4.38Å; H177-Y185 HydrophobicContact CB-CE2 3.79Å; H177-Y185 AromaticContact ND1-CE2 3.54Å; I180-Y185 PolarHBondContact O-OH 3.31Å; A182-Y185 WeakPolarHBondContact CA-OH 3.39Å; A182-Y185 HydrophobicContact CB-CE1 3.69Å; A182-Y185 WeakPolarHBondContact CB-OH 3.41Å; A182-Y185 PolarHBondContact N-OH 3.46Å; A182-Y185 PolarHBondContact O-OH 3.1Å; Y185-V207 PolarHBondContact N-O 3.47Å; Y185-V207 PolarHBondContact O-N 2.8Å; Y185-Q283 CarbonylContact C-O 3.59Å; Y185-Q283 VanDerWaalsContact CA-O 3.23Å; Y185-Q283 WeakPolarHBondContact CA-O 3.3Å; Y185-A284 HydrophobicContact CD1-CB 3.66Å; Y185-A284 HydrophobicContact CE1-CB 3.69Å
186	S	86.1	Confident	80.3	Confident	7 Å²	7	38.9 Å²	38.9	5%	0.049	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	152.3	170.5	-65.4	0	0	0	0	111.4	F173 D206 A282 Q283	F173-S186 VanDerWaalsContact CE1-C 3.47Å; F173-S186 VanDerWaalsContact CZ-C 3.48Å; S186-D206 PolarHBondContact OG-N 3.26Å; S186-A282 CarbonylContact O-C 3.53Å; S186-Q283 PolarHBondContact N-O 3.11Å; S186-Q283 PolarHBondContact O-N 2.98Å
187	L	88.1	Confident	79.9	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	122	-174.6	-177.7	75.1	0	0	0	108.1	C169 F173 I271 V281 A282	C169-L187 HydrophobicContact CB-CD2 3.64Å; C169-L187 WeakPolarHBondContact SG-CD2 2.92Å; F173-L187 HydrophobicContact CD2-CB 4.41Å; F173-L187 HydrophobicContact CE1-CB 3.81Å; F173-L187 HydrophobicContact CE2-CB 3.29Å; F173-L187 HydrophobicContact CE2-CD2 3.89Å; F173-L187 HydrophobicContact CE2-CG 4.23Å; F173-L187 HydrophobicContact CZ-CB 3.02Å; F173-L187 HydrophobicContact CZ-CD2 4.45Å; F173-L187 HydrophobicContact CZ-CG 4.32Å; L187-I271 HydrophobicContact CD1-CD1 3.27Å; L187-V281 WeakPolarHBondContact CA-O 3.38Å; L187-A282 HydrophobicContact CD1-CB 4.05Å
188	F	89.6	Confident	80.1	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.4	-177.2	-57.7	-92.8	0	0	0	108.1	L200 I201 F205 L223 V230 G280 V281	F188-L200 HydrophobicContact CB-CB 4.35Å; F188-L200 HydrophobicContact CB-CD2 4.15Å; F188-I201 CarbonylContact C-O 3.31Å; F188-I201 WeakPolarHBondContact CA-O 3.47Å; F188-F205 HydrophobicContact CE1-CD2 4.43Å; F188-F205 HydrophobicContact CZ-CD2 4.2Å; F188-F205 HydrophobicContact CZ-CE2 4.21Å; F188-L223 HydrophobicContact CD1-CD1 3.78Å; F188-L223 HydrophobicContact CE1-CD1 3.5Å; F188-L223 HydrophobicContact CE1-CG 4.37Å; F188-L223 HydrophobicContact CZ-CD1 4.16Å; F188-V230 HydrophobicContact CB-CG1 4.01Å; F188-V230 HydrophobicContact CD1-CG1 4.35Å; F188-V230 HydrophobicContact CD2-CB 4.42Å; F188-V230 HydrophobicContact CD2-CG1 3.43Å; F188-V230 VanDerWaalsContact CD2-CG1 3.43Å; F188-V230 HydrophobicContact CD2-CG2 4.11Å; F188-V230 HydrophobicContact CE2-CB 4.49Å; F188-V230 HydrophobicContact CE2-CG1 3.95Å; F188-V230 HydrophobicContact CE2-CG2 3.76Å; F188-V230 HydrophobicContact CG-CG1 3.67Å; F188-V230 HydrophobicContact CZ-CG2 4.24Å; F188-G280 CarbonylContact O-C 3.48Å; F188-G280 VanDerWaalsContact O-C 3.31Å; F188-G280 WeakPolarHBondContact O-CA 3.37Å; F188-V281 PolarHBondContact N-O 3.45Å; F188-V281 PolarHBondContact O-N 3.41Å
189	L	90.2	Very high	80.6	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	142.7	175.1	-60.3	-176.2	0	0	0	109.7	V165 L200 I201 R203 L314	V165-L189 HydrophobicContact CG1-CD1 3.36Å; L189-L200 WeakPolarHBondContact O-CA 3.35Å; L189-I201 PolarHBondContact N-O 2.85Å; L189-I201 PolarHBondContact O-N 3.31Å; L189-R203 HydrophobicContact CD1-CG 3.71Å; L189-R203 HydrophobicContact CG-CG 4.25Å; L189-L314 HydrophobicContact CD2-CD1 4.47Å; L189-L314 HydrophobicContact CD2-CD2 4.3Å
190	V	89.8	Confident	80.9	Confident	19 Å²	19	41.8 Å²	41.8	12%	0.115	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	129.4	170.4	180	0	0	0	0	108.4	K198 L200 W225 V278 V279	V190-K198 HydrophobicContact CG1-CD 4.42Å; V190-K198 HydrophobicContact CG1-CG 4.46Å; V190-L200 HydrophobicContact CG2-CD2 3.81Å; V190-W225 HydrophobicContact CB-CZ3 4.49Å; V190-W225 HydrophobicContact CG1-CH2 4.32Å; V190-W225 HydrophobicContact CG1-CZ3 3.83Å; V190-W225 HydrophobicContact CG2-CH2 4.25Å; V190-W225 HydrophobicContact CG2-CZ3 3.88Å; V190-V278 HydrophobicContact CG2-CG1 4.27Å; V190-V278 WeakPolarHBondContact CG2-O 3.42Å; V190-V279 PolarHBondContact N-O 3.03Å
191	C	82.8	Confident	81	Confident	30 Å²	30	43.4 Å²	43.4	20%	0.203	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.8	173.2	-63.4	0	0	0	0	109.4	K198 F199 I201	C191-K198 WeakPolarHBondContact O-CA 3.23Å; C191-F199 HydrophobicContact CB-CD1 4.39Å; C191-F199 HydrophobicContact CB-CD2 4.32Å; C191-F199 HydrophobicContact CB-CE1 3.88Å; C191-F199 HydrophobicContact CB-CE2 3.9Å; C191-F199 HydrophobicContact CB-CZ 3.63Å; C191-F199 PolarHBondContact N-O 3.22Å; C191-F199 WeakPolarHBondContact O-CD1 3.44Å; C191-F199 PolarHBondContact O-N 3.38Å; C191-I201 HydrophobicContact CB-CD1 4.06Å; C191-I201 HydrophobicContact CB-CG1 4.26Å; C191-I201 VanDerWaalsContact SG-CD1 3.56Å
192	E	78.9	Confident	80.8	Confident	114 Å²	114	40.4 Å²	40.4	53%	0.533	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.2	173.3	-71.1	178.7	-178.8	0	0	108	K198	E192-K198 HydrophobicContact CG-CG 3.82Å; E192-K198 WeakPolarHBondContact OE1-CE 2.95Å; E192-K198 IonicContact OE1-NZ 3.53Å
193	D	68.1	Low	79.9	Confident	48 Å²	48	44.1 Å²	44.1	26%	0.257	23%	0.229	S	C	.	.			trans	-87.6	178.8	173.2	68.5	16.5	0	0	0	111.4	S195 N196 D197 F199	D193-S195 PolarHBondContact O-N 2.9Å; D193-S195 VanDerWaalsContact OD1-CA 3.3Å; D193-S195 WeakPolarHBondContact OD1-CA 3.39Å; D193-S195 VanDerWaalsContact OD1-CB 3.28Å; D193-S195 WeakPolarHBondContact OD1-CB 3.48Å; D193-S195 PolarHBondContact OD1-N 3.16Å; D193-N196 PolarHBondContact O-N 3.24Å; D193-N196 PolarHBondContact OD1-N 3.14Å; D193-D197 PolarHBondContact N-O 3.2Å; D193-D197 VanDerWaalsContact N-O 3.14Å; D193-D197 PolarHBondContact OD1-N 3.21Å; D193-F199 HydrophobicContact CB-CE1 3.92Å
194	S	57.2	Low	79.1	Confident	58 Å²	58	41.4 Å²	41.4	41%	0.406	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.4	177.5	55.1	0	0	0	0	113.6	R486	S194-R486 WeakPolarHBondContact O-CD 3.22Å; S194-R486 PolarHBondContact O-NH1 3.22Å
195	S	60.8	Low	78.1	Confident	73 Å²	73	41 Å²	41	51%	0.51	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	1.2	176.7	-56.6	0	0	0	0	112.9	D193	D193-S195 PolarHBondContact O-N 2.9Å; D193-S195 VanDerWaalsContact OD1-CA 3.3Å; D193-S195 WeakPolarHBondContact OD1-CA 3.39Å; D193-S195 VanDerWaalsContact OD1-CB 3.28Å; D193-S195 WeakPolarHBondContact OD1-CB 3.48Å; D193-S195 PolarHBondContact OD1-N 3.16Å
196	N	67.4	Low	76.8	Confident	113 Å²	113	43.2 Å²	43.2	60%	0.604	23%	0.227	S	C	*	.			trans	65.9	19.7	-169.7	-57.1	-19.4	0	0	0	114	D193	D193-N196 PolarHBondContact O-N 3.24Å; D193-N196 PolarHBondContact OD1-N 3.14Å
197	D	76.2	Confident	75.7	Confident	106 Å²	106	43.8 Å²	43.8	57%	0.567	23%	0.23	S	C	*	.			trans	-81.9	127.9	173.4	-75	-32.3	0	0	0	109.7	D193	D193-D197 PolarHBondContact N-O 3.2Å; D193-D197 VanDerWaalsContact N-O 3.14Å; D193-D197 PolarHBondContact OD1-N 3.21Å
198	K	83.9	Confident	74.6	Confident	94 Å²	94	45.7 Å²	45.7	41%	0.409	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	140.4	179.5	-71.4	-179.1	176.4	-174.5	0	110.9	V190 C191 E192 W225	V190-K198 HydrophobicContact CG1-CD 4.42Å; V190-K198 HydrophobicContact CG1-CG 4.46Å; C191-K198 WeakPolarHBondContact O-CA 3.23Å; E192-K198 HydrophobicContact CG-CG 3.82Å; E192-K198 WeakPolarHBondContact OE1-CE 2.95Å; E192-K198 IonicContact OE1-NZ 3.53Å; K198-W225 HydrophobicContact CB-CD2 3.87Å; K198-W225 HydrophobicContact CB-CE3 3.61Å; K198-W225 HydrophobicContact CB-CG 4.42Å; K198-W225 HydrophobicContact CB-CH2 4.5Å; K198-W225 HydrophobicContact CB-CZ3 3.94Å; K198-W225 HydrophobicContact CD-CH2 4.08Å; K198-W225 HydrophobicContact CD-CZ2 4.21Å; K198-W225 HydrophobicContact CD-CZ3 4.29Å; K198-W225 WeakPolarHBondContact O-CB 3.42Å
199	F	86.7	Confident	73.2	Confident	20 Å²	20	51.8 Å²	51.8	9%	0.088	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	169.7	171.9	64.5	-81.7	0	0	0	110.3	C191 D193 I201 R222	C191-F199 HydrophobicContact CB-CD1 4.39Å; C191-F199 HydrophobicContact CB-CD2 4.32Å; C191-F199 HydrophobicContact CB-CE1 3.88Å; C191-F199 HydrophobicContact CB-CE2 3.9Å; C191-F199 HydrophobicContact CB-CZ 3.63Å; C191-F199 PolarHBondContact N-O 3.22Å; C191-F199 WeakPolarHBondContact O-CD1 3.44Å; C191-F199 PolarHBondContact O-N 3.38Å; D193-F199 HydrophobicContact CB-CE1 3.92Å; F199-I201 HydrophobicContact CD2-CD1 4.34Å; F199-I201 HydrophobicContact CD2-CG1 3.77Å; F199-I201 HydrophobicContact CE2-CD1 3.44Å; F199-I201 VanDerWaalsContact CE2-CD1 3.44Å; F199-I201 HydrophobicContact CE2-CG1 3.37Å; F199-I201 HydrophobicContact CZ-CD1 4.07Å; F199-I201 HydrophobicContact CZ-CG1 4.39Å; F199-R222 HydrophobicContact CD2-CG 3.84Å; F199-R222 HydrophobicContact CE2-CG 4.34Å
200	L	86.5	Confident	71.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135	-178.1	-70.7	164.8	0	0	0	110.2	F188 L189 V190 R222 L223 V230 A234 V281	F188-L200 HydrophobicContact CB-CB 4.35Å; F188-L200 HydrophobicContact CB-CD2 4.15Å; L189-L200 WeakPolarHBondContact O-CA 3.35Å; V190-L200 HydrophobicContact CG2-CD2 3.81Å; L200-R222 CarbonylContact O-C 3.42Å; L200-R222 WeakPolarHBondContact O-CA 3.31Å; L200-L223 HydrophobicContact CB-CB 4.09Å; L200-L223 PolarHBondContact N-O 3.29Å; L200-L223 PolarHBondContact O-N 2.97Å; L200-V230 HydrophobicContact CD1-CG1 3.88Å; L200-A234 HydrophobicContact CD1-CB 3.87Å; L200-A234 HydrophobicContact CD2-CB 4.1Å; L200-A234 HydrophobicContact CG-CB 4.37Å; L200-V281 HydrophobicContact CD2-CG2 4.49Å
201	I	85.3	Confident	70.5	Confident	34 Å²	34	54.8 Å²	54.8	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.4	173.3	-57.8	-175.7	0	0	0	109	F188 L189 C191 F199 R203 C220	F188-I201 CarbonylContact C-O 3.31Å; F188-I201 WeakPolarHBondContact CA-O 3.47Å; L189-I201 PolarHBondContact N-O 2.85Å; L189-I201 PolarHBondContact O-N 3.31Å; C191-I201 HydrophobicContact CB-CD1 4.06Å; C191-I201 HydrophobicContact CB-CG1 4.26Å; C191-I201 VanDerWaalsContact SG-CD1 3.56Å; F199-I201 HydrophobicContact CD2-CD1 4.34Å; F199-I201 HydrophobicContact CD2-CG1 3.77Å; F199-I201 HydrophobicContact CE2-CD1 3.44Å; F199-I201 VanDerWaalsContact CE2-CD1 3.44Å; F199-I201 HydrophobicContact CE2-CG1 3.37Å; F199-I201 HydrophobicContact CZ-CD1 4.07Å; F199-I201 HydrophobicContact CZ-CG1 4.39Å; I201-R203 PolarHBondContact O-N 2.93Å; I201-C220 WeakPolarHBondContact CG2-SG 3.28Å
202	S	79.4	Confident	69.6	Low	0 Å²	0	56 Å²	56	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	105.6	166.1	-171.9	0	0	0	0	109.3	L204 F205 C220 I221	S202-L204 VanDerWaalsContact C-N 3.35Å; S202-L204 PolarHBondContact OG-O 3.28Å; S202-F205 WeakPolarHBondContact OG-CB 3.25Å; S202-C220 WeakPolarHBondContact O-CA 3.25Å; S202-C220 PolarHBondContact O-SG 2.94Å; S202-I221 PolarHBondContact N-O 3.06Å
203	R	68.5	Low	68.8	Low	78 Å²	78	53.4 Å²	53.4	29%	0.294	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-27	171.2	-73	-68.2	-167.4	139	7	111.6	L189 I201 E321	L189-R203 HydrophobicContact CD1-CG 3.71Å; L189-R203 HydrophobicContact CG-CG 4.25Å; I201-R203 PolarHBondContact O-N 2.93Å; R203-E321 IonicContact NH2-OE1 3.23Å; R203-E321 IonicContact NH2-OE2 2.73Å
204	L	66.8	Low	68.5	Low	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	120.3	175.1	-61.9	168.2	0	0	0	108.5	C169 H170 F173 S202 V207 A216	C169-L204 HydrophobicContact CB-CD1 3.72Å; C169-L204 HydrophobicContact CB-CG 4.46Å; H170-L204 HydrophobicContact CB-CD1 3.75Å; F173-L204 HydrophobicContact CD2-CB 4.18Å; F173-L204 HydrophobicContact CD2-CD1 3.45Å; F173-L204 VanDerWaalsContact CD2-CD1 3.45Å; F173-L204 HydrophobicContact CD2-CG 4.44Å; F173-L204 HydrophobicContact CE2-CB 3.46Å; F173-L204 VanDerWaalsContact CE2-CB 3.46Å; F173-L204 HydrophobicContact CE2-CD1 3.46Å; F173-L204 VanDerWaalsContact CE2-CD1 3.46Å; F173-L204 HydrophobicContact CE2-CG 4.04Å; F173-L204 HydrophobicContact CZ-CB 3.94Å; S202-L204 VanDerWaalsContact C-N 3.35Å; S202-L204 PolarHBondContact OG-O 3.28Å; L204-V207 HydrophobicContact CB-CG2 4.14Å; L204-A216 WeakPolarHBondContact CA-O 3.35Å; L204-A216 HydrophobicContact CD2-CB 3.64Å
205	F	63.6	Low	68.7	Low	50 Å²	50	58.5 Å²	58.5	22%	0.219	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.4	-176	-169.8	-110.7	0	0	0	110.9	F188 S202 V207 N219 I221	F188-F205 HydrophobicContact CE1-CD2 4.43Å; F188-F205 HydrophobicContact CZ-CD2 4.2Å; F188-F205 HydrophobicContact CZ-CE2 4.21Å; S202-F205 WeakPolarHBondContact OG-CB 3.25Å; F205-V207 PolarHBondContact O-N 3.13Å; F205-N219 HydrophobicContact CB-CB 4.39Å; F205-N219 VanDerWaalsContact CB-O 3.3Å; F205-N219 WeakPolarHBondContact CB-O 3.24Å; F205-I221 HydrophobicContact CD1-CD1 3.69Å; F205-I221 HydrophobicContact CD2-CD1 3.79Å; F205-I221 HydrophobicContact CE1-CD1 3.58Å; F205-I221 HydrophobicContact CE2-CD1 3.68Å; F205-I221 HydrophobicContact CG-CD1 3.8Å; F205-I221 HydrophobicContact CG-CG1 4.48Å; F205-I221 HydrophobicContact CZ-CD1 3.57Å
206	D	57.7	Low	68.6	Low	56 Å²	56	55.3 Å²	55.3	30%	0.299	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.8	44	165.7	-155.9	26.1	0	0	0	115	R184 S186 A208	R184-D206 WeakPolarHBondContact CD-OD1 3.37Å; R184-D206 IonicContact CZ-OD1 3.82Å; R184-D206 IonicContact CZ-OD2 3.94Å; R184-D206 IonicContact NE-OD1 3.33Å; R184-D206 IonicContact NH1-OD1 3.11Å; R184-D206 PolarHBondContact NH1-OD1 3Å; R184-D206 IonicContact NH1-OD2 3.9Å; R184-D206 PolarHBondContact NH1-OD2 3.17Å; S186-D206 PolarHBondContact OG-N 3.26Å; D206-A208 PolarHBondContact O-N 3.39Å
207	V	63.3	Low	68.2	Low	18 Å²	18	51.9 Å²	51.9	11%	0.109	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	117.5	-173.7	-172.5	0	0	0	0	109.9	Y185 L204 F205 S211 A216	Y185-V207 PolarHBondContact N-O 3.47Å; Y185-V207 PolarHBondContact O-N 2.8Å; L204-V207 HydrophobicContact CB-CG2 4.14Å; F205-V207 PolarHBondContact O-N 3.13Å; V207-S211 WeakPolarHBondContact CG1-OG 3.3Å; V207-A216 HydrophobicContact CG2-CB 3.95Å
208	A	64.1	Low	67.2	Low	42 Å²	42	53 Å²	53	35%	0.347	29%	0.287	S	S	.	.			trans	-106	163.6	176.2	0	0	0	0	0	111.6	D206 G210 S211	D206-A208 PolarHBondContact O-N 3.39Å; A208-G210 PolarHBondContact O-N 3.03Å; A208-G210 VanDerWaalsContact O-N 3.09Å; A208-S211 PolarHBondContact O-N 3.45Å; A208-S211 PolarHBondContact O-OG 3.4Å; A208-S211 VanDerWaalsContact O-OG 3.07Å
209	E	61	Low	65.9	Low	131 Å²	131	53.2 Å²	53.2	61%	0.612	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	113.6	178.9	-166.7	176	166.7	0	0	111.1	H177 K288	H177-E209 IonicContact CE1-OE2 3.41Å; E209-K288 IonicContact OE2-NZ 2.73Å; E209-K288 PolarHBondContact OE2-NZ 3.27Å
210	G	58.4	Low	64.8	Low	60 Å²	60	56.2 Å²	56.2	62%	0.619	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.2	-0.5	-179.8	0	0	0	0	0	116.8	A208	A208-G210 PolarHBondContact O-N 3.03Å; A208-G210 VanDerWaalsContact O-N 3.09Å
211	S	64.3	Low	64.2	Low	25 Å²	25	59.1 Å²	59.1	18%	0.175	33%	0.33	C	S	.	.			trans	-71.5	143.2	177.5	59.9	0	0	0	0	113.3	V207 A208	V207-S211 WeakPolarHBondContact CG1-OG 3.3Å; A208-S211 PolarHBondContact O-N 3.45Å; A208-S211 PolarHBondContact O-OG 3.4Å; A208-S211 VanDerWaalsContact O-OG 3.07Å
212	T	63.8	Low	64	Low	55 Å²	55	64.9 Å²	64.9	34%	0.337	35%	0.35	S	S	.	.			trans	-82.1	156.3	176.2	62.7	0	0	0	0	112.8	E214 E215 A216	T212-E214 PolarHBondContact O-N 3.4Å; T212-E215 PolarHBondContact N-OE2 3.12Å; T212-E215 PolarHBondContact O-N 3.44Å; T212-E215 VanDerWaalsContact OG1-CG 3.23Å; T212-E215 WeakPolarHBondContact OG1-CG 3.29Å; T212-E215 PolarHBondContact OG1-N 3.26Å; T212-E215 PolarHBondContact OG1-OE2 2.89Å; T212-A216 PolarHBondContact O-N 2.67Å
213	L	62.7	Low	64.2	Low	61 Å²	61	67.4 Å²	67.4	32%	0.319	36%	0.363	S	S	.	.	H	α-helix	trans	-55.5	-35.3	175	-175	78.4	0	0	0	112	H170 S217	H170-L213 HydrophobicContact CB-CD1 3.45Å; H170-L213 VanDerWaalsContact CB-CD1 3.45Å; L213-S217 VanDerWaalsContact O-CB 3.29Å; L213-S217 WeakPolarHBondContact O-CB 3.47Å; L213-S217 PolarHBondContact O-N 2.74Å; L213-S217 VanDerWaalsContact O-N 3.14Å
214	E	60.9	Low	64.9	Low	93 Å²	93	69.5 Å²	69.5	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-71.6	-38.8	-179.4	-66.6	175.8	170.9	0	0	112	T212 N218	T212-E214 PolarHBondContact O-N 3.4Å; E214-N218 VanDerWaalsContact O-CG 3.28Å; E214-N218 PolarHBondContact O-ND2 2.77Å; E214-N218 VanDerWaalsContact O-ND2 3.12Å
215	E	60.8	Low	65.9	Low	119 Å²	119	73.5 Å²	73.5	56%	0.556	39%	0.391	S	S	*	.	H	α-helix	trans	-69.4	-39.1	175.1	-71.8	162.7	156.2	0	0	112.1	T212	T212-E215 PolarHBondContact N-OE2 3.12Å; T212-E215 PolarHBondContact O-N 3.44Å; T212-E215 VanDerWaalsContact OG1-CG 3.23Å; T212-E215 WeakPolarHBondContact OG1-CG 3.29Å; T212-E215 PolarHBondContact OG1-N 3.26Å; T212-E215 PolarHBondContact OG1-OE2 2.89Å
216	A	58.8	Low	67	Low	6 Å²	6	75.9 Å²	75.9	5%	0.05	41%	0.406	C	S	.	.	H	α-helix	trans	-74.5	-26.5	-178.1	0	0	0	0	0	113.7	L204 V207 T212	L204-A216 WeakPolarHBondContact CA-O 3.35Å; L204-A216 HydrophobicContact CD2-CB 3.64Å; V207-A216 HydrophobicContact CG2-CB 3.95Å; T212-A216 PolarHBondContact O-N 2.67Å
217	S	59.6	Low	68.3	Low	42 Å²	42	79.5 Å²	79.5	29%	0.294	42%	0.419	S	S	.	.	H	α-helix	trans	-87.2	-17.7	-178	-176	0	0	0	0	114.5	L213 N219	L213-S217 VanDerWaalsContact O-CB 3.29Å; L213-S217 WeakPolarHBondContact O-CB 3.47Å; L213-S217 PolarHBondContact O-N 2.74Å; L213-S217 VanDerWaalsContact O-N 3.14Å; S217-N219 VanDerWaalsContact C-N 3.33Å; S217-N219 PolarHBondContact O-N 3.16Å
218	N	54.3	Low	69.4	Low	129 Å²	129	80.3 Å²	80.3	69%	0.69	43%	0.431	S	S	*	.	S	Bend	trans	-79	-11.9	-176	-77.2	-21.4	0	0	0	114.3	E214	E214-N218 VanDerWaalsContact O-CG 3.28Å; E214-N218 PolarHBondContact O-ND2 2.77Å; E214-N218 VanDerWaalsContact O-ND2 3.12Å
219	N	57.9	Low	70.7	Confident	99 Å²	99	78.8 Å²	78.8	53%	0.529	42%	0.417	S	S	.	.			trans	-109.6	62.9	-177.5	-69	-28	0	0	0	111.6	F205 S217	F205-N219 HydrophobicContact CB-CB 4.39Å; F205-N219 VanDerWaalsContact CB-O 3.3Å; F205-N219 WeakPolarHBondContact CB-O 3.24Å; S217-N219 VanDerWaalsContact C-N 3.33Å; S217-N219 PolarHBondContact O-N 3.16Å
220	C	62.8	Low	72.1	Confident	83 Å²	83	73 Å²	73	56%	0.561	39%	0.391	S	S	*	.			trans	-76	126.8	177.4	-174.6	0	0	0	0	110.9	I201 S202	I201-C220 WeakPolarHBondContact CG2-SG 3.28Å; S202-C220 WeakPolarHBondContact O-CA 3.25Å; S202-C220 PolarHBondContact O-SG 2.94Å
221	I	74.3	Confident	73.6	Confident	60 Å²	60	70.2 Å²	70.2	31%	0.308	36%	0.362	S	S	.	.			trans	-121	128.9	-179.7	-57.9	179.4	0	0	0	109.2	S202 F205 L223	S202-I221 PolarHBondContact N-O 3.06Å; F205-I221 HydrophobicContact CD1-CD1 3.69Å; F205-I221 HydrophobicContact CD2-CD1 3.79Å; F205-I221 HydrophobicContact CE1-CD1 3.58Å; F205-I221 HydrophobicContact CE2-CD1 3.68Å; F205-I221 HydrophobicContact CG-CD1 3.8Å; F205-I221 HydrophobicContact CG-CG1 4.48Å; F205-I221 HydrophobicContact CZ-CD1 3.57Å; I221-L223 HydrophobicContact CG2-CD2 3.83Å; I221-L223 HydrophobicContact CG2-CG 4.22Å
222	R	81	Confident	74.9	Confident	156 Å²	156	71.2 Å²	71.2	59%	0.589	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	124.1	170.9	179.5	169.7	179	148.5	1.2	109.8	F199 L200	F199-R222 HydrophobicContact CD2-CG 3.84Å; F199-R222 HydrophobicContact CE2-CG 4.34Å; L200-R222 CarbonylContact O-C 3.42Å; L200-R222 WeakPolarHBondContact O-CA 3.31Å
223	L	83.2	Confident	76.3	Confident	53 Å²	53	68.6 Å²	68.6	28%	0.277	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.7	175.6	-58.5	176	0	0	0	110.7	F188 L200 I221 V230	F188-L223 HydrophobicContact CD1-CD1 3.78Å; F188-L223 HydrophobicContact CE1-CD1 3.5Å; F188-L223 HydrophobicContact CE1-CG 4.37Å; F188-L223 HydrophobicContact CZ-CD1 4.16Å; L200-L223 HydrophobicContact CB-CB 4.09Å; L200-L223 PolarHBondContact N-O 3.29Å; L200-L223 PolarHBondContact O-N 2.97Å; I221-L223 HydrophobicContact CG2-CD2 3.83Å; I221-L223 HydrophobicContact CG2-CG 4.22Å; L223-V230 HydrophobicContact CD1-CB 4.32Å; L223-V230 HydrophobicContact CD1-CG1 4.46Å
224	E	83.9	Confident	77.8	Confident	121 Å²	121	65.8 Å²	65.8	57%	0.565	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	146.1	174.2	-67.8	174	172.3	0	0	110.9	K227	E224-K227 HydrophobicContact CB-CB 4.18Å; E224-K227 HydrophobicContact CB-CD 4.16Å; E224-K227 WeakPolarHBondContact OE2-CD 3.48Å; E224-K227 IonicContact OE2-NZ 3.55Å; E224-K227 PolarHBondContact OE2-NZ 3.28Å
225	W	86.9	Confident	79.2	Confident	84 Å²	84	63.1 Å²	63.1	32%	0.318	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	142.6	175	-166	-100.7	0	0	0	111.4	V190 K198 K227 A234	V190-W225 HydrophobicContact CB-CZ3 4.49Å; V190-W225 HydrophobicContact CG1-CH2 4.32Å; V190-W225 HydrophobicContact CG1-CZ3 3.83Å; V190-W225 HydrophobicContact CG2-CH2 4.25Å; V190-W225 HydrophobicContact CG2-CZ3 3.88Å; K198-W225 HydrophobicContact CB-CD2 3.87Å; K198-W225 HydrophobicContact CB-CE3 3.61Å; K198-W225 HydrophobicContact CB-CG 4.42Å; K198-W225 HydrophobicContact CB-CH2 4.5Å; K198-W225 HydrophobicContact CB-CZ3 3.94Å; K198-W225 HydrophobicContact CD-CH2 4.08Å; K198-W225 HydrophobicContact CD-CZ2 4.21Å; K198-W225 HydrophobicContact CD-CZ3 4.29Å; K198-W225 WeakPolarHBondContact O-CB 3.42Å; W225-K227 PolarHBondContact O-N 2.99Å; W225-A234 HydrophobicContact CE3-CB 4.35Å; W225-A234 HydrophobicContact CH2-CB 3.91Å; W225-A234 WeakPolarHBondContact CH2-O 3.42Å; W225-A234 HydrophobicContact CZ2-CB 4.43Å; W225-A234 WeakPolarHBondContact CZ2-O 3.24Å; W225-A234 HydrophobicContact CZ3-CB 3.87Å
226	N	86.7	Confident	80.7	Confident	101 Å²	101	62.5 Å²	62.5	54%	0.54	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	23	177.7	-161.1	28.7	0	0	0	115.5	G231 A235	N226-G231 WeakPolarHBondContact CA-O 3.45Å; N226-G231 PolarHBondContact N-O 3.11Å; N226-A235 HydrophobicContact CB-CB 3.85Å
227	K	85.3	Confident	82.2	Confident	131 Å²	131	62.4 Å²	62.4	57%	0.57	33%	0.327	S	S	*	.			trans	-120	136.3	176.7	-167.1	176.5	-176.1	-179.1	0	111.8	E224 W225 G231	E224-K227 HydrophobicContact CB-CB 4.18Å; E224-K227 HydrophobicContact CB-CD 4.16Å; E224-K227 WeakPolarHBondContact OE2-CD 3.48Å; E224-K227 IonicContact OE2-NZ 3.55Å; E224-K227 PolarHBondContact OE2-NZ 3.28Å; W225-K227 PolarHBondContact O-N 2.99Å; K227-G231 VanDerWaalsContact O-CA 3.32Å; K227-G231 WeakPolarHBondContact O-CA 3.43Å; K227-G231 PolarHBondContact O-N 3.22Å
228	G	87.7	Confident	83.8	Confident	35 Å²	35	65.8 Å²	65.8	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	66.9	-177.2	-175.2	0	0	0	0	0	113.3	H232 R250	G228-H232 VanDerWaalsContact O-CB 3.28Å; G228-H232 WeakPolarHBondContact O-CB 3.33Å; G228-H232 PolarHBondContact O-N 3.32Å; G228-R250 WeakPolarHBondContact CA-O 2.98Å
229	I	90.9	Very high	85.7	Confident	10 Å²	10	62.5 Å²	62.5	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-59.8	-49.7	-177.6	-62.2	169.9	0	0	0	111.4	H232 V233 L240 I242 R250 F251 I266 C268	I229-H232 PolarHBondContact O-N 3.45Å; I229-V233 WeakPolarHBondContact O-CG2 3Å; I229-V233 PolarHBondContact O-N 2.9Å; I229-L240 HydrophobicContact CG2-CD1 4.12Å; I229-I242 HydrophobicContact CD1-CD1 3.7Å; I229-I242 HydrophobicContact CG1-CD1 4.11Å; I229-I242 HydrophobicContact CG2-CD1 4.11Å; I229-R250 HydrophobicContact CG1-CB 4.08Å; I229-F251 HydrophobicContact CD1-CB 4.03Å; I229-F251 HydrophobicContact CD1-CD2 3.86Å; I229-F251 HydrophobicContact CD1-CG 4.43Å; I229-I266 HydrophobicContact CD1-CD1 3.47Å; I229-I266 VanDerWaalsContact CD1-CD1 3.47Å; I229-I266 HydrophobicContact CG2-CG2 4.49Å; I229-C268 HydrophobicContact CG2-CB 4.02Å
230	V	90.3	Very high	87.4	Confident	11 Å²	11	59.2 Å²	59.2	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-44.9	-177.6	-175.9	0	0	0	0	111.3	F188 L200 L223 H232 V233 A234 V281	F188-V230 HydrophobicContact CB-CG1 4.01Å; F188-V230 HydrophobicContact CD1-CG1 4.35Å; F188-V230 HydrophobicContact CD2-CB 4.42Å; F188-V230 HydrophobicContact CD2-CG1 3.43Å; F188-V230 VanDerWaalsContact CD2-CG1 3.43Å; F188-V230 HydrophobicContact CD2-CG2 4.11Å; F188-V230 HydrophobicContact CE2-CB 4.49Å; F188-V230 HydrophobicContact CE2-CG1 3.95Å; F188-V230 HydrophobicContact CE2-CG2 3.76Å; F188-V230 HydrophobicContact CG-CG1 3.67Å; F188-V230 HydrophobicContact CZ-CG2 4.24Å; L200-V230 HydrophobicContact CD1-CG1 3.88Å; L223-V230 HydrophobicContact CD1-CB 4.32Å; L223-V230 HydrophobicContact CD1-CG1 4.46Å; V230-H232 VanDerWaalsContact C-N 3.31Å; V230-H232 PolarHBondContact O-N 2.85Å; V230-V233 PolarHBondContact O-N 3.33Å; V230-A234 WeakPolarHBondContact O-CB 3.3Å; V230-A234 PolarHBondContact O-N 2.8Å; V230-V281 HydrophobicContact CG1-CB 3.81Å; V230-V281 HydrophobicContact CG1-CG1 3.74Å; V230-V281 HydrophobicContact CG1-CG2 4.27Å
231	G	89.9	Confident	88.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-34.3	178	0	0	0	0	0	112.9	N226 K227 A234 A235	N226-G231 WeakPolarHBondContact CA-O 3.45Å; N226-G231 PolarHBondContact N-O 3.11Å; K227-G231 VanDerWaalsContact O-CA 3.32Å; K227-G231 WeakPolarHBondContact O-CA 3.43Å; K227-G231 PolarHBondContact O-N 3.22Å; G231-A234 PolarHBondContact O-N 3.44Å; G231-A235 WeakPolarHBondContact O-CB 3.49Å; G231-A235 PolarHBondContact O-N 3.16Å
232	H	91.3	Very high	89.8	Confident	47 Å²	47	55.1 Å²	55.1	22%	0.218	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-44.7	175	-175.8	86.9	0	0	0	112.3	G228 I229 V230 A234 A235 L236 R250	G228-H232 VanDerWaalsContact O-CB 3.28Å; G228-H232 WeakPolarHBondContact O-CB 3.33Å; G228-H232 PolarHBondContact O-N 3.32Å; I229-H232 PolarHBondContact O-N 3.45Å; V230-H232 VanDerWaalsContact C-N 3.31Å; V230-H232 PolarHBondContact O-N 2.85Å; H232-A234 VanDerWaalsContact C-N 3.33Å; H232-A235 PolarHBondContact O-N 2.79Å; H232-L236 WeakPolarHBondContact CE1-CD1 3.42Å; H232-L236 WeakPolarHBondContact NE2-CD1 3.36Å; H232-L236 PolarHBondContact O-N 3.16Å; H232-R250 PolarHBondContact CD2-NH1 2.89Å; H232-R250 PolarHBondContact NE2-NH1 2.87Å
233	V	94	Very high	90.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-39.9	174.7	172	0	0	0	0	111	I229 V230 A235 G237 L240 C268 P270 V281	I229-V233 WeakPolarHBondContact O-CG2 3Å; I229-V233 PolarHBondContact O-N 2.9Å; V230-V233 PolarHBondContact O-N 3.33Å; V233-A235 VanDerWaalsContact C-N 3.34Å; V233-A235 PolarHBondContact O-N 3.43Å; V233-G237 WeakPolarHBondContact O-CA 3.48Å; V233-G237 PolarHBondContact O-N 3.41Å; V233-L240 HydrophobicContact CG2-CB 4.16Å; V233-L240 HydrophobicContact CG2-CD1 3.68Å; V233-L240 HydrophobicContact CG2-CG 3.78Å; V233-C268 HydrophobicContact CG2-CB 4.06Å; V233-P270 HydrophobicContact CG1-CB 3.91Å; V233-P270 HydrophobicContact CG1-CG 4.23Å; V233-V281 HydrophobicContact CB-CG1 4.19Å; V233-V281 HydrophobicContact CG1-CG1 3.87Å; V233-V281 HydrophobicContact CG1-CG2 4.31Å
234	A	92.3	Very high	90.4	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-40.3	175.5	0	0	0	0	0	112.9	L200 W225 V230 G231 H232 V281	L200-A234 HydrophobicContact CD1-CB 3.87Å; L200-A234 HydrophobicContact CD2-CB 4.1Å; L200-A234 HydrophobicContact CG-CB 4.37Å; W225-A234 HydrophobicContact CE3-CB 4.35Å; W225-A234 HydrophobicContact CH2-CB 3.91Å; W225-A234 WeakPolarHBondContact CH2-O 3.42Å; W225-A234 HydrophobicContact CZ2-CB 4.43Å; W225-A234 WeakPolarHBondContact CZ2-O 3.24Å; W225-A234 HydrophobicContact CZ3-CB 3.87Å; V230-A234 WeakPolarHBondContact O-CB 3.3Å; V230-A234 PolarHBondContact O-N 2.8Å; G231-A234 PolarHBondContact O-N 3.44Å; H232-A234 VanDerWaalsContact C-N 3.33Å; A234-V281 HydrophobicContact CB-CG2 3.72Å
235	A	90.8	Very high	90.7	Very high	36 Å²	36	49.7 Å²	49.7	30%	0.298	26%	0.258	S	S	.	.	H	α-helix	trans	-76	-39.6	-177	0	0	0	0	0	113.4	N226 G231 H232 V233	N226-A235 HydrophobicContact CB-CB 3.85Å; G231-A235 WeakPolarHBondContact O-CB 3.49Å; G231-A235 PolarHBondContact O-N 3.16Å; H232-A235 PolarHBondContact O-N 2.79Å; V233-A235 VanDerWaalsContact C-N 3.34Å; V233-A235 PolarHBondContact O-N 3.43Å
236	L	91.9	Very high	90.7	Very high	106 Å²	106	50.5 Å²	50.5	56%	0.555	26%	0.262	S	S	*	.	H	α-helix	trans	-88.6	-26.8	-179.4	-66.5	-172	0	0	0	113.5	H232 E238	H232-L236 WeakPolarHBondContact CE1-CD1 3.42Å; H232-L236 WeakPolarHBondContact NE2-CD1 3.36Å; H232-L236 PolarHBondContact O-N 3.16Å; L236-E238 HydrophobicContact CB-CB 4.48Å; L236-E238 PolarHBondContact O-N 3.01Å
237	G	92	Very high	90.8	Very high	5 Å²	5	53.3 Å²	53.3	5%	0.052	27%	0.272	C	S	.	.			trans	69.6	20.9	-173.7	0	0	0	0	0	113.7	V233 P270 K272	V233-G237 WeakPolarHBondContact O-CA 3.48Å; V233-G237 PolarHBondContact O-N 3.41Å; G237-P270 WeakPolarHBondContact O-CG 3Å; G237-K272 WeakPolarHBondContact O-CE 3.2Å; G237-K272 PolarHBondContact O-NZ 3.22Å
238	E	93.1	Very high	91	Very high	113 Å²	113	48.2 Å²	48.2	53%	0.528	25%	0.251	S	S	.	.			trans	-115.6	144.3	-180	-64.3	-55.3	135.3	0	0	111.2	L236	L236-E238 HydrophobicContact CB-CB 4.48Å; L236-E238 PolarHBondContact O-N 3.01Å
239	P	93.5	Very high	91	Very high	59 Å²	59	52.7 Å²	52.7	38%	0.383	27%	0.274	S	S	.	.			trans	-74.3	153.2	-178.1	33.1	-37.4	0	0	0	113	C268 M269	P239-C268 WeakPolarHBondContact CA-O 3.47Å; P239-M269 HydrophobicContact CB-CE 3.71Å; P239-M269 HydrophobicContact CB-CG 4.5Å; P239-M269 HydrophobicContact CB-SD 3.36Å; P239-M269 WeakPolarHBondContact CB-SD 3.21Å; P239-M269 HydrophobicContact CG-SD 4.35Å
240	L	94.3	Very high	90.9	Very high	31 Å²	31	56 Å²	56	16%	0.162	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125	174.3	-70.5	-179.9	0	0	0	111.3	I229 V233 C268	I229-L240 HydrophobicContact CG2-CD1 4.12Å; V233-L240 HydrophobicContact CG2-CB 4.16Å; V233-L240 HydrophobicContact CG2-CD1 3.68Å; V233-L240 HydrophobicContact CG2-CG 3.78Å; L240-C268 PolarHBondContact N-O 3.22Å; L240-C268 PolarHBondContact O-N 2.91Å
241	N	93.4	Very high	90.8	Very high	45 Å²	45	57.3 Å²	57.3	24%	0.241	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	103.5	170	-177.5	-0	0	0	0	109.6	L267 F295 E300	N241-L267 HydrophobicContact CB-CD1 3.96Å; N241-F295 PolarHBondContact ND2-O 3.47Å; N241-E300 WeakPolarHBondContact CB-OE1 3.3Å; N241-E300 PolarHBondContact ND2-OE1 2.78Å
242	I	93	Very high	90.5	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.062	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.2	-175.4	-59	167.5	0	0	0	108.3	I229 D244 D248 S265 I266	I229-I242 HydrophobicContact CD1-CD1 3.7Å; I229-I242 HydrophobicContact CG1-CD1 4.11Å; I229-I242 HydrophobicContact CG2-CD1 4.11Å; I242-D244 VanDerWaalsContact CG2-O 3.26Å; I242-D244 WeakPolarHBondContact CG2-O 3.27Å; I242-D248 HydrophobicContact CD1-CB 4.22Å; I242-D248 WeakPolarHBondContact CD1-OD2 3.49Å; I242-D248 HydrophobicContact CG2-CB 4.06Å; I242-S265 CarbonylContact O-C 3.47Å; I242-S265 WeakPolarHBondContact O-CA 3.22Å; I242-I266 HydrophobicContact CB-CB 4.22Å; I242-I266 HydrophobicContact CD1-CB 4.48Å; I242-I266 PolarHBondContact N-O 3.37Å; I242-I266 PolarHBondContact O-N 2.82Å
243	K	89.1	Confident	90	Very high	145 Å²	145	60 Å²	60	63%	0.63	31%	0.31	S	S	*	.	S	Bend	trans	-80.1	-32.9	-177.6	-64.4	-176.9	-179.2	177.4	0	113.2	T294	K243-T294 HydrophobicContact CB-CG2 3.8Å; K243-T294 HydrophobicContact CD-CG2 4.36Å; K243-T294 HydrophobicContact CG-CG2 3.86Å
244	D	88.8	Confident	89.2	Confident	70 Å²	70	65.8 Å²	65.8	37%	0.374	34%	0.337	S	S	.	.			trans	-137	113.7	172.8	-165.3	-28.9	0	0	0	109.2	I242 Y246 E247 Q264	I242-D244 VanDerWaalsContact CG2-O 3.26Å; I242-D244 WeakPolarHBondContact CG2-O 3.27Å; D244-Y246 VanDerWaalsContact C-N 3.28Å; D244-Y246 PolarHBondContact O-N 3.11Å; D244-Y246 PolarHBondContact OD1-N 3.4Å; D244-E247 HydrophobicContact CB-CB 4.32Å; D244-E247 HydrophobicContact CB-CG 4.02Å; D244-E247 PolarHBondContact O-N 3.01Å; D244-Q264 CarbonylContact C-O 3.58Å; D244-Q264 VanDerWaalsContact CA-O 3.22Å; D244-Q264 WeakPolarHBondContact CA-O 3.47Å
245	A	88.9	Confident	88.2	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-63.4	-32.6	-177.7	0	0	0	0	0	112.7	E247 D248 F251 T263 Q264 I266	A245-E247 VanDerWaalsContact C-N 3.26Å; A245-E247 PolarHBondContact O-N 2.83Å; A245-D248 PolarHBondContact O-N 3.01Å; A245-F251 HydrophobicContact CB-CD1 4Å; A245-F251 HydrophobicContact CB-CD2 3.97Å; A245-F251 HydrophobicContact CB-CE1 4.06Å; A245-F251 HydrophobicContact CB-CE2 4.04Å; A245-F251 HydrophobicContact CB-CG 3.96Å; A245-F251 HydrophobicContact CB-CZ 4.1Å; A245-F251 WeakPolarHBondContact O-CB 3.36Å; A245-F251 WeakPolarHBondContact O-CD1 3.29Å; A245-F251 WeakPolarHBondContact O-CG 3.48Å; A245-T263 HydrophobicContact CB-CG2 4.06Å; A245-Q264 PolarHBondContact N-O 2.87Å; A245-I266 HydrophobicContact CB-CD1 3.68Å; A245-I266 HydrophobicContact CB-CG1 4.17Å
246	Y	88.3	Confident	87.7	Confident	102 Å²	102	67.6 Å²	67.6	40%	0.4	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-75.5	-16.3	-177.1	-76.2	-101.3	0	0	0	112.9	D244 F251 A253 D256 K262 T263	D244-Y246 VanDerWaalsContact C-N 3.28Å; D244-Y246 PolarHBondContact O-N 3.11Å; D244-Y246 PolarHBondContact OD1-N 3.4Å; Y246-F251 HydrophobicContact CD2-CE1 4.2Å; Y246-F251 HydrophobicContact CE1-CE1 4.49Å; Y246-F251 AromaticContact CE2-CE1 3.93Å; Y246-F251 HydrophobicContact CE2-CE1 3.93Å; Y246-A253 HydrophobicContact CD1-CB 4.42Å; Y246-A253 HydrophobicContact CE1-CB 3.85Å; Y246-D256 WeakPolarHBondContact OH-CB 3.27Å; Y246-D256 PolarHBondContact OH-OD2 2.88Å; Y246-K262 HydrophobicContact CE2-CG 4.38Å; Y246-T263 WeakPolarHBondContact CE2-O 3.39Å
247	E	89.1	Confident	86.9	Confident	160 Å²	160	69.7 Å²	69.7	75%	0.748	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-87.8	-11.5	173.9	-64.2	-67.5	132.2	0	0	112.5	D244 A245	D244-E247 HydrophobicContact CB-CB 4.32Å; D244-E247 HydrophobicContact CB-CG 4.02Å; D244-E247 PolarHBondContact O-N 3.01Å; A245-E247 VanDerWaalsContact C-N 3.26Å; A245-E247 PolarHBondContact O-N 2.83Å
248	D	89.3	Confident	85.9	Confident	23 Å²	23	76.4 Å²	76.4	12%	0.123	38%	0.383	C	S	.	.			trans	-90.5	120.9	179.1	-164	-62.2	0	0	0	111.3	I242 A245 R250 F251	I242-D248 HydrophobicContact CD1-CB 4.22Å; I242-D248 WeakPolarHBondContact CD1-OD2 3.49Å; I242-D248 HydrophobicContact CG2-CB 4.06Å; A245-D248 PolarHBondContact O-N 3.01Å; D248-R250 PolarHBondContact O-N 3.4Å; D248-R250 VanDerWaalsContact OD1-CB 3.26Å; D248-R250 WeakPolarHBondContact OD1-CB 3.39Å; D248-R250 IonicContact OD1-CZ 2.66Å; D248-R250 PolarHBondContact OD1-N 3.16Å; D248-R250 IonicContact OD1-NE 2.9Å; D248-R250 PolarHBondContact OD1-NE 2.82Å; D248-R250 IonicContact OD1-NH2 3.43Å; D248-R250 IonicContact OD2-CZ 3.59Å; D248-R250 IonicContact OD2-NE 3.56Å; D248-R250 IonicContact OD2-NH2 3.68Å; D248-R250 PolarHBondContact OD2-NH2 2.77Å; D248-F251 WeakPolarHBondContact O-CB 3.35Å; D248-F251 PolarHBondContact O-N 2.99Å
249	P	87.8	Confident	84.7	Confident	129 Å²	129	74.9 Å²	74.9	84%	0.838	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.6	-176.5	27.6	-36	0	0	0	114.1
250	R	88.9	Confident	83.8	Confident	79 Å²	79	75.6 Å²	75.6	30%	0.298	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-8.9	178.3	-58.4	164.6	-70.6	-169.1	0.2	112.4	G228 I229 H232 D248	G228-R250 WeakPolarHBondContact CA-O 2.98Å; I229-R250 HydrophobicContact CG1-CB 4.08Å; H232-R250 PolarHBondContact CD2-NH1 2.89Å; H232-R250 PolarHBondContact NE2-NH1 2.87Å; D248-R250 PolarHBondContact O-N 3.4Å; D248-R250 VanDerWaalsContact OD1-CB 3.26Å; D248-R250 WeakPolarHBondContact OD1-CB 3.39Å; D248-R250 IonicContact OD1-CZ 2.66Å; D248-R250 PolarHBondContact OD1-N 3.16Å; D248-R250 IonicContact OD1-NE 2.9Å; D248-R250 PolarHBondContact OD1-NE 2.82Å; D248-R250 IonicContact OD1-NH2 3.43Å; D248-R250 IonicContact OD2-CZ 3.59Å; D248-R250 IonicContact OD2-NE 3.56Å; D248-R250 IonicContact OD2-NH2 3.68Å; D248-R250 PolarHBondContact OD2-NH2 2.77Å
251	F	88	Confident	83.2	Confident	39 Å²	39	75.7 Å²	75.7	17%	0.171	40%	0.398	C	S	.	.			trans	-77.2	132.5	179.9	-178.2	-115.8	0	0	0	111.3	I229 A245 Y246 D248 A253 T263 I266	I229-F251 HydrophobicContact CD1-CB 4.03Å; I229-F251 HydrophobicContact CD1-CD2 3.86Å; I229-F251 HydrophobicContact CD1-CG 4.43Å; A245-F251 HydrophobicContact CB-CD1 4Å; A245-F251 HydrophobicContact CB-CD2 3.97Å; A245-F251 HydrophobicContact CB-CE1 4.06Å; A245-F251 HydrophobicContact CB-CE2 4.04Å; A245-F251 HydrophobicContact CB-CG 3.96Å; A245-F251 HydrophobicContact CB-CZ 4.1Å; A245-F251 WeakPolarHBondContact O-CB 3.36Å; A245-F251 WeakPolarHBondContact O-CD1 3.29Å; A245-F251 WeakPolarHBondContact O-CG 3.48Å; Y246-F251 HydrophobicContact CD2-CE1 4.2Å; Y246-F251 HydrophobicContact CE1-CE1 4.49Å; Y246-F251 AromaticContact CE2-CE1 3.93Å; Y246-F251 HydrophobicContact CE2-CE1 3.93Å; D248-F251 WeakPolarHBondContact O-CB 3.35Å; D248-F251 PolarHBondContact O-N 2.99Å; F251-A253 HydrophobicContact CD1-CB 4.27Å; F251-A253 HydrophobicContact CE1-CB 3.96Å; F251-T263 HydrophobicContact CE2-CG2 3.99Å; F251-T263 HydrophobicContact CZ-CG2 4.21Å; F251-I266 HydrophobicContact CD2-CD1 3.88Å; F251-I266 HydrophobicContact CE2-CD1 4.07Å
252	N	82.9	Confident	82.9	Confident	81 Å²	81	80.5 Å²	80.5	43%	0.433	42%	0.417	S	S	.	.			trans	-98.6	101	173.4	-174	-1.2	0	0	0	110.5	E254	N252-E254 PolarHBondContact ND2-OE2 3.22Å; N252-E254 PolarHBondContact O-N 2.93Å; N252-E254 WeakPolarHBondContact OD1-CB 3.26Å; N252-E254 VanDerWaalsContact OD1-CG 3.24Å; N252-E254 WeakPolarHBondContact OD1-CG 3.44Å; N252-E254 PolarHBondContact OD1-N 3.23Å
253	A	80.6	Confident	82.7	Confident	23 Å²	23	80.3 Å²	80.3	19%	0.19	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-8	179.3	0	0	0	0	0	114.5	Y246 F251 V255 D256 Q257	Y246-A253 HydrophobicContact CD1-CB 4.42Å; Y246-A253 HydrophobicContact CE1-CB 3.85Å; F251-A253 HydrophobicContact CD1-CB 4.27Å; F251-A253 HydrophobicContact CE1-CB 3.96Å; A253-V255 VanDerWaalsContact C-N 3.26Å; A253-V255 PolarHBondContact O-N 2.84Å; A253-D256 PolarHBondContact O-N 3.06Å; A253-Q257 WeakPolarHBondContact O-CG 3.44Å; A253-Q257 PolarHBondContact O-N 3.49Å; A253-Q257 VanDerWaalsContact O-N 3.12Å
254	E	76.6	Confident	82.6	Confident	121 Å²	121	77.4 Å²	77.4	57%	0.565	41%	0.405	S	S	*	.	H	α-helix	trans	-62.1	-35.6	177.9	-65.3	173.6	166.2	0	0	111.5	N252 Q257 I258	N252-E254 PolarHBondContact ND2-OE2 3.22Å; N252-E254 PolarHBondContact O-N 2.93Å; N252-E254 WeakPolarHBondContact OD1-CB 3.26Å; N252-E254 VanDerWaalsContact OD1-CG 3.24Å; N252-E254 WeakPolarHBondContact OD1-CG 3.44Å; N252-E254 PolarHBondContact OD1-N 3.23Å; E254-Q257 PolarHBondContact O-N 3.48Å; E254-I258 WeakPolarHBondContact O-CD1 3.34Å; E254-I258 WeakPolarHBondContact O-CG1 3.08Å; E254-I258 PolarHBondContact O-N 3.14Å
255	V	71.8	Confident	82.7	Confident	68 Å²	68	74.1 Å²	74.1	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-66.7	-43.1	179.7	-176.4	0	0	0	0	111	A253 Q257 I258 T259	A253-V255 VanDerWaalsContact C-N 3.26Å; A253-V255 PolarHBondContact O-N 2.84Å; V255-Q257 VanDerWaalsContact C-N 3.35Å; V255-Q257 PolarHBondContact O-N 2.76Å; V255-I258 PolarHBondContact O-N 3.06Å; V255-T259 HydrophobicContact CG1-CG2 4.31Å; V255-T259 WeakPolarHBondContact O-CB 3.47Å; V255-T259 VanDerWaalsContact O-CG2 3.26Å; V255-T259 WeakPolarHBondContact O-CG2 3.44Å; V255-T259 PolarHBondContact O-N 2.95Å; V255-T259 PolarHBondContact O-OG1 2.93Å
256	D	79.8	Confident	82.9	Confident	9 Å²	9	74.1 Å²	74.1	5%	0.048	39%	0.388	C	S	.	.	H	α-helix	trans	-61.5	-41.8	174.3	-87.5	24.6	0	0	0	111.6	Y246 A253 I258 T259 G260 Y261 T263	Y246-D256 WeakPolarHBondContact OH-CB 3.27Å; Y246-D256 PolarHBondContact OH-OD2 2.88Å; A253-D256 PolarHBondContact O-N 3.06Å; D256-I258 PolarHBondContact O-N 2.85Å; D256-T259 PolarHBondContact O-N 2.97Å; D256-T259 PolarHBondContact O-OG1 3.48Å; D256-G260 WeakPolarHBondContact O-CA 3.31Å; D256-G260 PolarHBondContact O-N 2.92Å; D256-Y261 VanDerWaalsContact CA-O 3.3Å; D256-Y261 WeakPolarHBondContact CA-O 3.22Å; D256-Y261 WeakPolarHBondContact CB-O 3.48Å; D256-Y261 PolarHBondContact O-N 3.24Å; D256-T263 PolarHBondContact OD1-OG1 3.37Å; D256-T263 WeakPolarHBondContact OD2-CB 3.34Å; D256-T263 PolarHBondContact OD2-N 3.03Å; D256-T263 PolarHBondContact OD2-OG1 3.12Å
257	Q	76.4	Confident	83.2	Confident	150 Å²	150	69.3 Å²	69.3	70%	0.701	37%	0.369	S	S	*	.	H	α-helix	trans	-65.8	-36.5	179.9	-71.1	170.4	35.3	0	0	112.8	A253 E254 V255	A253-Q257 WeakPolarHBondContact O-CG 3.44Å; A253-Q257 PolarHBondContact O-N 3.49Å; A253-Q257 VanDerWaalsContact O-N 3.12Å; E254-Q257 PolarHBondContact O-N 3.48Å; V255-Q257 VanDerWaalsContact C-N 3.35Å; V255-Q257 PolarHBondContact O-N 2.76Å
258	I	71.1	Confident	83.4	Confident	145 Å²	145	61.7 Å²	61.7	74%	0.744	33%	0.333	S	S	*	.	H	α-helix	trans	-76.3	-41.4	178.7	-65.2	164.8	0	0	0	111	E254 V255 D256	E254-I258 WeakPolarHBondContact O-CD1 3.34Å; E254-I258 WeakPolarHBondContact O-CG1 3.08Å; E254-I258 PolarHBondContact O-N 3.14Å; V255-I258 PolarHBondContact O-N 3.06Å; D256-I258 PolarHBondContact O-N 2.85Å
259	T	68.1	Low	83.7	Confident	81 Å²	81	60.9 Å²	60.9	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-83.6	-16	-175.1	57.8	0	0	0	0	113.5	V255 D256 Y261	V255-T259 HydrophobicContact CG1-CG2 4.31Å; V255-T259 WeakPolarHBondContact O-CB 3.47Å; V255-T259 VanDerWaalsContact O-CG2 3.26Å; V255-T259 WeakPolarHBondContact O-CG2 3.44Å; V255-T259 PolarHBondContact O-N 2.95Å; V255-T259 PolarHBondContact O-OG1 2.93Å; D256-T259 PolarHBondContact O-N 2.97Å; D256-T259 PolarHBondContact O-OG1 3.48Å; T259-Y261 PolarHBondContact O-N 3.43Å; T259-Y261 WeakPolarHBondContact OG1-CB 3.28Å; T259-Y261 PolarHBondContact OG1-N 3.39Å
260	G	73.8	Confident	84	Confident	74 Å²	74	55.6 Å²	55.6	76%	0.763	30%	0.295	S	S	*	.			trans	68.9	7.8	-171.8	0	0	0	0	0	113.4	D256	D256-G260 WeakPolarHBondContact O-CA 3.31Å; D256-G260 PolarHBondContact O-N 2.92Å
261	Y	82.9	Confident	84.3	Confident	33 Å²	33	51.8 Å²	51.8	13%	0.129	28%	0.28	C	S	.	.			trans	-88.6	145.3	177	-171	-101.5	0	0	0	109.9	D183 R184 D256 T259 I285 N286	D183-Y261 WeakPolarHBondContact OD2-CE2 3.37Å; D183-Y261 PolarHBondContact OD2-OH 3.04Å; R184-Y261 VanDerWaalsContact NE-CE2 3.27Å; D256-Y261 VanDerWaalsContact CA-O 3.3Å; D256-Y261 WeakPolarHBondContact CA-O 3.22Å; D256-Y261 WeakPolarHBondContact CB-O 3.48Å; D256-Y261 PolarHBondContact O-N 3.24Å; T259-Y261 PolarHBondContact O-N 3.43Å; T259-Y261 WeakPolarHBondContact OG1-CB 3.28Å; T259-Y261 PolarHBondContact OG1-N 3.39Å; Y261-I285 HydrophobicContact CD1-CD1 4.5Å; Y261-I285 HydrophobicContact CE1-CD1 3.63Å; Y261-I285 HydrophobicContact CE1-CG1 4.42Å; Y261-N286 PolarHBondContact OH-ND2 3.43Å
262	K	85.4	Confident	84.5	Confident	146 Å²	146	52.2 Å²	52.2	64%	0.635	28%	0.282	S	S	*	.			trans	-113	111.1	177.5	-173.2	174.3	-178.4	178.1	0	110.5	Y246 N286	Y246-K262 HydrophobicContact CE2-CG 4.38Å; K262-N286 PolarHBondContact O-ND2 2.89Å
263	T	88.8	Confident	84.8	Confident	8 Å²	8	48.6 Å²	48.6	5%	0.049	26%	0.263	C	S	.	.			trans	-83.7	118.5	172.4	-53.2	0	0	0	0	109.3	A245 Y246 F251 D256 I266 I285	A245-T263 HydrophobicContact CB-CG2 4.06Å; Y246-T263 WeakPolarHBondContact CE2-O 3.39Å; F251-T263 HydrophobicContact CE2-CG2 3.99Å; F251-T263 HydrophobicContact CZ-CG2 4.21Å; D256-T263 PolarHBondContact OD1-OG1 3.37Å; D256-T263 WeakPolarHBondContact OD2-CB 3.34Å; D256-T263 PolarHBondContact OD2-N 3.03Å; D256-T263 PolarHBondContact OD2-OG1 3.12Å; T263-I266 HydrophobicContact CG2-CD1 3.7Å; T263-I266 HydrophobicContact CG2-CG1 3.59Å; T263-I285 HydrophobicContact CG2-CB 4.27Å; T263-I285 HydrophobicContact CG2-CG2 4.22Å
264	Q	87.8	Confident	85.1	Confident	84 Å²	84	53.2 Å²	53.2	39%	0.393	28%	0.28	S	S	.	.			trans	-108.8	-63	-178.3	-174.8	174.6	9.6	0	0	111.2	D244 A245 N286	D244-Q264 CarbonylContact C-O 3.58Å; D244-Q264 VanDerWaalsContact CA-O 3.22Å; D244-Q264 WeakPolarHBondContact CA-O 3.47Å; A245-Q264 PolarHBondContact N-O 2.87Å; Q264-N286 WeakPolarHBondContact CA-OD1 3.32Å; Q264-N286 WeakPolarHBondContact CB-OD1 3.34Å; Q264-N286 PolarHBondContact N-OD1 2.83Å
265	S	91	Very high	85.7	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.007	28%	0.28	C	S	.	.			trans	-111.1	142	177.9	53.9	0	0	0	0	111.2	I242 I285 N286 K287 G293	I242-S265 CarbonylContact O-C 3.47Å; I242-S265 WeakPolarHBondContact O-CA 3.22Å; S265-I285 CarbonylContact O-C 3.6Å; S265-I285 WeakPolarHBondContact O-CA 3.43Å; S265-N286 PolarHBondContact N-OD1 3.31Å; S265-N286 PolarHBondContact O-N 3.32Å; S265-K287 PolarHBondContact OG-N 2.94Å; S265-K287 VanDerWaalsContact OG-N 3.16Å; S265-G293 PolarHBondContact OG-O 2.76Å
266	I	92.8	Very high	86.5	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	126.1	-178.6	-56.2	173.7	0	0	0	109.4	I229 I242 A245 F251 T263 C268 Q283 I285	I229-I266 HydrophobicContact CD1-CD1 3.47Å; I229-I266 VanDerWaalsContact CD1-CD1 3.47Å; I229-I266 HydrophobicContact CG2-CG2 4.49Å; I242-I266 HydrophobicContact CB-CB 4.22Å; I242-I266 HydrophobicContact CD1-CB 4.48Å; I242-I266 PolarHBondContact N-O 3.37Å; I242-I266 PolarHBondContact O-N 2.82Å; A245-I266 HydrophobicContact CB-CD1 3.68Å; A245-I266 HydrophobicContact CB-CG1 4.17Å; F251-I266 HydrophobicContact CD2-CD1 3.88Å; F251-I266 HydrophobicContact CE2-CD1 4.07Å; T263-I266 HydrophobicContact CG2-CD1 3.7Å; T263-I266 HydrophobicContact CG2-CG1 3.59Å; I266-C268 HydrophobicContact CG2-CB 4.31Å; I266-Q283 HydrophobicContact CG2-CG 3.94Å; I266-I285 HydrophobicContact CG1-CG2 4.08Å; I266-I285 HydrophobicContact CG2-CG2 4.33Å
267	L	93.8	Very high	87	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.9	167	-179.6	61	0	0	0	108.8	I180 N241 M269 Q283 A284 F295 D299 E300 F303	I180-L267 HydrophobicContact CD1-CD2 4.38Å; N241-L267 HydrophobicContact CB-CD1 3.96Å; L267-M269 HydrophobicContact CD1-CE 3.79Å; L267-M269 HydrophobicContact CG-CE 4.49Å; L267-Q283 CarbonylContact O-C 3.56Å; L267-Q283 WeakPolarHBondContact O-CA 3.23Å; L267-A284 HydrophobicContact CB-CB 4.47Å; L267-A284 PolarHBondContact N-O 3.45Å; L267-A284 PolarHBondContact O-N 3.29Å; L267-F295 HydrophobicContact CB-CB 4.25Å; L267-F295 HydrophobicContact CB-CD1 3.94Å; L267-F295 HydrophobicContact CB-CD2 3.58Å; L267-F295 HydrophobicContact CB-CE1 4.14Å; L267-F295 HydrophobicContact CB-CE2 3.79Å; L267-F295 HydrophobicContact CB-CG 3.66Å; L267-F295 HydrophobicContact CB-CZ 4.07Å; L267-F295 HydrophobicContact CD2-CB 4.1Å; L267-F295 HydrophobicContact CD2-CD1 3.77Å; L267-F295 HydrophobicContact CD2-CE1 4.39Å; L267-F295 HydrophobicContact CD2-CG 3.97Å; L267-F295 HydrophobicContact CG-CG 4.37Å; L267-D299 HydrophobicContact CD2-CB 4.31Å; L267-E300 HydrophobicContact CD1-CG 3.84Å; L267-F303 HydrophobicContact CD2-CD1 3.57Å; L267-F303 HydrophobicContact CD2-CE1 4.23Å; L267-F303 HydrophobicContact CG-CD1 3.84Å; L267-F303 HydrophobicContact CG-CE1 4.19Å
268	C	94.4	Very high	87.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.7	-177	-165.1	0	0	0	0	110	I229 V233 P239 L240 I266 V281 A282 Q283	I229-C268 HydrophobicContact CG2-CB 4.02Å; V233-C268 HydrophobicContact CG2-CB 4.06Å; P239-C268 WeakPolarHBondContact CA-O 3.47Å; L240-C268 PolarHBondContact N-O 3.22Å; L240-C268 PolarHBondContact O-N 2.91Å; I266-C268 HydrophobicContact CG2-CB 4.31Å; C268-V281 WeakPolarHBondContact SG-CG1 3.45Å; C268-A282 CarbonylContact C-O 3.49Å; C268-A282 WeakPolarHBondContact CA-O 3.29Å; C268-Q283 HydrophobicContact CB-CG 4.49Å
269	M	94.7	Very high	88.8	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.034	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.6	-170.8	-75.4	-81.6	174.9	0	0	110.7	P239 L267 V281 A282 E300 F303 A304 L307	P239-M269 HydrophobicContact CB-CE 3.71Å; P239-M269 HydrophobicContact CB-CG 4.5Å; P239-M269 HydrophobicContact CB-SD 3.36Å; P239-M269 WeakPolarHBondContact CB-SD 3.21Å; P239-M269 HydrophobicContact CG-SD 4.35Å; L267-M269 HydrophobicContact CD1-CE 3.79Å; L267-M269 HydrophobicContact CG-CE 4.49Å; M269-V281 WeakPolarHBondContact O-CA 3.39Å; M269-A282 PolarHBondContact N-O 3.4Å; M269-A282 PolarHBondContact O-N 3.37Å; M269-E300 HydrophobicContact CE-CB 3.74Å; M269-E300 HydrophobicContact CE-CG 3.8Å; M269-F303 HydrophobicContact CB-CD1 4.15Å; M269-F303 HydrophobicContact CB-CE1 4.21Å; M269-F303 HydrophobicContact CG-CB 4.38Å; M269-F303 HydrophobicContact CG-CD1 3.47Å; M269-F303 VanDerWaalsContact CG-CD1 3.47Å; M269-F303 HydrophobicContact CG-CE1 3.95Å; M269-F303 HydrophobicContact CG-CG 3.98Å; M269-A304 HydrophobicContact SD-CB 4.41Å; M269-L307 HydrophobicContact CB-CD1 3.36Å; M269-L307 HydrophobicContact CG-CD1 4.19Å
270	P	94.8	Very high	89.9	Confident	17 Å²	17	44.9 Å²	44.9	11%	0.11	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	142.3	171.7	31.8	-33	0	0	0	109.9	V233 G237 K272 V278	V233-P270 HydrophobicContact CG1-CB 3.91Å; V233-P270 HydrophobicContact CG1-CG 4.23Å; G237-P270 WeakPolarHBondContact O-CG 3Å; P270-K272 HydrophobicContact CB-CG 4.46Å; P270-V278 HydrophobicContact CB-CG1 4.36Å; P270-V278 HydrophobicContact CB-CG2 4.25Å
271	I	94.1	Very high	90.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.3	170	-55.5	-174.4	0	0	0	107	L187 V278 V279 G280 A282 L307 L314	L187-I271 HydrophobicContact CD1-CD1 3.27Å; I271-V278 CarbonylContact O-C 3.6Å; I271-V278 WeakPolarHBondContact O-CA 3.35Å; I271-V279 HydrophobicContact CB-CG2 4.33Å; I271-V279 HydrophobicContact CG2-CG2 3.82Å; I271-V279 WeakPolarHBondContact O-CG2 3.43Å; I271-V279 PolarHBondContact O-N 3.42Å; I271-G280 WeakPolarHBondContact CB-O 3.3Å; I271-G280 PolarHBondContact N-O 3.02Å; I271-G280 PolarHBondContact O-N 3.25Å; I271-A282 HydrophobicContact CD1-CB 4.19Å; I271-A282 HydrophobicContact CG1-CB 4.39Å; I271-L307 HydrophobicContact CD1-CD2 3.85Å; I271-L307 HydrophobicContact CG1-CB 4.46Å; I271-L307 HydrophobicContact CG1-CD1 4.25Å; I271-L307 HydrophobicContact CG1-CD2 3.92Å; I271-L307 HydrophobicContact CG1-CG 4.43Å; I271-L314 HydrophobicContact CD1-CD1 4Å; I271-L314 HydrophobicContact CG2-CD1 4.13Å
272	K	92.8	Very high	91.3	Very high	48 Å²	48	39.9 Å²	39.9	21%	0.209	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.7	-175.8	-61.5	-176.6	-175.9	179.5	0	111.5	G237 P270 E276 E277 V278 G311	G237-K272 WeakPolarHBondContact O-CE 3.2Å; G237-K272 PolarHBondContact O-NZ 3.22Å; P270-K272 HydrophobicContact CB-CG 4.46Å; K272-E276 WeakPolarHBondContact CD-OE2 3.46Å; K272-E276 IonicContact NZ-OE2 2.7Å; K272-E277 CarbonylContact C-O 3.59Å; K272-E277 VanDerWaalsContact CA-O 3.25Å; K272-E277 WeakPolarHBondContact CA-O 2.99Å; K272-V278 HydrophobicContact CG-CG2 4.41Å; K272-G311 WeakPolarHBondContact O-CA 3.38Å
273	N	90.3	Very high	91.5	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.027	16%	0.158	C	C	.	.			trans	-77.9	-179.1	169.7	70.4	10.5	0	0	0	111.2	R275 E276 E277 V279 H315	N273-R275 PolarHBondContact O-N 2.93Å; N273-R275 WeakPolarHBondContact OD1-CA 3.33Å; N273-R275 WeakPolarHBondContact OD1-CB 3.36Å; N273-R275 PolarHBondContact OD1-N 3.36Å; N273-E276 PolarHBondContact O-N 3.35Å; N273-E276 PolarHBondContact OD1-N 3.38Å; N273-E277 PolarHBondContact N-O 3.19Å; N273-E277 PolarHBondContact ND2-OE2 3.12Å; N273-E277 WeakPolarHBondContact OD1-CB 3.5Å; N273-E277 PolarHBondContact OD1-N 3.02Å; N273-V279 HydrophobicContact CB-CG1 3.86Å; N273-H315 HydrophobicContact CB-CB 4.08Å
274	H	86.3	Confident	91.6	Very high	120 Å²	120	33.9 Å²	33.9	56%	0.556	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-6.9	178.1	67.4	79.3	0	0	0	114.8
275	R	89.1	Confident	91.7	Very high	147 Å²	147	30.8 Å²	30.8	56%	0.555	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	11.5	174.3	-57.1	-168.5	-68.5	-136.3	-2.6	112.6	N273 E277	N273-R275 PolarHBondContact O-N 2.93Å; N273-R275 WeakPolarHBondContact OD1-CA 3.33Å; N273-R275 WeakPolarHBondContact OD1-CB 3.36Å; N273-R275 PolarHBondContact OD1-N 3.36Å; R275-E277 HydrophobicContact CB-CG 4.16Å; R275-E277 IonicContact CZ-OE2 3.23Å; R275-E277 VanDerWaalsContact CZ-OE2 3.3Å; R275-E277 IonicContact NE-OE1 3.4Å; R275-E277 IonicContact NE-OE2 3.77Å; R275-E277 PolarHBondContact NE-OE2 3.48Å; R275-E277 IonicContact NH2-OE1 3.52Å; R275-E277 IonicContact NH2-OE2 3.31Å; R275-E277 PolarHBondContact NH2-OE2 3.25Å; R275-E277 PolarHBondContact O-N 3.33Å
276	E	88.2	Confident	91.7	Very high	133 Å²	133	31.9 Å²	31.9	62%	0.621	15%	0.147	S	C	*	.	S	Bend	trans	64	16.3	-174.6	-61.6	-66.8	142.6	0	0	114.3	K272 N273	K272-E276 WeakPolarHBondContact CD-OE2 3.46Å; K272-E276 IonicContact NZ-OE2 2.7Å; N273-E276 PolarHBondContact O-N 3.35Å; N273-E276 PolarHBondContact OD1-N 3.38Å
277	E	91	Very high	91.5	Very high	87 Å²	87	33.3 Å²	33.3	41%	0.407	15%	0.153	S	C	.	.			trans	-84.1	135.6	174.9	-57.3	169.6	135.7	0	0	110.1	K272 N273 R275 V279	K272-E277 CarbonylContact C-O 3.59Å; K272-E277 VanDerWaalsContact CA-O 3.25Å; K272-E277 WeakPolarHBondContact CA-O 2.99Å; N273-E277 PolarHBondContact N-O 3.19Å; N273-E277 PolarHBondContact ND2-OE2 3.12Å; N273-E277 WeakPolarHBondContact OD1-CB 3.5Å; N273-E277 PolarHBondContact OD1-N 3.02Å; R275-E277 HydrophobicContact CB-CG 4.16Å; R275-E277 IonicContact CZ-OE2 3.23Å; R275-E277 VanDerWaalsContact CZ-OE2 3.3Å; R275-E277 IonicContact NE-OE1 3.4Å; R275-E277 IonicContact NE-OE2 3.77Å; R275-E277 PolarHBondContact NE-OE2 3.48Å; R275-E277 IonicContact NH2-OE1 3.52Å; R275-E277 IonicContact NH2-OE2 3.31Å; R275-E277 PolarHBondContact NH2-OE2 3.25Å; R275-E277 PolarHBondContact O-N 3.33Å; E277-V279 PolarHBondContact O-N 3.48Å
278	V	92.6	Very high	91	Very high	23 Å²	23	37.6 Å²	37.6	14%	0.139	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	115.8	177.8	-174.3	0	0	0	0	110	V190 P270 I271 K272 G280 V281	V190-V278 HydrophobicContact CG2-CG1 4.27Å; V190-V278 WeakPolarHBondContact CG2-O 3.42Å; P270-V278 HydrophobicContact CB-CG1 4.36Å; P270-V278 HydrophobicContact CB-CG2 4.25Å; I271-V278 CarbonylContact O-C 3.6Å; I271-V278 WeakPolarHBondContact O-CA 3.35Å; K272-V278 HydrophobicContact CG-CG2 4.41Å; V278-G280 VanDerWaalsContact CG1-O 3.22Å; V278-G280 WeakPolarHBondContact CG1-O 3.35Å; V278-V281 HydrophobicContact CG1-CG2 4.34Å
279	V	91.7	Very high	89.8	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-16.2	176.5	-64.8	0	0	0	0	112.7	V190 I271 N273 E277 H315	V190-V279 PolarHBondContact N-O 3.03Å; I271-V279 HydrophobicContact CB-CG2 4.33Å; I271-V279 HydrophobicContact CG2-CG2 3.82Å; I271-V279 WeakPolarHBondContact O-CG2 3.43Å; I271-V279 PolarHBondContact O-N 3.42Å; N273-V279 HydrophobicContact CB-CG1 3.86Å; E277-V279 PolarHBondContact O-N 3.48Å; V279-H315 HydrophobicContact CG1-CB 4.26Å
280	G	91.8	Very high	87.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	179.8	174.2	0	0	0	0	0	112.5	F188 I271 V278	F188-G280 CarbonylContact O-C 3.48Å; F188-G280 VanDerWaalsContact O-C 3.31Å; F188-G280 WeakPolarHBondContact O-CA 3.37Å; I271-G280 WeakPolarHBondContact CB-O 3.3Å; I271-G280 PolarHBondContact N-O 3.02Å; I271-G280 PolarHBondContact O-N 3.25Å; V278-G280 VanDerWaalsContact CG1-O 3.22Å; V278-G280 WeakPolarHBondContact CG1-O 3.35Å
281	V	93.1	Very high	85.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	126.2	177.8	-179.3	0	0	0	0	108.6	L187 F188 L200 V230 V233 A234 C268 M269 V278	L187-V281 WeakPolarHBondContact CA-O 3.38Å; F188-V281 PolarHBondContact N-O 3.45Å; F188-V281 PolarHBondContact O-N 3.41Å; L200-V281 HydrophobicContact CD2-CG2 4.49Å; V230-V281 HydrophobicContact CG1-CB 3.81Å; V230-V281 HydrophobicContact CG1-CG1 3.74Å; V230-V281 HydrophobicContact CG1-CG2 4.27Å; V233-V281 HydrophobicContact CB-CG1 4.19Å; V233-V281 HydrophobicContact CG1-CG1 3.87Å; V233-V281 HydrophobicContact CG1-CG2 4.31Å; A234-V281 HydrophobicContact CB-CG2 3.72Å; C268-V281 WeakPolarHBondContact SG-CG1 3.45Å; M269-V281 WeakPolarHBondContact O-CA 3.39Å; V278-V281 HydrophobicContact CG1-CG2 4.34Å
282	A	92.1	Very high	84.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139.5	172.7	0	0	0	0	0	110.1	I176 S186 L187 C268 M269 I271 F303 L307	I176-A282 HydrophobicContact CD1-CB 4.46Å; S186-A282 CarbonylContact O-C 3.53Å; L187-A282 HydrophobicContact CD1-CB 4.05Å; C268-A282 CarbonylContact C-O 3.49Å; C268-A282 WeakPolarHBondContact CA-O 3.29Å; M269-A282 PolarHBondContact N-O 3.4Å; M269-A282 PolarHBondContact O-N 3.37Å; I271-A282 HydrophobicContact CD1-CB 4.19Å; I271-A282 HydrophobicContact CG1-CB 4.39Å; A282-F303 HydrophobicContact CB-CE2 4.03Å; A282-F303 HydrophobicContact CB-CZ 3.64Å; A282-L307 HydrophobicContact CB-CD1 3.92Å; A282-L307 HydrophobicContact CB-CD2 4.03Å
283	Q	91.3	Very high	83.4	Confident	29 Å²	29	52.2 Å²	52.2	14%	0.136	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.7	179.1	-171.6	-177.2	33.7	0	0	109.2	Y185 S186 I266 L267 C268 I285	Y185-Q283 CarbonylContact C-O 3.59Å; Y185-Q283 VanDerWaalsContact CA-O 3.23Å; Y185-Q283 WeakPolarHBondContact CA-O 3.3Å; S186-Q283 PolarHBondContact N-O 3.11Å; S186-Q283 PolarHBondContact O-N 2.98Å; I266-Q283 HydrophobicContact CG2-CG 3.94Å; L267-Q283 CarbonylContact O-C 3.56Å; L267-Q283 WeakPolarHBondContact O-CA 3.23Å; C268-Q283 HydrophobicContact CB-CG 4.49Å; Q283-I285 HydrophobicContact CG-CG2 4Å
284	A	90.7	Very high	83.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.5	169.3	0	0	0	0	0	108.6	A182 Y185 L267 F295 F303	A182-A284 HydrophobicContact CB-CB 3.97Å; Y185-A284 HydrophobicContact CD1-CB 3.66Å; Y185-A284 HydrophobicContact CE1-CB 3.69Å; L267-A284 HydrophobicContact CB-CB 4.47Å; L267-A284 PolarHBondContact N-O 3.45Å; L267-A284 PolarHBondContact O-N 3.29Å; A284-F295 HydrophobicContact CB-CE1 4.21Å; A284-F295 HydrophobicContact CB-CZ 4.08Å; A284-F303 HydrophobicContact CB-CE1 4.24Å
285	I	89.9	Confident	83.4	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.092	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	145.4	-179	66.7	-179.6	0	0	0	111.5	A182 D183 R184 Y261 T263 S265 I266 Q283	A182-I285 WeakPolarHBondContact CB-O 3.46Å; D183-I285 PolarHBondContact N-O 3.3Å; R184-I285 HydrophobicContact CB-CD1 3.96Å; R184-I285 HydrophobicContact CB-CG1 3.74Å; R184-I285 HydrophobicContact CG-CG1 4.48Å; R184-I285 PolarHBondContact N-O 3.18Å; R184-I285 PolarHBondContact O-N 3.2Å; Y261-I285 HydrophobicContact CD1-CD1 4.5Å; Y261-I285 HydrophobicContact CE1-CD1 3.63Å; Y261-I285 HydrophobicContact CE1-CG1 4.42Å; T263-I285 HydrophobicContact CG2-CB 4.27Å; T263-I285 HydrophobicContact CG2-CG2 4.22Å; S265-I285 CarbonylContact O-C 3.6Å; S265-I285 WeakPolarHBondContact O-CA 3.43Å; I266-I285 HydrophobicContact CG1-CG2 4.08Å; I266-I285 HydrophobicContact CG2-CG2 4.33Å; Q283-I285 HydrophobicContact CG-CG2 4Å
286	N	89.4	Confident	83.4	Confident	24 Å²	24	45.9 Å²	45.9	13%	0.128	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	56.1	87.2	178.3	-68.2	-20.6	0	0	0	113.9	A182 D183 Y261 K262 Q264 S265 K288	A182-N286 CarbonylContact C-O 3.55Å; A182-N286 WeakPolarHBondContact CA-O 3.46Å; D183-N286 HydrophobicContact CB-CB 3.7Å; D183-N286 PolarHBondContact N-O 3.24Å; Y261-N286 PolarHBondContact OH-ND2 3.43Å; K262-N286 PolarHBondContact O-ND2 2.89Å; Q264-N286 WeakPolarHBondContact CA-OD1 3.32Å; Q264-N286 WeakPolarHBondContact CB-OD1 3.34Å; Q264-N286 PolarHBondContact N-OD1 2.83Å; S265-N286 PolarHBondContact N-OD1 3.31Å; S265-N286 PolarHBondContact O-N 3.32Å; N286-K288 PolarHBondContact O-N 2.91Å
287	K	89.1	Confident	83.4	Confident	31 Å²	31	46.4 Å²	46.4	14%	0.135	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	124.9	175.1	-175.8	80.6	-164.2	-178.8	0	111.2	S181 S265 S289 F295 D299	S181-K287 CarbonylContact O-C 3.55Å; S181-K287 VanDerWaalsContact O-CD 3.22Å; S181-K287 WeakPolarHBondContact O-CD 3.45Å; S181-K287 WeakPolarHBondContact O-CE 3.5Å; S265-K287 PolarHBondContact OG-N 2.94Å; S265-K287 VanDerWaalsContact OG-N 3.16Å; K287-S289 PolarHBondContact O-N 3.12Å; K287-F295 HydrophobicContact CB-CD1 4.15Å; K287-F295 HydrophobicContact CB-CD2 4.47Å; K287-F295 HydrophobicContact CB-CE1 3.98Å; K287-F295 HydrophobicContact CB-CE2 4.31Å; K287-F295 HydrophobicContact CB-CG 4.39Å; K287-F295 HydrophobicContact CB-CZ 4.06Å; K287-F295 HydrophobicContact CD-CD1 3.54Å; K287-F295 HydrophobicContact CD-CE1 3.68Å; K287-F295 HydrophobicContact CD-CG 4.35Å; K287-F295 HydrophobicContact CG-CD1 4.36Å; K287-F295 HydrophobicContact CG-CE1 4.44Å; K287-D299 IonicContact NZ-OD1 2.77Å; K287-D299 PolarHBondContact NZ-OD1 3.2Å; K287-D299 IonicContact NZ-OD2 3.62Å
288	K	83	Confident	83.1	Confident	90 Å²	90	48.6 Å²	48.6	39%	0.391	29%	0.285	S	S	.	.			trans	-76.7	81.8	171.9	-64.3	-173.1	-175	-175.9	0	109.8	S181 A182 E209 N286	S181-K288 PolarHBondContact O-N 2.81Å; A182-K288 VanDerWaalsContact O-CE 3.3Å; A182-K288 WeakPolarHBondContact O-CE 3.4Å; E209-K288 IonicContact OE2-NZ 2.73Å; E209-K288 PolarHBondContact OE2-NZ 3.27Å; N286-K288 PolarHBondContact O-N 2.91Å
289	S	69.6	Low	82.9	Confident	75 Å²	75	48.3 Å²	48.3	52%	0.524	28%	0.282	S	S	.	.	S	Bend	trans	-140.8	131.8	166.3	-179.8	0	0	0	0	107.1	K287 N291 G293	K287-S289 PolarHBondContact O-N 3.12Å; S289-N291 PolarHBondContact O-N 3.12Å; S289-G293 PolarHBondContact O-N 3.23Å
290	G	55.8	Low	82.8	Confident	76 Å²	76	50.6 Å²	50.6	78%	0.784	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	135.3	-170	0	0	0	0	0	113.9
291	N	52.9	Low	82.7	Confident	175 Å²	175	57.5 Å²	57.5	94%	0.936	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	70	-176.3	-74	-0.1	0	0	0	116.4	S289	S289-N291 PolarHBondContact O-N 3.12Å
292	G	61.5	Low	82.3	Confident	40 Å²	40	59 Å²	59	41%	0.412	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	46.4	165.2	0	0	0	0	0	114.4
293	G	71.2	Confident	82.2	Confident	13 Å²	13	59.1 Å²	59.1	13%	0.134	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-54.8	138.7	-179.5	0	0	0	0	0	114	S265 S289	S265-G293 PolarHBondContact OG-O 2.76Å; S289-G293 PolarHBondContact O-N 3.23Å
294	T	86.1	Confident	82.1	Confident	61 Å²	61	59.9 Å²	59.9	37%	0.374	34%	0.342	S	S	.	.			trans	-106.6	153	168.2	52.2	0	0	0	0	109.3	K243	K243-T294 HydrophobicContact CB-CG2 3.8Å; K243-T294 HydrophobicContact CD-CG2 4.36Å; K243-T294 HydrophobicContact CG-CG2 3.86Å
295	F	90.4	Very high	82	Confident	5 Å²	5	61.8 Å²	61.8	2%	0.022	36%	0.358	C	S	.	.			trans	-71.9	137	176.3	-61.7	-85.3	0	0	0	110.3	I180 A182 N241 L267 A284 K287 D299	I180-F295 HydrophobicContact CG2-CD1 4.02Å; I180-F295 HydrophobicContact CG2-CE1 3.73Å; A182-F295 HydrophobicContact CB-CE1 3.94Å; A182-F295 HydrophobicContact CB-CZ 3.93Å; N241-F295 PolarHBondContact ND2-O 3.47Å; L267-F295 HydrophobicContact CB-CB 4.25Å; L267-F295 HydrophobicContact CB-CD1 3.94Å; L267-F295 HydrophobicContact CB-CD2 3.58Å; L267-F295 HydrophobicContact CB-CE1 4.14Å; L267-F295 HydrophobicContact CB-CE2 3.79Å; L267-F295 HydrophobicContact CB-CG 3.66Å; L267-F295 HydrophobicContact CB-CZ 4.07Å; L267-F295 HydrophobicContact CD2-CB 4.1Å; L267-F295 HydrophobicContact CD2-CD1 3.77Å; L267-F295 HydrophobicContact CD2-CE1 4.39Å; L267-F295 HydrophobicContact CD2-CG 3.97Å; L267-F295 HydrophobicContact CG-CG 4.37Å; A284-F295 HydrophobicContact CB-CE1 4.21Å; A284-F295 HydrophobicContact CB-CZ 4.08Å; K287-F295 HydrophobicContact CB-CD1 4.15Å; K287-F295 HydrophobicContact CB-CD2 4.47Å; K287-F295 HydrophobicContact CB-CE1 3.98Å; K287-F295 HydrophobicContact CB-CE2 4.31Å; K287-F295 HydrophobicContact CB-CG 4.39Å; K287-F295 HydrophobicContact CB-CZ 4.06Å; K287-F295 HydrophobicContact CD-CD1 3.54Å; K287-F295 HydrophobicContact CD-CE1 3.68Å; K287-F295 HydrophobicContact CD-CG 4.35Å; K287-F295 HydrophobicContact CG-CD1 4.36Å; K287-F295 HydrophobicContact CG-CE1 4.44Å; F295-D299 HydrophobicContact CB-CB 4.33Å; F295-D299 HydrophobicContact CD1-CB 4.39Å
296	T	89.8	Confident	81.9	Confident	73 Å²	73	61 Å²	61	45%	0.448	35%	0.353	S	S	.	.			trans	-91.9	164.3	-177.7	64.3	0	0	0	0	111.9	K298 D299 E300	T296-K298 PolarHBondContact O-N 2.97Å; T296-K298 VanDerWaalsContact O-N 3.16Å; T296-K298 PolarHBondContact OG1-N 3.36Å; T296-D299 PolarHBondContact N-OD2 2.97Å; T296-D299 WeakPolarHBondContact O-CB 3.45Å; T296-D299 PolarHBondContact O-N 3.27Å; T296-D299 PolarHBondContact OG1-N 3.1Å; T296-D299 PolarHBondContact OG1-OD2 3.15Å; T296-E300 PolarHBondContact O-N 3.14Å
297	E	87.6	Confident	82	Confident	145 Å²	145	60 Å²	60	68%	0.678	35%	0.348	S	S	*	.	H	α-helix	trans	-59.2	-25.5	171.4	-67.1	-176.8	-173.9	0	0	112.7	K301	E297-K301 WeakPolarHBondContact O-CG 3.25Å; E297-K301 PolarHBondContact O-N 3.34Å; E297-K301 VanDerWaalsContact O-N 3.13Å
298	K	86.2	Confident	81.9	Confident	133 Å²	133	61.1 Å²	61.1	58%	0.578	36%	0.363	S	S	*	.	H	α-helix	trans	-69.7	-43.9	173.1	-175.2	177.5	178.1	-177.3	0	110.9	T296 E300 K301 D302	T296-K298 PolarHBondContact O-N 2.97Å; T296-K298 VanDerWaalsContact O-N 3.16Å; T296-K298 PolarHBondContact OG1-N 3.36Å; K298-E300 VanDerWaalsContact C-N 3.27Å; K298-E300 PolarHBondContact O-N 2.94Å; K298-K301 PolarHBondContact O-N 2.84Å; K298-D302 WeakPolarHBondContact CE-OD2 3.35Å; K298-D302 WeakPolarHBondContact O-CB 3.5Å; K298-D302 VanDerWaalsContact O-CG 3.27Å; K298-D302 PolarHBondContact O-N 2.75Å
299	D	88.1	Confident	82.2	Confident	16 Å²	16	60.6 Å²	60.6	9%	0.086	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-41.1	174.5	-62.5	-62.8	0	0	0	110.9	L267 K287 F295 T296 F303	L267-D299 HydrophobicContact CD2-CB 4.31Å; K287-D299 IonicContact NZ-OD1 2.77Å; K287-D299 PolarHBondContact NZ-OD1 3.2Å; K287-D299 IonicContact NZ-OD2 3.62Å; F295-D299 HydrophobicContact CB-CB 4.33Å; F295-D299 HydrophobicContact CD1-CB 4.39Å; T296-D299 PolarHBondContact N-OD2 2.97Å; T296-D299 WeakPolarHBondContact O-CB 3.45Å; T296-D299 PolarHBondContact O-N 3.27Å; T296-D299 PolarHBondContact OG1-N 3.1Å; T296-D299 PolarHBondContact OG1-OD2 3.15Å; D299-F303 WeakPolarHBondContact O-CB 3.33Å; D299-F303 PolarHBondContact O-N 2.98Å
300	E	90.1	Very high	83.1	Confident	58 Å²	58	57 Å²	57	27%	0.271	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-47.6	175.9	-73.4	177.7	-159.3	0	0	112.6	N241 L267 M269 T296 K298 F303 A304	N241-E300 WeakPolarHBondContact CB-OE1 3.3Å; N241-E300 PolarHBondContact ND2-OE1 2.78Å; L267-E300 HydrophobicContact CD1-CG 3.84Å; M269-E300 HydrophobicContact CE-CB 3.74Å; M269-E300 HydrophobicContact CE-CG 3.8Å; T296-E300 PolarHBondContact O-N 3.14Å; K298-E300 VanDerWaalsContact C-N 3.27Å; K298-E300 PolarHBondContact O-N 2.94Å; E300-F303 PolarHBondContact O-N 2.89Å; E300-A304 VanDerWaalsContact O-CB 3.24Å; E300-A304 WeakPolarHBondContact O-CB 3.36Å; E300-A304 PolarHBondContact O-N 3.39Å
301	K	88.6	Confident	84.7	Confident	144 Å²	144	53.4 Å²	53.4	63%	0.626	30%	0.299	S	S	*	.	H	α-helix	trans	-65.6	-44.5	179.9	-74.6	176.7	-177.4	173	0	112.2	E297 K298 F303 A304 A305	E297-K301 WeakPolarHBondContact O-CG 3.25Å; E297-K301 PolarHBondContact O-N 3.34Å; E297-K301 VanDerWaalsContact O-N 3.13Å; K298-K301 PolarHBondContact O-N 2.84Å; K301-F303 VanDerWaalsContact C-N 3.34Å; K301-A304 PolarHBondContact O-N 2.76Å; K301-A305 VanDerWaalsContact O-CB 3.28Å; K301-A305 WeakPolarHBondContact O-CB 3.42Å; K301-A305 PolarHBondContact O-N 3.01Å
302	D	85.6	Confident	86.4	Confident	32 Å²	32	48.3 Å²	48.3	17%	0.171	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-39	-179.6	-67.7	-15.2	0	0	0	110.5	Q148 K298 Y306	Q148-D302 PolarHBondContact NE2-OD1 2.84Å; K298-D302 WeakPolarHBondContact CE-OD2 3.35Å; K298-D302 WeakPolarHBondContact O-CB 3.5Å; K298-D302 VanDerWaalsContact O-CG 3.27Å; K298-D302 PolarHBondContact O-N 2.75Å; D302-Y306 PolarHBondContact O-N 2.99Å
303	F	89.3	Confident	87.7	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.013	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-49.5	175.4	-155.5	178.1	0	0	0	111.7	I176 I180 L267 M269 A282 A284 D299 E300 K301 A305 Y306 L307	I176-F303 HydrophobicContact CB-CE2 4.34Å; I176-F303 HydrophobicContact CD1-CE2 3.71Å; I176-F303 HydrophobicContact CD1-CZ 4.28Å; I176-F303 HydrophobicContact CG1-CD2 4.47Å; I176-F303 HydrophobicContact CG1-CE2 3.74Å; I176-F303 HydrophobicContact CG2-CD2 4.38Å; I176-F303 HydrophobicContact CG2-CE2 3.6Å; I176-F303 HydrophobicContact CG2-CZ 3.84Å; I180-F303 HydrophobicContact CD1-CB 3.42Å; I180-F303 VanDerWaalsContact CD1-CB 3.42Å; I180-F303 HydrophobicContact CD1-CD1 3.37Å; I180-F303 HydrophobicContact CD1-CD2 3.58Å; I180-F303 HydrophobicContact CD1-CE1 3.91Å; I180-F303 HydrophobicContact CD1-CE2 4.08Å; I180-F303 HydrophobicContact CD1-CG 3.19Å; I180-F303 HydrophobicContact CD1-CZ 4.23Å; L267-F303 HydrophobicContact CD2-CD1 3.57Å; L267-F303 HydrophobicContact CD2-CE1 4.23Å; L267-F303 HydrophobicContact CG-CD1 3.84Å; L267-F303 HydrophobicContact CG-CE1 4.19Å; M269-F303 HydrophobicContact CB-CD1 4.15Å; M269-F303 HydrophobicContact CB-CE1 4.21Å; M269-F303 HydrophobicContact CG-CB 4.38Å; M269-F303 HydrophobicContact CG-CD1 3.47Å; M269-F303 VanDerWaalsContact CG-CD1 3.47Å; M269-F303 HydrophobicContact CG-CE1 3.95Å; M269-F303 HydrophobicContact CG-CG 3.98Å; A282-F303 HydrophobicContact CB-CE2 4.03Å; A282-F303 HydrophobicContact CB-CZ 3.64Å; A284-F303 HydrophobicContact CB-CE1 4.24Å; D299-F303 WeakPolarHBondContact O-CB 3.33Å; D299-F303 PolarHBondContact O-N 2.98Å; E300-F303 PolarHBondContact O-N 2.89Å; K301-F303 VanDerWaalsContact C-N 3.34Å; F303-A305 VanDerWaalsContact C-N 3.34Å; F303-A305 PolarHBondContact O-N 2.56Å; F303-Y306 PolarHBondContact O-N 3.18Å; F303-L307 HydrophobicContact CD2-CD1 3.56Å; F303-L307 HydrophobicContact CD2-CD2 4.25Å; F303-L307 HydrophobicContact CD2-CG 3.66Å; F303-L307 HydrophobicContact CE2-CD1 3.57Å; F303-L307 HydrophobicContact CE2-CD2 3.9Å; F303-L307 HydrophobicContact CE2-CG 3.78Å; F303-L307 HydrophobicContact CG-CD1 4.1Å; F303-L307 HydrophobicContact CZ-CD1 4.13Å; F303-L307 WeakPolarHBondContact O-CB 3.29Å; F303-L307 VanDerWaalsContact O-CG 3.29Å; F303-L307 WeakPolarHBondContact O-CG 3.49Å; F303-L307 PolarHBondContact O-N 3.44Å
304	A	89.4	Confident	88.6	Confident	45 Å²	45	46.7 Å²	46.7	37%	0.372	25%	0.25	S	S	.	.	H	α-helix	trans	-61.7	-42.2	-179.2	0	0	0	0	0	111.8	M269 E300 K301 Y306 L307 A308	M269-A304 HydrophobicContact SD-CB 4.41Å; E300-A304 VanDerWaalsContact O-CB 3.24Å; E300-A304 WeakPolarHBondContact O-CB 3.36Å; E300-A304 PolarHBondContact O-N 3.39Å; K301-A304 PolarHBondContact O-N 2.76Å; A304-Y306 VanDerWaalsContact C-N 3.33Å; A304-Y306 PolarHBondContact O-N 2.78Å; A304-L307 PolarHBondContact O-N 2.71Å; A304-A308 PolarHBondContact O-N 2.89Å
305	A	87.9	Confident	88.6	Confident	41 Å²	41	44.9 Å²	44.9	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-41.4	178.7	0	0	0	0	0	112.2	L152 K301 F303 F309	L152-A305 HydrophobicContact CD2-CB 4.38Å; K301-A305 VanDerWaalsContact O-CB 3.28Å; K301-A305 WeakPolarHBondContact O-CB 3.42Å; K301-A305 PolarHBondContact O-N 3.01Å; F303-A305 VanDerWaalsContact C-N 3.34Å; F303-A305 PolarHBondContact O-N 2.56Å; A305-F309 VanDerWaalsContact O-CD2 3.25Å; A305-F309 WeakPolarHBondContact O-CD2 3.45Å
306	Y	89	Confident	88.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-71.5	-44.9	177	-176.2	-120.9	0	0	0	112.3	L152 L155 I159 I172 H175 I176 L179 D302 F303 A304 A308 F309 C310	L152-Y306 HydrophobicContact CD1-CD2 3.76Å; L152-Y306 HydrophobicContact CD1-CG 4.31Å; L155-Y306 HydrophobicContact CB-CD2 4.44Å; L155-Y306 HydrophobicContact CB-CE2 3.79Å; L155-Y306 HydrophobicContact CD1-CE2 4.43Å; I159-Y306 HydrophobicContact CD1-CE2 4.34Å; I159-Y306 WeakPolarHBondContact CG2-OH 3.5Å; I172-Y306 HydrophobicContact CG2-CE1 4.27Å; H175-Y306 HydrophobicContact CB-CE1 3.65Å; H175-Y306 HydrophobicContact CB-CE2 4.38Å; H175-Y306 WeakPolarHBondContact CB-OH 3.46Å; H175-Y306 AromaticContact ND1-CZ 3.7Å; H175-Y306 PolarHBondContact ND1-OH 3.01Å; I176-Y306 HydrophobicContact CG1-CD1 4.02Å; I176-Y306 HydrophobicContact CG1-CE1 4.02Å; L179-Y306 HydrophobicContact CD1-CD1 3.66Å; L179-Y306 HydrophobicContact CD1-CD2 4.08Å; L179-Y306 HydrophobicContact CD1-CE1 4.34Å; L179-Y306 HydrophobicContact CD1-CG 3.52Å; D302-Y306 PolarHBondContact O-N 2.99Å; F303-Y306 PolarHBondContact O-N 3.18Å; A304-Y306 VanDerWaalsContact C-N 3.33Å; A304-Y306 PolarHBondContact O-N 2.78Å; Y306-A308 VanDerWaalsContact C-N 3.25Å; Y306-A308 PolarHBondContact O-N 3.44Å; Y306-F309 PolarHBondContact O-N 2.89Å; Y306-F309 VanDerWaalsContact O-N 3.09Å; Y306-C310 WeakPolarHBondContact CE1-SG 3.36Å; Y306-C310 PolarHBondContact O-N 2.81Å; Y306-C310 VanDerWaalsContact O-N 3.15Å; Y306-C310 PolarHBondContact O-SG 2.97Å; Y306-C310 VanDerWaalsContact O-SG 3.38Å
307	L	91	Very high	88.3	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-27.5	-178.4	-69.5	179.6	0	0	0	113.5	I176 M269 I271 A282 F303 A304 F309 C310 G311	I176-L307 HydrophobicContact CD1-CD2 4.18Å; M269-L307 HydrophobicContact CB-CD1 3.36Å; M269-L307 HydrophobicContact CG-CD1 4.19Å; I271-L307 HydrophobicContact CD1-CD2 3.85Å; I271-L307 HydrophobicContact CG1-CB 4.46Å; I271-L307 HydrophobicContact CG1-CD1 4.25Å; I271-L307 HydrophobicContact CG1-CD2 3.92Å; I271-L307 HydrophobicContact CG1-CG 4.43Å; A282-L307 HydrophobicContact CB-CD1 3.92Å; A282-L307 HydrophobicContact CB-CD2 4.03Å; F303-L307 HydrophobicContact CD2-CD1 3.56Å; F303-L307 HydrophobicContact CD2-CD2 4.25Å; F303-L307 HydrophobicContact CD2-CG 3.66Å; F303-L307 HydrophobicContact CE2-CD1 3.57Å; F303-L307 HydrophobicContact CE2-CD2 3.9Å; F303-L307 HydrophobicContact CE2-CG 3.78Å; F303-L307 HydrophobicContact CG-CD1 4.1Å; F303-L307 HydrophobicContact CZ-CD1 4.13Å; F303-L307 WeakPolarHBondContact O-CB 3.29Å; F303-L307 VanDerWaalsContact O-CG 3.29Å; F303-L307 WeakPolarHBondContact O-CG 3.49Å; F303-L307 PolarHBondContact O-N 3.44Å; A304-L307 PolarHBondContact O-N 2.71Å; L307-F309 VanDerWaalsContact C-N 3.26Å; L307-F309 PolarHBondContact O-N 2.89Å; L307-C310 HydrophobicContact CD2-CB 4.34Å; L307-C310 PolarHBondContact O-N 3.24Å; L307-G311 PolarHBondContact O-N 3.05Å
308	A	87.6	Confident	88.1	Confident	55 Å²	55	39.7 Å²	39.7	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-57.3	-40.3	173	0	0	0	0	0	112	A304 Y306	A304-A308 PolarHBondContact O-N 2.89Å; Y306-A308 VanDerWaalsContact C-N 3.25Å; Y306-A308 PolarHBondContact O-N 3.44Å
309	F	87.9	Confident	87.9	Confident	79 Å²	79	37.7 Å²	37.7	35%	0.346	21%	0.207	S	C	.	.	H	α-helix	trans	-76.6	-40.2	174.8	-64.9	-77.5	0	0	0	111.9	L152 V156 A305 Y306 L307 G311 I312 V313	L152-F309 HydrophobicContact CD2-CD2 4.35Å; L152-F309 HydrophobicContact CD2-CE2 3.84Å; L152-F309 HydrophobicContact CG-CE2 4.44Å; V156-F309 HydrophobicContact CG1-CB 4.27Å; V156-F309 HydrophobicContact CG1-CD1 4.04Å; V156-F309 HydrophobicContact CG1-CG 4.25Å; V156-F309 HydrophobicContact CG2-CB 3.59Å; V156-F309 HydrophobicContact CG2-CD1 4Å; V156-F309 HydrophobicContact CG2-CD2 3.7Å; V156-F309 HydrophobicContact CG2-CE2 4.38Å; V156-F309 HydrophobicContact CG2-CG 3.48Å; V156-F309 VanDerWaalsContact CG2-CG 3.48Å; A305-F309 VanDerWaalsContact O-CD2 3.25Å; A305-F309 WeakPolarHBondContact O-CD2 3.45Å; Y306-F309 PolarHBondContact O-N 2.89Å; Y306-F309 VanDerWaalsContact O-N 3.09Å; L307-F309 VanDerWaalsContact C-N 3.26Å; L307-F309 PolarHBondContact O-N 2.89Å; F309-G311 PolarHBondContact O-N 3.32Å; F309-I312 PolarHBondContact O-N 2.96Å; F309-V313 WeakPolarHBondContact O-CG2 3.49Å; F309-V313 PolarHBondContact O-N 3.36Å
310	C	90.2	Very high	87.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.6	-38.9	176.1	-63.2	0	0	0	0	112.1	I172 Y306 L307 I312 V313 L314	I172-C310 HydrophobicContact CD1-CB 3.96Å; I172-C310 HydrophobicContact CG1-CB 4.37Å; I172-C310 HydrophobicContact CG2-CB 4.43Å; Y306-C310 WeakPolarHBondContact CE1-SG 3.36Å; Y306-C310 PolarHBondContact O-N 2.81Å; Y306-C310 VanDerWaalsContact O-N 3.15Å; Y306-C310 PolarHBondContact O-SG 2.97Å; Y306-C310 VanDerWaalsContact O-SG 3.38Å; L307-C310 HydrophobicContact CD2-CB 4.34Å; L307-C310 PolarHBondContact O-N 3.24Å; C310-I312 PolarHBondContact O-N 3.22Å; C310-V313 PolarHBondContact O-N 3.2Å; C310-L314 HydrophobicContact CB-CD1 4.42Å; C310-L314 WeakPolarHBondContact O-CB 3.33Å; C310-L314 VanDerWaalsContact O-CG 3.3Å; C310-L314 WeakPolarHBondContact O-CG 3.15Å; C310-L314 PolarHBondContact O-N 3Å
311	G	88.9	Confident	87.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-34.3	-179.8	0	0	0	0	0	114.1	K272 L307 F309 H315	K272-G311 WeakPolarHBondContact O-CA 3.38Å; L307-G311 PolarHBondContact O-N 3.05Å; F309-G311 PolarHBondContact O-N 3.32Å; G311-H315 WeakPolarHBondContact O-CB 3.42Å; G311-H315 PolarHBondContact O-N 3.12Å
312	I	88.4	Confident	86.5	Confident	68 Å²	68	39.1 Å²	39.1	35%	0.349	22%	0.216	S	C	.	.	H	α-helix	trans	-66.6	-47.8	173.2	-59.7	170.4	0	0	0	110.2	F309 C310 H315 N316	F309-I312 PolarHBondContact O-N 2.96Å; C310-I312 PolarHBondContact O-N 3.22Å; I312-H315 PolarHBondContact O-N 2.96Å; I312-N316 VanDerWaalsContact O-CG 3.32Å; I312-N316 PolarHBondContact O-N 3.09Å; I312-N316 VanDerWaalsContact O-N 3.1Å; I312-N316 PolarHBondContact O-ND2 3.11Å
313	V	89.5	Confident	86.1	Confident	19 Å²	19	40.8 Å²	40.8	12%	0.115	23%	0.23	C	C	.	.	H	α-helix	trans	-69.2	-42.8	-176.6	-176.6	0	0	0	0	111.3	I159 L168 F309 C310 N316 A317	I159-V313 HydrophobicContact CD1-CB 4.48Å; I159-V313 HydrophobicContact CD1-CG2 4.16Å; I159-V313 HydrophobicContact CG1-CG2 4.26Å; I159-V313 WeakPolarHBondContact O-CG1 3.25Å; L168-V313 HydrophobicContact CD1-CG1 3.8Å; L168-V313 HydrophobicContact CD2-CG1 3.74Å; L168-V313 HydrophobicContact CG-CG1 4.44Å; F309-V313 WeakPolarHBondContact O-CG2 3.49Å; F309-V313 PolarHBondContact O-N 3.36Å; C310-V313 PolarHBondContact O-N 3.2Å; V313-N316 PolarHBondContact O-N 3.4Å; V313-A317 PolarHBondContact O-N 3.27Å
314	L	88.4	Confident	85.4	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-43.1	175.9	-78.9	167.4	0	0	0	111.8	L168 I172 L189 I271 C310 N316 A317 Q318	L168-L314 HydrophobicContact CD2-CD2 3.72Å; L168-L314 HydrophobicContact CD2-CG 4.13Å; L168-L314 HydrophobicContact CG-CD2 3.97Å; I172-L314 HydrophobicContact CD1-CD1 3.67Å; I172-L314 HydrophobicContact CD1-CD2 3.86Å; I172-L314 HydrophobicContact CD1-CG 3.62Å; L189-L314 HydrophobicContact CD2-CD1 4.47Å; L189-L314 HydrophobicContact CD2-CD2 4.3Å; I271-L314 HydrophobicContact CD1-CD1 4Å; I271-L314 HydrophobicContact CG2-CD1 4.13Å; C310-L314 HydrophobicContact CB-CD1 4.42Å; C310-L314 WeakPolarHBondContact O-CB 3.33Å; C310-L314 VanDerWaalsContact O-CG 3.3Å; C310-L314 WeakPolarHBondContact O-CG 3.15Å; C310-L314 PolarHBondContact O-N 3Å; L314-N316 VanDerWaalsContact C-N 3.33Å; L314-N316 PolarHBondContact O-N 2.92Å; L314-A317 PolarHBondContact O-N 3.47Å; L314-Q318 WeakPolarHBondContact O-CB 3.44Å; L314-Q318 WeakPolarHBondContact O-CG 3.47Å; L314-Q318 PolarHBondContact O-N 3.46Å
315	H	87.7	Confident	84.5	Confident	24 Å²	24	45.4 Å²	45.4	11%	0.111	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-44.3	176.4	-173.2	54.2	0	0	0	111.4	N273 V279 G311 I312 Q318 L319	N273-H315 HydrophobicContact CB-CB 4.08Å; V279-H315 HydrophobicContact CG1-CB 4.26Å; G311-H315 WeakPolarHBondContact O-CB 3.42Å; G311-H315 PolarHBondContact O-N 3.12Å; I312-H315 PolarHBondContact O-N 2.96Å; H315-Q318 PolarHBondContact O-N 3.24Å; H315-L319 WeakPolarHBondContact O-CB 3.37Å; H315-L319 VanDerWaalsContact O-CG 3.3Å; H315-L319 WeakPolarHBondContact O-CG 3.45Å; H315-L319 PolarHBondContact O-N 2.96Å
316	N	86.9	Confident	83.6	Confident	82 Å²	82	48 Å²	48	44%	0.439	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-41.2	177.6	-71.6	-15.7	0	0	0	112.5	I312 V313 L314 L319 Y320	I312-N316 VanDerWaalsContact O-CG 3.32Å; I312-N316 PolarHBondContact O-N 3.09Å; I312-N316 VanDerWaalsContact O-N 3.1Å; I312-N316 PolarHBondContact O-ND2 3.11Å; V313-N316 PolarHBondContact O-N 3.4Å; L314-N316 VanDerWaalsContact C-N 3.33Å; L314-N316 PolarHBondContact O-N 2.92Å; N316-L319 PolarHBondContact O-N 3.08Å; N316-Y320 WeakPolarHBondContact O-CB 3.31Å; N316-Y320 PolarHBondContact O-N 3.31Å
317	A	86.6	Confident	82.9	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-43.5	176.3	0	0	0	0	0	111.8	V165 L168 V313 L314 Y320 E321	V165-A317 HydrophobicContact CG2-CB 3.87Å; L168-A317 HydrophobicContact CD2-CB 3.66Å; V313-A317 PolarHBondContact O-N 3.27Å; L314-A317 PolarHBondContact O-N 3.47Å; A317-Y320 PolarHBondContact O-N 3.23Å; A317-E321 PolarHBondContact O-N 3.34Å
318	Q	83.5	Confident	81.9	Confident	31 Å²	31	58.2 Å²	58.2	15%	0.145	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-41.9	175.1	-74	174.9	-32.3	0	0	112.4	V165 L314 H315 Y320 E321 T322	V165-Q318 HydrophobicContact CG2-CG 4.21Å; L314-Q318 WeakPolarHBondContact O-CB 3.44Å; L314-Q318 WeakPolarHBondContact O-CG 3.47Å; L314-Q318 PolarHBondContact O-N 3.46Å; H315-Q318 PolarHBondContact O-N 3.24Å; Q318-Y320 VanDerWaalsContact C-N 3.33Å; Q318-E321 PolarHBondContact O-N 3.46Å; Q318-T322 WeakPolarHBondContact O-CB 3.14Å; Q318-T322 PolarHBondContact O-N 3.26Å; Q318-T322 PolarHBondContact O-OG1 3.36Å
319	L	81.9	Confident	81.2	Confident	91 Å²	91	60.2 Å²	60.2	48%	0.476	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-40.9	174.8	-75.4	175.3	0	0	0	111.6	H315 N316 S323	H315-L319 WeakPolarHBondContact O-CB 3.37Å; H315-L319 VanDerWaalsContact O-CG 3.3Å; H315-L319 WeakPolarHBondContact O-CG 3.45Å; H315-L319 PolarHBondContact O-N 2.96Å; N316-L319 PolarHBondContact O-N 3.08Å; L319-S323 VanDerWaalsContact O-CB 3.29Å; L319-S323 WeakPolarHBondContact O-CB 3.32Å; L319-S323 PolarHBondContact O-N 2.89Å
320	Y	83.4	Confident	80.5	Confident	111 Å²	111	60.1 Å²	60.1	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-46.6	177.2	-178.4	-103.9	0	0	0	112	L163 N316 A317 Q318 T322 S323 L324	L163-Y320 HydrophobicContact CB-CD1 3.99Å; L163-Y320 HydrophobicContact CB-CE1 4.23Å; L163-Y320 HydrophobicContact CD1-CD1 4.36Å; L163-Y320 HydrophobicContact CD1-CE1 4.21Å; N316-Y320 WeakPolarHBondContact O-CB 3.31Å; N316-Y320 PolarHBondContact O-N 3.31Å; A317-Y320 PolarHBondContact O-N 3.23Å; Q318-Y320 VanDerWaalsContact C-N 3.33Å; Y320-T322 VanDerWaalsContact C-N 3.35Å; Y320-T322 PolarHBondContact O-N 2.96Å; Y320-S323 PolarHBondContact O-N 3.28Å; Y320-L324 HydrophobicContact CD1-CD1 3.92Å; Y320-L324 HydrophobicContact CD1-CG 4.42Å; Y320-L324 HydrophobicContact CE1-CD1 3.34Å; Y320-L324 HydrophobicContact CE1-CG 4.03Å; Y320-L324 HydrophobicContact CE2-CG 4.38Å; Y320-L324 WeakPolarHBondContact O-CG 3.42Å; Y320-L324 PolarHBondContact O-N 3.31Å
321	E	78.6	Confident	79.9	Confident	63 Å²	63	64.8 Å²	64.8	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-58.3	-46.5	175.4	-172	-179	-154.9	0	0	111.1	V165 R203 A317 Q318 S323 L324 L325	V165-E321 HydrophobicContact CG2-CB 4.42Å; V165-E321 WeakPolarHBondContact CG2-OE2 3.11Å; R203-E321 IonicContact NH2-OE1 3.23Å; R203-E321 IonicContact NH2-OE2 2.73Å; A317-E321 PolarHBondContact O-N 3.34Å; Q318-E321 PolarHBondContact O-N 3.46Å; E321-S323 PolarHBondContact O-N 3.45Å; E321-L324 PolarHBondContact O-N 3.19Å; E321-L325 WeakPolarHBondContact O-CG 3.34Å; E321-L325 PolarHBondContact O-N 2.93Å; E321-L325 VanDerWaalsContact O-N 3.08Å
322	T	74.9	Confident	79.3	Confident	74 Å²	74	65.9 Å²	65.9	45%	0.454	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-45.5	177	-54.5	0	0	0	0	111.5	Q318 Y320 L324 L325 E326	Q318-T322 WeakPolarHBondContact O-CB 3.14Å; Q318-T322 PolarHBondContact O-N 3.26Å; Q318-T322 PolarHBondContact O-OG1 3.36Å; Y320-T322 VanDerWaalsContact C-N 3.35Å; Y320-T322 PolarHBondContact O-N 2.96Å; T322-L324 PolarHBondContact O-N 2.77Å; T322-L325 PolarHBondContact O-N 2.98Å; T322-E326 WeakPolarHBondContact O-CG 3.35Å; T322-E326 PolarHBondContact O-N 3.49Å
323	S	76.1	Confident	78.8	Confident	66 Å²	66	63.3 Å²	63.3	46%	0.462	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-40	178	-179.7	0	0	0	0	112.8	L319 Y320 E321 E326 N327	L319-S323 VanDerWaalsContact O-CB 3.29Å; L319-S323 WeakPolarHBondContact O-CB 3.32Å; L319-S323 PolarHBondContact O-N 2.89Å; Y320-S323 PolarHBondContact O-N 3.28Å; E321-S323 PolarHBondContact O-N 3.45Å; S323-E326 PolarHBondContact O-N 3.29Å; S323-N327 WeakPolarHBondContact O-CB 3.23Å; S323-N327 PolarHBondContact O-N 3.18Å
324	L	76.1	Confident	78.4	Confident	70 Å²	70	66 Å²	66	37%	0.366	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-41.1	175.1	-75.4	179.8	0	0	0	112.2	Y320 E321 T322 N327 K328	Y320-L324 HydrophobicContact CD1-CD1 3.92Å; Y320-L324 HydrophobicContact CD1-CG 4.42Å; Y320-L324 HydrophobicContact CE1-CD1 3.34Å; Y320-L324 HydrophobicContact CE1-CG 4.03Å; Y320-L324 HydrophobicContact CE2-CG 4.38Å; Y320-L324 WeakPolarHBondContact O-CG 3.42Å; Y320-L324 PolarHBondContact O-N 3.31Å; E321-L324 PolarHBondContact O-N 3.19Å; T322-L324 PolarHBondContact O-N 2.77Å; L324-N327 PolarHBondContact O-N 3.12Å; L324-K328 WeakPolarHBondContact O-CG 3.47Å; L324-K328 PolarHBondContact O-N 2.83Å
325	L	70.1	Confident	77.8	Confident	75 Å²	75	69.3 Å²	69.3	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-43	176.4	-70.2	170.4	0	0	0	111.5	L125 E321 T322 N327 K328 R329	L125-L325 HydrophobicContact CD2-CD2 4.13Å; E321-L325 WeakPolarHBondContact O-CG 3.34Å; E321-L325 PolarHBondContact O-N 2.93Å; E321-L325 VanDerWaalsContact O-N 3.08Å; T322-L325 PolarHBondContact O-N 2.98Å; L325-N327 PolarHBondContact O-N 2.88Å; L325-K328 PolarHBondContact O-N 2.69Å; L325-R329 PolarHBondContact O-N 3.33Å
326	E	69.7	Low	77.4	Confident	97 Å²	97	69.2 Å²	69.2	45%	0.453	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-41.5	174.4	-72.7	-172.6	155.1	0	0	112.4	T322 S323 R329 N330	T322-E326 WeakPolarHBondContact O-CG 3.35Å; T322-E326 PolarHBondContact O-N 3.49Å; S323-E326 PolarHBondContact O-N 3.29Å; E326-R329 WeakPolarHBondContact O-CB 3.26Å; E326-R329 PolarHBondContact O-N 2.9Å; E326-N330 VanDerWaalsContact O-CG 3.27Å; E326-N330 PolarHBondContact O-N 2.94Å; E326-N330 PolarHBondContact O-ND2 2.73Å
327	N	73.1	Confident	77.1	Confident	85 Å²	85	65.5 Å²	65.5	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-46.5	177.4	-165.4	-29.2	0	0	0	111.1	S323 L324 L325 R329 N330 Q331	S323-N327 WeakPolarHBondContact O-CB 3.23Å; S323-N327 PolarHBondContact O-N 3.18Å; L324-N327 PolarHBondContact O-N 3.12Å; L325-N327 PolarHBondContact O-N 2.88Å; N327-R329 VanDerWaalsContact C-N 3.32Å; N327-R329 PolarHBondContact O-N 3.44Å; N327-N330 PolarHBondContact O-N 3.06Å; N327-N330 VanDerWaalsContact O-N 3.13Å; N327-Q331 WeakPolarHBondContact O-CG 3.36Å; N327-Q331 PolarHBondContact O-N 3.3Å
328	K	71.2	Confident	76.9	Confident	131 Å²	131	67.3 Å²	67.3	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-57.7	-43.2	174.5	-74.5	174.4	-177.9	176.4	0	111.9	L324 L325 N330 Q331 V332	L324-K328 WeakPolarHBondContact O-CG 3.47Å; L324-K328 PolarHBondContact O-N 2.83Å; L325-K328 PolarHBondContact O-N 2.69Å; K328-N330 VanDerWaalsContact C-N 3.33Å; K328-N330 PolarHBondContact O-N 3.33Å; K328-Q331 PolarHBondContact O-N 3.18Å; K328-V332 PolarHBondContact O-N 2.85Å
329	R	71.1	Confident	76.7	Confident	97 Å²	97	69.8 Å²	69.8	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-58.9	-44.3	175.3	-176.7	-179.1	67.5	177	-5.2	111.8	L325 E326 N327 V332 L333	L325-R329 PolarHBondContact O-N 3.33Å; E326-R329 WeakPolarHBondContact O-CB 3.26Å; E326-R329 PolarHBondContact O-N 2.9Å; N327-R329 VanDerWaalsContact C-N 3.32Å; N327-R329 PolarHBondContact O-N 3.44Å; R329-V332 PolarHBondContact O-N 3.38Å; R329-L333 PolarHBondContact O-N 2.67Å
330	N	73.1	Confident	76.6	Confident	78 Å²	78	65.5 Å²	65.5	42%	0.417	33%	0.331	S	S	.	.	H	α-helix	trans	-67.5	-36.3	179.5	-68.8	-17.3	0	0	0	112.5	E326 N327 K328 L333 L334	E326-N330 VanDerWaalsContact O-CG 3.27Å; E326-N330 PolarHBondContact O-N 2.94Å; E326-N330 PolarHBondContact O-ND2 2.73Å; N327-N330 PolarHBondContact O-N 3.06Å; N327-N330 VanDerWaalsContact O-N 3.13Å; K328-N330 VanDerWaalsContact C-N 3.33Å; K328-N330 PolarHBondContact O-N 3.33Å; N330-L333 PolarHBondContact O-N 3.3Å; N330-L334 WeakPolarHBondContact O-CG 3.46Å; N330-L334 PolarHBondContact O-N 2.86Å; N330-L334 VanDerWaalsContact O-N 3.07Å
331	Q	77.9	Confident	76.4	Confident	97 Å²	97	63.5 Å²	63.5	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-60	-47.3	174.7	-69.9	-65	-30.2	0	0	111.4	N327 K328 L333 L334 D335	N327-Q331 WeakPolarHBondContact O-CG 3.36Å; N327-Q331 PolarHBondContact O-N 3.3Å; K328-Q331 PolarHBondContact O-N 3.18Å; Q331-L333 VanDerWaalsContact C-N 3.31Å; Q331-L333 PolarHBondContact O-N 3.19Å; Q331-L334 WeakPolarHBondContact O-CB 3.48Å; Q331-L334 PolarHBondContact O-N 2.83Å; Q331-D335 PolarHBondContact O-N 2.83Å
332	V	76.2	Confident	76.3	Confident	24 Å²	24	67.1 Å²	67.1	15%	0.145	34%	0.342	C	S	.	.	H	α-helix	trans	-59	-42.9	177.3	175	0	0	0	0	111.4	K328 R329 L334 D335 L336 F361	K328-V332 PolarHBondContact O-N 2.85Å; R329-V332 PolarHBondContact O-N 3.38Å; V332-L334 VanDerWaalsContact C-N 3.29Å; V332-L334 PolarHBondContact O-N 3.26Å; V332-D335 PolarHBondContact O-N 2.91Å; V332-L336 HydrophobicContact CG1-CD1 4.17Å; V332-L336 HydrophobicContact CG1-CG 4.39Å; V332-L336 VanDerWaalsContact O-CG 3.26Å; V332-L336 WeakPolarHBondContact O-CG 3.45Å; V332-L336 PolarHBondContact O-N 2.85Å; V332-F361 HydrophobicContact CG1-CE2 3.69Å; V332-F361 HydrophobicContact CG1-CZ 3.88Å
333	L	79.1	Confident	75.8	Confident	14 Å²	14	68.4 Å²	68.4	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-60.5	-38.7	176.2	-75.4	169.8	0	0	0	112.5	R329 N330 Q331 A337 F491 A494 F495 F498	R329-L333 PolarHBondContact O-N 2.67Å; N330-L333 PolarHBondContact O-N 3.3Å; Q331-L333 VanDerWaalsContact C-N 3.31Å; Q331-L333 PolarHBondContact O-N 3.19Å; L333-A337 VanDerWaalsContact O-CB 3.31Å; L333-A337 WeakPolarHBondContact O-CB 3.39Å; L333-A337 PolarHBondContact O-N 2.83Å; L333-F491 HydrophobicContact CD2-CD2 3.79Å; L333-F491 HydrophobicContact CD2-CE2 3.4Å; L333-F491 VanDerWaalsContact CD2-CE2 3.4Å; L333-F491 HydrophobicContact CD2-CZ 4.09Å; L333-F491 HydrophobicContact CG-CE2 4.26Å; L333-A494 HydrophobicContact CD1-CB 4.01Å; L333-A494 HydrophobicContact CD2-CB 4.36Å; L333-F495 HydrophobicContact CD2-CB 4.47Å; L333-F495 HydrophobicContact CD2-CD2 4.42Å; L333-F498 HydrophobicContact CB-CE2 4.46Å
334	L	79.7	Confident	75.3	Confident	74 Å²	74	67.8 Å²	67.8	39%	0.387	33%	0.333	S	S	.	.	H	α-helix	trans	-70.6	-38.8	178	-70.3	172.6	0	0	0	112.4	N330 Q331 V332 A337 S338 F498	N330-L334 WeakPolarHBondContact O-CG 3.46Å; N330-L334 PolarHBondContact O-N 2.86Å; N330-L334 VanDerWaalsContact O-N 3.07Å; Q331-L334 WeakPolarHBondContact O-CB 3.48Å; Q331-L334 PolarHBondContact O-N 2.83Å; V332-L334 VanDerWaalsContact C-N 3.29Å; V332-L334 PolarHBondContact O-N 3.26Å; L334-A337 PolarHBondContact O-N 2.94Å; L334-S338 WeakPolarHBondContact O-CB 3.46Å; L334-S338 PolarHBondContact O-N 3.41Å; L334-S338 PolarHBondContact O-OG 3.33Å; L334-F498 HydrophobicContact CD2-CZ 4.45Å
335	D	77.1	Confident	75	Confident	71 Å²	71	71.6 Å²	71.6	38%	0.38	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-45.5	175.7	-69	-19.9	0	0	0	110.4	Q331 V332 A337 S338 L339	Q331-D335 PolarHBondContact O-N 2.83Å; V332-D335 PolarHBondContact O-N 2.91Å; D335-A337 VanDerWaalsContact C-N 3.34Å; D335-A337 PolarHBondContact O-N 2.94Å; D335-S338 WeakPolarHBondContact O-CB 3.44Å; D335-S338 PolarHBondContact O-N 3.12Å; D335-L339 PolarHBondContact O-N 3.12Å
336	L	78.8	Confident	75.7	Confident	22 Å²	22	69.6 Å²	69.6	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-37.6	175.9	-63.4	179.8	0	0	0	112.3	V332 S338 L339 I340 T357 F361 F491 F495	V332-L336 HydrophobicContact CG1-CD1 4.17Å; V332-L336 HydrophobicContact CG1-CG 4.39Å; V332-L336 VanDerWaalsContact O-CG 3.26Å; V332-L336 WeakPolarHBondContact O-CG 3.45Å; V332-L336 PolarHBondContact O-N 2.85Å; L336-S338 VanDerWaalsContact C-N 3.33Å; L336-L339 HydrophobicContact CD2-CD1 4.25Å; L336-L339 PolarHBondContact O-N 3.24Å; L336-I340 PolarHBondContact O-N 2.91Å; L336-T357 HydrophobicContact CB-CG2 4.26Å; L336-T357 HydrophobicContact CD1-CG2 4.38Å; L336-T357 HydrophobicContact CD2-CG2 3.7Å; L336-T357 HydrophobicContact CG-CG2 4.32Å; L336-F361 HydrophobicContact CD1-CD1 4.37Å; L336-F361 HydrophobicContact CD1-CD2 3.99Å; L336-F361 HydrophobicContact CD1-CE2 4.22Å; L336-F361 HydrophobicContact CD1-CG 4.07Å; L336-F491 HydrophobicContact CD1-CE2 4.2Å; L336-F491 HydrophobicContact CD1-CZ 3.68Å; L336-F495 HydrophobicContact CB-CD2 4.39Å; L336-F495 HydrophobicContact CB-CE2 3.58Å; L336-F495 HydrophobicContact CB-CZ 4.3Å; L336-F495 HydrophobicContact CD1-CE2 4.34Å
337	A	81.9	Confident	76.5	Confident	4 Å²	4	66.3 Å²	66.3	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-42	173.7	0	0	0	0	0	111	L333 L334 D335 L339 I340 F341 F498	L333-A337 VanDerWaalsContact O-CB 3.31Å; L333-A337 WeakPolarHBondContact O-CB 3.39Å; L333-A337 PolarHBondContact O-N 2.83Å; L334-A337 PolarHBondContact O-N 2.94Å; D335-A337 VanDerWaalsContact C-N 3.34Å; D335-A337 PolarHBondContact O-N 2.94Å; A337-L339 VanDerWaalsContact C-N 3.3Å; A337-L339 PolarHBondContact O-N 2.89Å; A337-I340 WeakPolarHBondContact O-CB 3.4Å; A337-I340 PolarHBondContact O-N 3.44Å; A337-F341 HydrophobicContact CB-CD2 4.38Å; A337-F341 HydrophobicContact CB-CE2 4.29Å; A337-F341 WeakPolarHBondContact O-CD2 3.29Å; A337-F341 PolarHBondContact O-N 2.94Å; A337-F341 VanDerWaalsContact O-N 3.11Å; A337-F498 HydrophobicContact CB-CB 4.08Å; A337-F498 HydrophobicContact CB-CD1 3.71Å; A337-F498 HydrophobicContact CB-CD2 4.22Å; A337-F498 HydrophobicContact CB-CE1 4.16Å; A337-F498 HydrophobicContact CB-CG 3.74Å
338	S	82	Confident	77.1	Confident	38 Å²	38	65.7 Å²	65.7	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-59.3	-41.2	179.1	-57.6	0	0	0	0	111.7	L334 D335 L336 I340 F341 E342	L334-S338 WeakPolarHBondContact O-CB 3.46Å; L334-S338 PolarHBondContact O-N 3.41Å; L334-S338 PolarHBondContact O-OG 3.33Å; D335-S338 WeakPolarHBondContact O-CB 3.44Å; D335-S338 PolarHBondContact O-N 3.12Å; L336-S338 VanDerWaalsContact C-N 3.33Å; S338-I340 PolarHBondContact O-N 3.26Å; S338-F341 PolarHBondContact O-N 2.8Å; S338-E342 WeakPolarHBondContact O-CG 3.45Å; S338-E342 PolarHBondContact O-N 3.5Å
339	L	79.1	Confident	77.7	Confident	84 Å²	84	61.8 Å²	61.8	44%	0.44	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-32.7	174.4	-66.5	172.4	0	0	0	113.6	D335 L336 A337	D335-L339 PolarHBondContact O-N 3.12Å; L336-L339 HydrophobicContact CD2-CD1 4.25Å; L336-L339 PolarHBondContact O-N 3.24Å; A337-L339 VanDerWaalsContact C-N 3.3Å; A337-L339 PolarHBondContact O-N 2.89Å
340	I	80.4	Confident	78.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-74.2	-35.3	175.7	-66	168	0	0	0	110.9	L336 A337 S338 I350 I354 F495	L336-I340 PolarHBondContact O-N 2.91Å; A337-I340 WeakPolarHBondContact O-CB 3.4Å; A337-I340 PolarHBondContact O-N 3.44Å; S338-I340 PolarHBondContact O-N 3.26Å; I340-I350 HydrophobicContact CG2-CD1 3.77Å; I340-I350 HydrophobicContact CG2-CG1 3.72Å; I340-I354 HydrophobicContact CD1-CG1 3.78Å; I340-I354 HydrophobicContact CG1-CG1 3.96Å; I340-I354 HydrophobicContact CG2-CD1 4.4Å; I340-I354 HydrophobicContact CG2-CG1 4.09Å; I340-F495 HydrophobicContact CD1-CE1 4.02Å; I340-F495 HydrophobicContact CD1-CE2 3.82Å; I340-F495 HydrophobicContact CD1-CZ 3.33Å; I340-F495 HydrophobicContact CG1-CZ 4.42Å
341	F	78.8	Confident	79.3	Confident	69 Å²	69	53.7 Å²	53.7	30%	0.303	27%	0.272	S	S	.	.	H	α-helix	trans	-88.6	-15.6	-173.4	-72.2	-66.5	0	0	0	115	A337 S338 E343 F498 L501	A337-F341 HydrophobicContact CB-CD2 4.38Å; A337-F341 HydrophobicContact CB-CE2 4.29Å; A337-F341 WeakPolarHBondContact O-CD2 3.29Å; A337-F341 PolarHBondContact O-N 2.94Å; A337-F341 VanDerWaalsContact O-N 3.11Å; S338-F341 PolarHBondContact O-N 2.8Å; F341-E343 PolarHBondContact O-N 2.83Å; F341-F498 HydrophobicContact CE2-CB 4.41Å; F341-F498 HydrophobicContact CE2-CD1 4.36Å; F341-L501 HydrophobicContact CE1-CB 4.39Å; F341-L501 HydrophobicContact CZ-CB 3.92Å
342	E	74.9	Confident	79.8	Confident	140 Å²	140	53 Å²	53	65%	0.654	27%	0.267	S	S	*	.	S	Bend	trans	-63.7	-32.5	-175.9	-87.4	176.2	178.1	0	0	114.9	S338	S338-E342 WeakPolarHBondContact O-CG 3.45Å; S338-E342 PolarHBondContact O-N 3.5Å
343	E	65.4	Low	80.3	Confident	101 Å²	101	54.2 Å²	54.2	47%	0.472	27%	0.27	S	S	.	.			trans	-139.9	102.5	179.3	-56.7	174	143.6	0	0	111.9	F341 K353	F341-E343 PolarHBondContact O-N 2.83Å; E343-K353 IonicContact OE2-NZ 3.68Å; E343-K353 PolarHBondContact OE2-NZ 3.18Å
344	Q	65.9	Low	80.8	Confident	53 Å²	53	53.6 Å²	53.6	25%	0.248	27%	0.267	C	S	.	.			trans	-104.7	65.4	-179.8	-59.8	-167.1	-36	0	0	111.7
345	Q	69.8	Low	81.3	Confident	149 Å²	149	50.1 Å²	50.1	70%	0.696	25%	0.249	S	C	*	.	S	Bend	trans	-87.4	-34	-177.9	-66	-175.8	-0.6	0	0	113.9
346	S	84.6	Confident	81.8	Confident	34 Å²	34	48 Å²	48	24%	0.238	24%	0.241	C	C	.	.			trans	-159.9	158.6	178.4	63.7	0	0	0	0	111.2	E348 V349 I350 E510	S346-E348 PolarHBondContact O-N 3.4Å; S346-V349 PolarHBondContact O-N 3.33Å; S346-V349 VanDerWaalsContact OG-CG2 3.3Å; S346-V349 WeakPolarHBondContact OG-CG2 3.22Å; S346-V349 PolarHBondContact OG-N 3.48Å; S346-I350 PolarHBondContact O-N 2.9Å; S346-E510 WeakPolarHBondContact CA-OE1 3.49Å
347	L	86.4	Confident	82.2	Confident	27 Å²	27	47.9 Å²	47.9	14%	0.141	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-33.4	178.4	178.2	59.5	0	0	0	111.4	I350 L351 I503 T506 Q507 E510	L347-I350 HydrophobicContact CD1-CG2 4.19Å; L347-I350 WeakPolarHBondContact O-CG2 3.11Å; L347-L351 HydrophobicContact CD1-CD1 4.06Å; L347-L351 HydrophobicContact CD1-CG 4.15Å; L347-L351 HydrophobicContact CG-CD1 3.91Å; L347-L351 HydrophobicContact CG-CG 4.43Å; L347-L351 WeakPolarHBondContact O-CB 3.45Å; L347-L351 WeakPolarHBondContact O-CD1 3.48Å; L347-L351 WeakPolarHBondContact O-CG 3.46Å; L347-L351 PolarHBondContact O-N 3.21Å; L347-L351 VanDerWaalsContact O-N 3.1Å; L347-I503 HydrophobicContact CD1-CB 4.45Å; L347-I503 HydrophobicContact CD1-CG1 4.38Å; L347-I503 HydrophobicContact CD1-CG2 3.85Å; L347-T506 HydrophobicContact CB-CG2 4.44Å; L347-T506 VanDerWaalsContact N-CG2 3.31Å; L347-Q507 HydrophobicContact CD1-CG 4.28Å; L347-Q507 HydrophobicContact CD2-CG 4.26Å; L347-E510 PolarHBondContact N-OE1 3.09Å
348	E	85.1	Confident	82.6	Confident	73 Å²	73	47.7 Å²	47.7	34%	0.341	24%	0.24	S	C	.	.	H	α-helix	trans	-73.3	-41.3	-178.4	-159	-171.6	155.1	0	0	113.3	S346 I350 L351 K352 F384 R400	S346-E348 PolarHBondContact O-N 3.4Å; E348-I350 VanDerWaalsContact C-N 3.29Å; E348-I350 PolarHBondContact O-N 2.74Å; E348-L351 PolarHBondContact O-N 2.85Å; E348-K352 WeakPolarHBondContact O-CB 2.76Å; E348-K352 PolarHBondContact O-N 3.4Å; E348-F384 HydrophobicContact CG-CD2 4.48Å; E348-F384 HydrophobicContact CG-CE2 4.28Å; E348-R400 IonicContact OE1-CZ 3.68Å; E348-R400 IonicContact OE1-NE 3.92Å; E348-R400 PolarHBondContact OE1-NE 2.87Å; E348-R400 IonicContact OE1-NH1 3.3Å; E348-R400 IonicContact OE1-NH2 2.95Å; E348-R400 PolarHBondContact OE1-NH2 2.8Å; E348-R400 IonicContact OE2-CZ 2.72Å; E348-R400 IonicContact OE2-NE 2.92Å; E348-R400 IonicContact OE2-NH1 2.81Å; E348-R400 PolarHBondContact OE2-NH1 2.95Å; E348-R400 VanDerWaalsContact OE2-NH1 3.17Å; E348-R400 IonicContact OE2-NH2 3.91Å; E348-R400 PolarHBondContact OE2-NH2 2.9Å
349	V	85.3	Confident	82.9	Confident	49 Å²	49	46 Å²	46	30%	0.297	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-41.8	178.2	171.7	0	0	0	0	110.1	S346 K352 K353	S346-V349 PolarHBondContact O-N 3.33Å; S346-V349 VanDerWaalsContact OG-CG2 3.3Å; S346-V349 WeakPolarHBondContact OG-CG2 3.22Å; S346-V349 PolarHBondContact OG-N 3.48Å; V349-K352 PolarHBondContact O-N 2.81Å; V349-K353 WeakPolarHBondContact O-CG 3.28Å; V349-K353 PolarHBondContact O-N 2.74Å
350	I	88.1	Confident	83.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69.4	-39.4	178.9	-163.1	166.6	0	0	0	112	I340 S346 L347 E348 K352 K353 I354 G502 T506	I340-I350 HydrophobicContact CG2-CD1 3.77Å; I340-I350 HydrophobicContact CG2-CG1 3.72Å; S346-I350 PolarHBondContact O-N 2.9Å; L347-I350 HydrophobicContact CD1-CG2 4.19Å; L347-I350 WeakPolarHBondContact O-CG2 3.11Å; E348-I350 VanDerWaalsContact C-N 3.29Å; E348-I350 PolarHBondContact O-N 2.74Å; I350-K352 VanDerWaalsContact C-N 3.33Å; I350-K352 PolarHBondContact O-N 3.45Å; I350-K353 PolarHBondContact O-N 2.77Å; I350-I354 HydrophobicContact CG1-CD1 4.12Å; I350-I354 VanDerWaalsContact O-CG1 3.27Å; I350-I354 WeakPolarHBondContact O-CG1 3.48Å; I350-I354 PolarHBondContact O-N 2.97Å; I350-G502 VanDerWaalsContact CD1-C 3.46Å; I350-T506 HydrophobicContact CG2-CG2 4.42Å
351	L	89.1	Confident	83.4	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-38.8	175.6	-69.8	172.7	0	0	0	112	L347 E348 I354 A355 I369 I371 F384 I503	L347-L351 HydrophobicContact CD1-CD1 4.06Å; L347-L351 HydrophobicContact CD1-CG 4.15Å; L347-L351 HydrophobicContact CG-CD1 3.91Å; L347-L351 HydrophobicContact CG-CG 4.43Å; L347-L351 WeakPolarHBondContact O-CB 3.45Å; L347-L351 WeakPolarHBondContact O-CD1 3.48Å; L347-L351 WeakPolarHBondContact O-CG 3.46Å; L347-L351 PolarHBondContact O-N 3.21Å; L347-L351 VanDerWaalsContact O-N 3.1Å; E348-L351 PolarHBondContact O-N 2.85Å; L351-I354 PolarHBondContact O-N 3.34Å; L351-A355 WeakPolarHBondContact O-CB 3.34Å; L351-A355 PolarHBondContact O-N 3.29Å; L351-I369 HydrophobicContact CD2-CB 4.17Å; L351-I369 HydrophobicContact CD2-CD1 3.9Å; L351-I369 HydrophobicContact CD2-CG2 3.68Å; L351-I371 HydrophobicContact CD1-CD1 4.31Å; L351-I371 HydrophobicContact CD1-CG1 4.2Å; L351-I371 HydrophobicContact CD2-CD1 4.01Å; L351-F384 HydrophobicContact CB-CB 4.22Å; L351-F384 HydrophobicContact CB-CD1 4.13Å; L351-F384 HydrophobicContact CB-CD2 4.08Å; L351-F384 HydrophobicContact CB-CG 3.86Å; L351-F384 HydrophobicContact CD1-CB 4.09Å; L351-I503 HydrophobicContact CD2-CD1 3.81Å; L351-I503 HydrophobicContact CD2-CG1 4.09Å
352	K	87.3	Confident	83.7	Confident	81 Å²	81	46.3 Å²	46.3	35%	0.352	24%	0.237	S	C	.	.	H	α-helix	trans	-60.3	-47.5	173.3	-170.6	-177.6	-179.5	178.4	0	111.4	E348 V349 I350 A355 A356 F384 M386	E348-K352 WeakPolarHBondContact O-CB 2.76Å; E348-K352 PolarHBondContact O-N 3.4Å; V349-K352 PolarHBondContact O-N 2.81Å; I350-K352 VanDerWaalsContact C-N 3.33Å; I350-K352 PolarHBondContact O-N 3.45Å; K352-A355 PolarHBondContact O-N 3.1Å; K352-A356 VanDerWaalsContact O-CB 3.28Å; K352-A356 WeakPolarHBondContact O-CB 3.5Å; K352-A356 PolarHBondContact O-N 3.2Å; K352-F384 VanDerWaalsContact CA-CZ 3.48Å; K352-F384 HydrophobicContact CB-CE2 4.35Å; K352-F384 HydrophobicContact CB-CZ 3.77Å; K352-F384 HydrophobicContact CG-CZ 4.16Å; K352-M386 HydrophobicContact CB-CE 4.35Å; K352-M386 HydrophobicContact CG-CE 3.49Å; K352-M386 VanDerWaalsContact CG-CE 3.49Å
353	K	86.7	Confident	84.3	Confident	50 Å²	50	41.7 Å²	41.7	22%	0.217	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-48.9	177.4	-73.7	-174.3	179	-169.9	0	111.5	E343 V349 I350 A355 A356 T357	E343-K353 IonicContact OE2-NZ 3.68Å; E343-K353 PolarHBondContact OE2-NZ 3.18Å; V349-K353 WeakPolarHBondContact O-CG 3.28Å; V349-K353 PolarHBondContact O-N 2.74Å; I350-K353 PolarHBondContact O-N 2.77Å; K353-A355 PolarHBondContact O-N 3.31Å; K353-A356 PolarHBondContact O-N 3.49Å; K353-T357 WeakPolarHBondContact O-CB 3.38Å; K353-T357 PolarHBondContact O-N 3.2Å; K353-T357 PolarHBondContact O-OG1 3.44Å
354	I	89.6	Confident	85.5	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-55.5	-51.3	177.6	-69	163.2	0	0	0	110.7	I340 I350 L351 A356 T357 I358 I369 F495 C499 I503	I340-I354 HydrophobicContact CD1-CG1 3.78Å; I340-I354 HydrophobicContact CG1-CG1 3.96Å; I340-I354 HydrophobicContact CG2-CD1 4.4Å; I340-I354 HydrophobicContact CG2-CG1 4.09Å; I350-I354 HydrophobicContact CG1-CD1 4.12Å; I350-I354 VanDerWaalsContact O-CG1 3.27Å; I350-I354 WeakPolarHBondContact O-CG1 3.48Å; I350-I354 PolarHBondContact O-N 2.97Å; L351-I354 PolarHBondContact O-N 3.34Å; I354-A356 PolarHBondContact O-N 3.11Å; I354-T357 PolarHBondContact O-N 2.87Å; I354-I358 HydrophobicContact CG2-CD1 3.76Å; I354-I358 HydrophobicContact CG2-CG1 4.5Å; I354-I358 VanDerWaalsContact O-CG1 3.32Å; I354-I358 WeakPolarHBondContact O-CG1 3.26Å; I354-I358 PolarHBondContact O-N 3.14Å; I354-I369 HydrophobicContact CB-CD1 4.03Å; I354-I369 HydrophobicContact CG2-CD1 3.63Å; I354-F495 HydrophobicContact CG2-CE1 4.48Å; I354-C499 HydrophobicContact CD1-CB 3.89Å; I354-C499 HydrophobicContact CG1-CB 4.4Å; I354-C499 HydrophobicContact CG2-CB 4.34Å; I354-C499 WeakPolarHBondContact CG2-SG 3.45Å; I354-I503 HydrophobicContact CD1-CD1 4.18Å; I354-I503 HydrophobicContact CD1-CG1 4.11Å
355	A	90	Very high	86.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-44.4	-178.6	0	0	0	0	0	111.9	L351 K352 K353 T357 I358 I359 C367 I369 F384 M386	L351-A355 WeakPolarHBondContact O-CB 3.34Å; L351-A355 PolarHBondContact O-N 3.29Å; K352-A355 PolarHBondContact O-N 3.1Å; K353-A355 PolarHBondContact O-N 3.31Å; A355-T357 PolarHBondContact O-N 3.07Å; A355-I358 PolarHBondContact O-N 3.14Å; A355-I359 WeakPolarHBondContact O-CB 3.34Å; A355-I359 WeakPolarHBondContact O-CD1 3.45Å; A355-I359 VanDerWaalsContact O-CG1 3.26Å; A355-I359 WeakPolarHBondContact O-CG1 3.46Å; A355-I359 PolarHBondContact O-N 3.07Å; A355-C367 HydrophobicContact CB-CB 4.26Å; A355-I369 HydrophobicContact CB-CD1 4.33Å; A355-F384 HydrophobicContact CB-CD1 4.16Å; A355-F384 HydrophobicContact CB-CE1 3.75Å; A355-M386 HydrophobicContact CB-CB 3.98Å; A355-M386 HydrophobicContact CB-CE 4.28Å; A355-M386 HydrophobicContact CB-SD 3.85Å
356	A	88	Confident	87.5	Confident	26 Å²	26	30.7 Å²	30.7	22%	0.215	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-43.2	178.3	0	0	0	0	0	112	K352 K353 I354 I359 S360 M386 L391	K352-A356 VanDerWaalsContact O-CB 3.28Å; K352-A356 WeakPolarHBondContact O-CB 3.5Å; K352-A356 PolarHBondContact O-N 3.2Å; K353-A356 PolarHBondContact O-N 3.49Å; I354-A356 PolarHBondContact O-N 3.11Å; A356-I359 PolarHBondContact O-N 3.24Å; A356-S360 WeakPolarHBondContact O-CB 3.22Å; A356-S360 PolarHBondContact O-N 3.4Å; A356-M386 HydrophobicContact CB-CE 4.43Å; A356-M386 HydrophobicContact CB-SD 4.01Å; A356-L391 HydrophobicContact CB-CD2 3.75Å
357	T	87.6	Confident	87.9	Confident	20 Å²	20	29.1 Å²	29.1	12%	0.123	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-46.1	175.7	-61.1	0	0	0	0	111.6	L336 K353 I354 A355 F361 F495	L336-T357 HydrophobicContact CB-CG2 4.26Å; L336-T357 HydrophobicContact CD1-CG2 4.38Å; L336-T357 HydrophobicContact CD2-CG2 3.7Å; L336-T357 HydrophobicContact CG-CG2 4.32Å; K353-T357 WeakPolarHBondContact O-CB 3.38Å; K353-T357 PolarHBondContact O-N 3.2Å; K353-T357 PolarHBondContact O-OG1 3.44Å; I354-T357 PolarHBondContact O-N 2.87Å; A355-T357 PolarHBondContact O-N 3.07Å; T357-F361 WeakPolarHBondContact O-CB 3.44Å; T357-F361 PolarHBondContact O-N 3.13Å; T357-F495 HydrophobicContact CG2-CE1 4.36Å; T357-F495 HydrophobicContact CG2-CE2 4.43Å; T357-F495 HydrophobicContact CG2-CZ 3.69Å
358	I	89.9	Confident	88.1	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-45.2	179.1	-66.8	169.8	0	0	0	111.2	I354 A355 S360 F361 M362 V364 L470 L492 F495	I354-I358 HydrophobicContact CG2-CD1 3.76Å; I354-I358 HydrophobicContact CG2-CG1 4.5Å; I354-I358 VanDerWaalsContact O-CG1 3.32Å; I354-I358 WeakPolarHBondContact O-CG1 3.26Å; I354-I358 PolarHBondContact O-N 3.14Å; A355-I358 PolarHBondContact O-N 3.14Å; I358-S360 PolarHBondContact O-N 3.44Å; I358-F361 PolarHBondContact O-N 2.87Å; I358-M362 HydrophobicContact CG2-CB 4.32Å; I358-M362 HydrophobicContact CG2-CG 4.2Å; I358-M362 HydrophobicContact CG2-SD 3.93Å; I358-M362 WeakPolarHBondContact O-CA 3.42Å; I358-M362 VanDerWaalsContact O-CB 3.27Å; I358-M362 WeakPolarHBondContact O-CB 3.49Å; I358-M362 PolarHBondContact O-N 2.99Å; I358-V364 HydrophobicContact CG2-CG2 4.31Å; I358-L470 HydrophobicContact CG2-CD1 3.68Å; I358-L470 HydrophobicContact CG2-CD2 3.46Å; I358-L470 VanDerWaalsContact CG2-CD2 3.46Å; I358-L470 HydrophobicContact CG2-CG 4.24Å; I358-L492 HydrophobicContact CD1-CD1 4.24Å; I358-F495 HydrophobicContact CD1-CD1 4.01Å; I358-F495 HydrophobicContact CD1-CE1 3.98Å; I358-F495 HydrophobicContact CG1-CD1 3.74Å; I358-F495 HydrophobicContact CG1-CE1 3.52Å
359	I	88.8	Confident	88.5	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-59.7	-50.3	179.7	-72.4	163.7	0	0	0	110.5	A355 A356 Q363 V364 C367 M386 C388 L391	A355-I359 WeakPolarHBondContact O-CB 3.34Å; A355-I359 WeakPolarHBondContact O-CD1 3.45Å; A355-I359 VanDerWaalsContact O-CG1 3.26Å; A355-I359 WeakPolarHBondContact O-CG1 3.46Å; A355-I359 PolarHBondContact O-N 3.07Å; A356-I359 PolarHBondContact O-N 3.24Å; I359-Q363 VanDerWaalsContact O-CA 3.31Å; I359-Q363 WeakPolarHBondContact O-CA 2.9Å; I359-Q363 PolarHBondContact O-N 2.99Å; I359-V364 HydrophobicContact CB-CG2 4.48Å; I359-V364 HydrophobicContact CG1-CG2 4.07Å; I359-V364 PolarHBondContact O-N 3.38Å; I359-C367 HydrophobicContact CD1-CB 3.84Å; I359-C367 HydrophobicContact CG1-CB 3.68Å; I359-M386 HydrophobicContact CD1-CB 3.84Å; I359-M386 HydrophobicContact CD1-CG 3.52Å; I359-M386 HydrophobicContact CD1-SD 3.69Å; I359-C388 HydrophobicContact CG2-CB 3.74Å; I359-L391 HydrophobicContact CB-CD1 4.14Å; I359-L391 HydrophobicContact CG2-CD1 3.38Å; I359-L391 HydrophobicContact CG2-CG 4.3Å
360	S	84.9	Confident	88.7	Confident	85 Å²	85	22.2 Å²	22.2	59%	0.594	12%	0.116	S	C	*	.	H	α-helix	trans	-65.6	-41	-178.3	-176.1	0	0	0	0	112.4	A356 I358	A356-S360 WeakPolarHBondContact O-CB 3.22Å; A356-S360 PolarHBondContact O-N 3.4Å; I358-S360 PolarHBondContact O-N 3.44Å
361	F	84.3	Confident	88.8	Confident	73 Å²	73	22.3 Å²	22.3	32%	0.32	12%	0.116	S	C	.	.	H	α-helix	trans	-83.6	-45.3	-173.6	-173.2	-92.3	0	0	0	112.6	V332 L336 T357 I358 Q363 F491	V332-F361 HydrophobicContact CG1-CE2 3.69Å; V332-F361 HydrophobicContact CG1-CZ 3.88Å; L336-F361 HydrophobicContact CD1-CD1 4.37Å; L336-F361 HydrophobicContact CD1-CD2 3.99Å; L336-F361 HydrophobicContact CD1-CE2 4.22Å; L336-F361 HydrophobicContact CD1-CG 4.07Å; T357-F361 WeakPolarHBondContact O-CB 3.44Å; T357-F361 PolarHBondContact O-N 3.13Å; I358-F361 PolarHBondContact O-N 2.87Å; F361-Q363 VanDerWaalsContact C-N 3.34Å; F361-F491 HydrophobicContact CD1-CD1 4.23Å; F361-F491 AromaticContact CD1-CE1 3.47Å; F361-F491 HydrophobicContact CD1-CE1 3.47Å; F361-F491 VanDerWaalsContact CD1-CE1 3.47Å; F361-F491 AromaticContact CD1-CE2 3.85Å; F361-F491 HydrophobicContact CD1-CE2 3.85Å; F361-F491 AromaticContact CD1-CZ 3.25Å; F361-F491 HydrophobicContact CD1-CZ 3.25Å; F361-F491 HydrophobicContact CE1-CD1 4.15Å; F361-F491 AromaticContact CE1-CD2 3.78Å; F361-F491 HydrophobicContact CE1-CD2 3.78Å; F361-F491 AromaticContact CE1-CE1 3.67Å; F361-F491 HydrophobicContact CE1-CE1 3.67Å; F361-F491 AromaticContact CE1-CE2 3.23Å; F361-F491 HydrophobicContact CE1-CE2 3.23Å; F361-F491 HydrophobicContact CE1-CG 4.2Å; F361-F491 AromaticContact CE1-CZ 3.18Å; F361-F491 HydrophobicContact CE1-CZ 3.18Å; F361-F491 HydrophobicContact CG-CZ 4.18Å; F361-F491 HydrophobicContact CZ-CD2 4.48Å; F361-F491 AromaticContact CZ-CE2 3.82Å; F361-F491 HydrophobicContact CZ-CE2 3.82Å; F361-F491 HydrophobicContact CZ-CZ 4.05Å
362	M	86.2	Confident	88.7	Confident	3 Å²	3	23 Å²	23	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-86.9	-3.4	-179.4	-60.3	-168.6	74.5	0	0	112.9	I358 V364 L452 L470 K473 D488 F491 L492	I358-M362 HydrophobicContact CG2-CB 4.32Å; I358-M362 HydrophobicContact CG2-CG 4.2Å; I358-M362 HydrophobicContact CG2-SD 3.93Å; I358-M362 WeakPolarHBondContact O-CA 3.42Å; I358-M362 VanDerWaalsContact O-CB 3.27Å; I358-M362 WeakPolarHBondContact O-CB 3.49Å; I358-M362 PolarHBondContact O-N 2.99Å; M362-V364 VanDerWaalsContact C-N 3.35Å; M362-V364 HydrophobicContact CB-CG1 4.03Å; M362-V364 PolarHBondContact O-N 3.33Å; M362-L452 HydrophobicContact CE-CD2 4.16Å; M362-L470 HydrophobicContact CE-CD1 4.02Å; M362-L470 HydrophobicContact SD-CD1 3.53Å; M362-L470 VanDerWaalsContact SD-CD1 3.53Å; M362-K473 WeakPolarHBondContact O-CD 3.33Å; M362-K473 WeakPolarHBondContact O-CE 3.26Å; M362-K473 PolarHBondContact O-NZ 3.4Å; M362-D488 HydrophobicContact CE-CB 3.83Å; M362-D488 VanDerWaalsContact CE-O 3.31Å; M362-D488 WeakPolarHBondContact CE-O 3.34Å; M362-F491 HydrophobicContact CE-CD1 4.13Å; M362-F491 HydrophobicContact CG-CD1 3.92Å; M362-F491 HydrophobicContact CG-CE1 3.87Å; M362-F491 HydrophobicContact SD-CD1 3.73Å; M362-F491 HydrophobicContact SD-CE1 4.01Å; M362-L492 HydrophobicContact CE-CB 4.14Å; M362-L492 HydrophobicContact SD-CB 4.19Å; M362-L492 HydrophobicContact SD-CD1 4.13Å
363	Q	87.4	Confident	88.1	Confident	42 Å²	42	22.1 Å²	22.1	20%	0.196	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	51.3	176.4	-54.7	-175.1	-16.4	0	0	112.2	I359 F361 M474 E476	I359-Q363 VanDerWaalsContact O-CA 3.31Å; I359-Q363 WeakPolarHBondContact O-CA 2.9Å; I359-Q363 PolarHBondContact O-N 2.99Å; F361-Q363 VanDerWaalsContact C-N 3.34Å; Q363-M474 WeakPolarHBondContact O-CB 3.41Å; Q363-M474 PolarHBondContact O-N 3.31Å; Q363-E476 PolarHBondContact NE2-OE1 3.43Å; Q363-E476 VanDerWaalsContact OE1-CG 3.28Å
364	V	90	Very high	87.1	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	146.8	-179	-65.2	0	0	0	0	109.9	I358 I359 M362 L470 N472 K473 F484	I358-V364 HydrophobicContact CG2-CG2 4.31Å; I359-V364 HydrophobicContact CB-CG2 4.48Å; I359-V364 HydrophobicContact CG1-CG2 4.07Å; I359-V364 PolarHBondContact O-N 3.38Å; M362-V364 VanDerWaalsContact C-N 3.35Å; M362-V364 HydrophobicContact CB-CG1 4.03Å; M362-V364 PolarHBondContact O-N 3.33Å; V364-L470 HydrophobicContact CB-CB 4.46Å; V364-L470 HydrophobicContact CG1-CB 4.13Å; V364-L470 HydrophobicContact CG1-CD1 4.19Å; V364-L470 HydrophobicContact CG2-CB 4.48Å; V364-L470 HydrophobicContact CG2-CD2 4.37Å; V364-N472 WeakPolarHBondContact CA-O 3.18Å; V364-K473 HydrophobicContact CG1-CD 4.41Å; V364-F484 HydrophobicContact CG1-CE1 3.59Å; V364-F484 HydrophobicContact CG1-CZ 3.74Å
365	Q	88.3	Confident	85.9	Confident	44 Å²	44	32.5 Å²	32.5	21%	0.206	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-40.6	-180	-169.6	-178.2	7.4	0	0	111.7	C388 V471 N472 M474	Q365-C388 PolarHBondContact O-N 2.96Å; Q365-V471 PolarHBondContact N-O 3.01Å; Q365-V471 VanDerWaalsContact N-O 3.1Å; Q365-N472 HydrophobicContact CB-CB 3.87Å; Q365-N472 PolarHBondContact N-O 3.07Å; Q365-N472 PolarHBondContact OE1-ND2 2.95Å; Q365-M474 HydrophobicContact CB-CG 4.42Å; Q365-M474 HydrophobicContact CB-SD 4.19Å
366	K	89.5	Confident	84.4	Confident	28 Å²	28	34.8 Å²	34.8	12%	0.122	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.4	-178	-41.5	-171.5	178.4	-155	0	112	M386 E387 L470 V471	K366-M386 WeakPolarHBondContact CA-O 3.41Å; K366-E387 HydrophobicContact CD-CG 4.12Å; K366-E387 WeakPolarHBondContact CE-OE1 3.4Å; K366-E387 HydrophobicContact CG-CG 4.13Å; K366-E387 IonicContact NZ-OE1 3.07Å; K366-E387 PolarHBondContact NZ-OE1 3.44Å; K366-L470 WeakPolarHBondContact O-CA 3.31Å; K366-V471 HydrophobicContact CB-CB 4.17Å; K366-V471 PolarHBondContact N-O 3.02Å; K366-V471 PolarHBondContact O-N 2.89Å
367	C	92.8	Very high	83	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.5	170.9	178.1	0	0	0	0	109.4	A355 I359 M386 L470	A355-C367 HydrophobicContact CB-CB 4.26Å; I359-C367 HydrophobicContact CD1-CB 3.84Å; I359-C367 HydrophobicContact CG1-CB 3.68Å; C367-M386 PolarHBondContact N-O 3.43Å; C367-M386 PolarHBondContact O-N 3.4Å; C367-L470 HydrophobicContact CB-CD2 3.97Å
368	T	91.6	Very high	81.7	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.9	175.4	-46.3	0	0	0	0	109.4	F370 V383 F384 H385 I407 Q469	T368-F370 HydrophobicContact CG2-CD2 4.2Å; T368-F370 HydrophobicContact CG2-CE1 4.16Å; T368-F370 HydrophobicContact CG2-CE2 3.57Å; T368-F370 HydrophobicContact CG2-CZ 3.55Å; T368-V383 HydrophobicContact CG2-CG1 3.7Å; T368-F384 CarbonylContact C-O 3.57Å; T368-F384 VanDerWaalsContact CA-O 3.26Å; T368-F384 WeakPolarHBondContact CA-O 3.23Å; T368-F384 WeakPolarHBondContact CG2-O 3.45Å; T368-H385 HydrophobicContact CG2-CB 4.39Å; T368-H385 PolarHBondContact OG1-ND1 3.38Å; T368-I407 HydrophobicContact CG2-CG2 4.35Å; T368-Q469 PolarHBondContact N-O 3.49Å; T368-Q469 PolarHBondContact O-N 2.89Å
369	I	92.5	Very high	80.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.6	177.4	-53.8	169.3	0	0	0	108	L351 I354 A355 I371 F384 I456 V467	L351-I369 HydrophobicContact CD2-CB 4.17Å; L351-I369 HydrophobicContact CD2-CD1 3.9Å; L351-I369 HydrophobicContact CD2-CG2 3.68Å; I354-I369 HydrophobicContact CB-CD1 4.03Å; I354-I369 HydrophobicContact CG2-CD1 3.63Å; A355-I369 HydrophobicContact CB-CD1 4.33Å; I369-I371 HydrophobicContact CG2-CD1 4.09Å; I369-F384 HydrophobicContact CB-CB 4.47Å; I369-F384 PolarHBondContact N-O 3.47Å; I369-F384 PolarHBondContact O-N 2.97Å; I369-I456 HydrophobicContact CG2-CD1 3.79Å; I369-V467 CarbonylContact C-O 3.58Å; I369-V467 WeakPolarHBondContact CA-O 3.26Å
370	F	91	Very high	80.3	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.9	176.4	-57.1	-96.8	0	0	0	108.8	T368 F380 V383 I407 A412 G466 V467 Q469	T368-F370 HydrophobicContact CG2-CD2 4.2Å; T368-F370 HydrophobicContact CG2-CE1 4.16Å; T368-F370 HydrophobicContact CG2-CE2 3.57Å; T368-F370 HydrophobicContact CG2-CZ 3.55Å; F370-F380 HydrophobicContact CB-CB 4.5Å; F370-F380 HydrophobicContact CB-CD1 3.46Å; F370-F380 VanDerWaalsContact CB-CD1 3.46Å; F370-F380 HydrophobicContact CB-CD2 4.35Å; F370-F380 HydrophobicContact CB-CE1 3.59Å; F370-F380 HydrophobicContact CB-CE2 4.48Å; F370-F380 HydrophobicContact CB-CG 3.85Å; F370-F380 HydrophobicContact CB-CZ 4.13Å; F370-F380 AromaticContact CD1-CD2 3.95Å; F370-F380 HydrophobicContact CD1-CD2 3.95Å; F370-F380 HydrophobicContact CD1-CE2 4.19Å; F370-F380 HydrophobicContact CD1-CG 4.15Å; F370-F380 HydrophobicContact CG-CD1 4.38Å; F370-F380 HydrophobicContact CG-CD2 4.49Å; F370-F380 HydrophobicContact CG-CE1 4.36Å; F370-F380 HydrophobicContact CG-CE2 4.49Å; F370-F380 HydrophobicContact CG-CG 4.43Å; F370-F380 HydrophobicContact CG-CZ 4.42Å; F370-V383 HydrophobicContact CD1-CB 4.33Å; F370-V383 HydrophobicContact CD1-CG1 3.8Å; F370-V383 HydrophobicContact CD1-CG2 3.66Å; F370-V383 HydrophobicContact CE1-CG1 3.74Å; F370-V383 HydrophobicContact CE1-CG2 4.11Å; F370-V383 HydrophobicContact CZ-CG1 4.43Å; F370-I407 HydrophobicContact CE1-CG2 4.19Å; F370-I407 HydrophobicContact CZ-CG2 3.96Å; F370-A412 HydrophobicContact CD1-CB 4.25Å; F370-A412 HydrophobicContact CD2-CB 3.48Å; F370-A412 VanDerWaalsContact CD2-CB 3.48Å; F370-A412 HydrophobicContact CE1-CB 4.3Å; F370-A412 HydrophobicContact CE2-CB 3.52Å; F370-A412 HydrophobicContact CG-CB 3.87Å; F370-A412 HydrophobicContact CZ-CB 3.96Å; F370-G466 CarbonylContact O-C 3.59Å; F370-G466 VanDerWaalsContact O-C 3.31Å; F370-G466 WeakPolarHBondContact O-CA 3.43Å; F370-V467 HydrophobicContact CB-CB 4.39Å; F370-V467 HydrophobicContact CD2-CB 4.46Å; F370-V467 PolarHBondContact N-O 3.09Å; F370-V467 PolarHBondContact O-N 2.92Å; F370-Q469 HydrophobicContact CE2-CB 3.94Å
371	I	89.5	Confident	80	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.8	175.4	-55	-58.4	0	0	0	109	L351 I369 F380 S381 S382 I503	L351-I371 HydrophobicContact CD1-CD1 4.31Å; L351-I371 HydrophobicContact CD1-CG1 4.2Å; L351-I371 HydrophobicContact CD2-CD1 4.01Å; I369-I371 HydrophobicContact CG2-CD1 4.09Å; I371-F380 CarbonylContact O-C 3.59Å; I371-F380 VanDerWaalsContact O-CA 3.22Å; I371-F380 WeakPolarHBondContact O-CA 3.38Å; I371-F380 WeakPolarHBondContact O-CB 3.36Å; I371-S381 PolarHBondContact O-N 2.8Å; I371-S381 PolarHBondContact O-OG 3.39Å; I371-S382 VanDerWaalsContact CB-OG 3.28Å; I371-S382 WeakPolarHBondContact CB-OG 3.32Å; I371-S382 VanDerWaalsContact CG1-OG 3.26Å; I371-S382 WeakPolarHBondContact CG1-OG 3.27Å; I371-S382 PolarHBondContact N-O 3.22Å; I371-I503 HydrophobicContact CD1-CD1 4.21Å; I371-I503 HydrophobicContact CD1-CG2 4.35Å
372	V	86.2	Confident	79.9	Confident	19 Å²	19	44.4 Å²	44.4	12%	0.115	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.2	-179.9	174.9	0	0	0	0	108.9	F380 K416 V464 I465	V372-F380 HydrophobicContact CG2-CD1 3.86Å; V372-F380 HydrophobicContact CG2-CE1 3.82Å; V372-K416 HydrophobicContact CG2-CD 4.05Å; V372-K416 HydrophobicContact CG2-CG 4.26Å; V372-V464 HydrophobicContact CG2-CG1 4.39Å; V372-I465 PolarHBondContact N-O 3.4Å
373	D	75.6	Confident	79.9	Confident	63 Å²	63	46.9 Å²	46.9	34%	0.337	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-78.1	143.7	168.8	-152	-27.7	0	0	0	110.6	D375 C376	D373-D375 VanDerWaalsContact C-N 3.28Å; D373-D375 PolarHBondContact OD1-N 2.95Å; D373-C376 HydrophobicContact CB-CB 4.15Å
374	E	66.4	Low	80	Confident	122 Å²	122	46.4 Å²	46.4	57%	0.57	26%	0.264	S	S	*	.	S	Bend	trans	-72.1	-27.6	172	-64.2	-145	121.6	0	0	112	K463	E374-K463 VanDerWaalsContact CG-NZ 3.29Å; E374-K463 IonicContact OE1-NZ 2.7Å; E374-K463 PolarHBondContact OE1-NZ 2.92Å
375	D	63	Low	79.9	Confident	149 Å²	149	48.3 Å²	48.3	80%	0.797	27%	0.273	S	S	*	.	S	Bend	trans	-95.6	-15.1	-170.6	-62	-30.8	0	0	0	113.7	D373	D373-D375 VanDerWaalsContact C-N 3.28Å; D373-D375 PolarHBondContact OD1-N 2.95Å
376	C	58.6	Low	79.8	Confident	48 Å²	48	46.6 Å²	46.6	32%	0.324	27%	0.265	S	S	.	.			trans	-120	107.7	179.6	-162.2	0	0	0	0	111.5	D373 D378 S379	D373-C376 HydrophobicContact CB-CB 4.15Å; C376-D378 PolarHBondContact O-N 3.19Å; C376-S379 PolarHBondContact SG-OG 3.32Å
377	S	58.5	Low	79.7	Confident	89 Å²	89	46.7 Å²	46.7	62%	0.622	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.2	-178.5	67.2	0	0	0	0	112.9	K416	S377-K416 PolarHBondContact O-NZ 3.24Å
378	D	60.6	Low	79.3	Confident	125 Å²	125	49.4 Å²	49.4	67%	0.668	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-1.8	-163.2	-68.4	0.3	0	0	0	114.3	C376	C376-D378 PolarHBondContact O-N 3.19Å
379	S	69.7	Low	78.6	Confident	52 Å²	52	54.9 Å²	54.9	36%	0.364	31%	0.31	S	S	.	.	S	Bend	trans	-130.3	167.4	179.1	70.1	0	0	0	0	113.8	C376 K416	C376-S379 PolarHBondContact SG-OG 3.32Å; S379-K416 PolarHBondContact O-NZ 3.13Å
380	F	80.4	Confident	77.8	Confident	32 Å²	32	56.6 Å²	56.6	14%	0.14	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	135.2	168.6	-63.7	-73.4	0	0	0	108.6	F370 I371 V372 V383 A412 K416 V467	F370-F380 HydrophobicContact CB-CB 4.5Å; F370-F380 HydrophobicContact CB-CD1 3.46Å; F370-F380 VanDerWaalsContact CB-CD1 3.46Å; F370-F380 HydrophobicContact CB-CD2 4.35Å; F370-F380 HydrophobicContact CB-CE1 3.59Å; F370-F380 HydrophobicContact CB-CE2 4.48Å; F370-F380 HydrophobicContact CB-CG 3.85Å; F370-F380 HydrophobicContact CB-CZ 4.13Å; F370-F380 AromaticContact CD1-CD2 3.95Å; F370-F380 HydrophobicContact CD1-CD2 3.95Å; F370-F380 HydrophobicContact CD1-CE2 4.19Å; F370-F380 HydrophobicContact CD1-CG 4.15Å; F370-F380 HydrophobicContact CG-CD1 4.38Å; F370-F380 HydrophobicContact CG-CD2 4.49Å; F370-F380 HydrophobicContact CG-CE1 4.36Å; F370-F380 HydrophobicContact CG-CE2 4.49Å; F370-F380 HydrophobicContact CG-CG 4.43Å; F370-F380 HydrophobicContact CG-CZ 4.42Å; I371-F380 CarbonylContact O-C 3.59Å; I371-F380 VanDerWaalsContact O-CA 3.22Å; I371-F380 WeakPolarHBondContact O-CA 3.38Å; I371-F380 WeakPolarHBondContact O-CB 3.36Å; V372-F380 HydrophobicContact CG2-CD1 3.86Å; V372-F380 HydrophobicContact CG2-CE1 3.82Å; F380-V383 HydrophobicContact CB-CG2 4.41Å; F380-A412 HydrophobicContact CE2-CB 4.11Å; F380-A412 HydrophobicContact CZ-CB 3.78Å; F380-K416 HydrophobicContact CE1-CD 4.06Å; F380-K416 HydrophobicContact CZ-CB 4.45Å; F380-K416 HydrophobicContact CZ-CD 4.2Å; F380-V467 HydrophobicContact CE1-CG2 4.17Å
381	S	77.3	Confident	76.9	Confident	63 Å²	63	60.1 Å²	60.1	44%	0.441	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-33.7	179.8	48.2	0	0	0	0	112.1	I371	I371-S381 PolarHBondContact O-N 2.8Å; I371-S381 PolarHBondContact O-OG 3.39Å
382	S	82.5	Confident	75.4	Confident	46 Å²	46	68.8 Å²	68.8	32%	0.322	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.9	175	68.8	0	0	0	0	111.6	I371	I371-S382 VanDerWaalsContact CB-OG 3.28Å; I371-S382 WeakPolarHBondContact CB-OG 3.32Å; I371-S382 VanDerWaalsContact CG1-OG 3.26Å; I371-S382 WeakPolarHBondContact CG1-OG 3.27Å; I371-S382 PolarHBondContact N-O 3.22Å
383	V	86.9	Confident	74.2	Confident	56 Å²	56	73.7 Å²	73.7	34%	0.339	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.6	177.6	-175.6	0	0	0	0	107.9	T368 F370 F380 I407	T368-V383 HydrophobicContact CG2-CG1 3.7Å; F370-V383 HydrophobicContact CD1-CB 4.33Å; F370-V383 HydrophobicContact CD1-CG1 3.8Å; F370-V383 HydrophobicContact CD1-CG2 3.66Å; F370-V383 HydrophobicContact CE1-CG1 3.74Å; F370-V383 HydrophobicContact CE1-CG2 4.11Å; F370-V383 HydrophobicContact CZ-CG1 4.43Å; F380-V383 HydrophobicContact CB-CG2 4.41Å; V383-I407 HydrophobicContact CG1-CD1 4.21Å
384	F	88.4	Confident	72.7	Confident	32 Å²	32	75.7 Å²	75.7	14%	0.14	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.2	174.1	-173.1	-91.1	0	0	0	109.3	E348 L351 K352 A355 T368 I369 M386	E348-F384 HydrophobicContact CG-CD2 4.48Å; E348-F384 HydrophobicContact CG-CE2 4.28Å; L351-F384 HydrophobicContact CB-CB 4.22Å; L351-F384 HydrophobicContact CB-CD1 4.13Å; L351-F384 HydrophobicContact CB-CD2 4.08Å; L351-F384 HydrophobicContact CB-CG 3.86Å; L351-F384 HydrophobicContact CD1-CB 4.09Å; K352-F384 VanDerWaalsContact CA-CZ 3.48Å; K352-F384 HydrophobicContact CB-CE2 4.35Å; K352-F384 HydrophobicContact CB-CZ 3.77Å; K352-F384 HydrophobicContact CG-CZ 4.16Å; A355-F384 HydrophobicContact CB-CD1 4.16Å; A355-F384 HydrophobicContact CB-CE1 3.75Å; T368-F384 CarbonylContact C-O 3.57Å; T368-F384 VanDerWaalsContact CA-O 3.26Å; T368-F384 WeakPolarHBondContact CA-O 3.23Å; T368-F384 WeakPolarHBondContact CG2-O 3.45Å; I369-F384 HydrophobicContact CB-CB 4.47Å; I369-F384 PolarHBondContact N-O 3.47Å; I369-F384 PolarHBondContact O-N 2.97Å; F384-M386 HydrophobicContact CE1-CB 4.09Å; F384-M386 HydrophobicContact CE1-CE 4.03Å; F384-M386 HydrophobicContact CZ-CE 4.02Å
385	H	87.9	Confident	71.8	Confident	41 Å²	41	74 Å²	74	19%	0.19	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.6	-177.9	-175.2	73	0	0	0	109.8	T368 E387 I407	T368-H385 HydrophobicContact CG2-CB 4.39Å; T368-H385 PolarHBondContact OG1-ND1 3.38Å; H385-E387 IonicContact NE2-OE1 2.64Å; H385-I407 HydrophobicContact CB-CD1 3.83Å
386	M	87.1	Confident	70.7	Confident	8 Å²	8	74 Å²	74	4%	0.039	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	137.6	176.2	-176	-178.7	-79.3	0	0	110.2	K352 A355 A356 I359 K366 C367 F384	K352-M386 HydrophobicContact CB-CE 4.35Å; K352-M386 HydrophobicContact CG-CE 3.49Å; K352-M386 VanDerWaalsContact CG-CE 3.49Å; A355-M386 HydrophobicContact CB-CB 3.98Å; A355-M386 HydrophobicContact CB-CE 4.28Å; A355-M386 HydrophobicContact CB-SD 3.85Å; A356-M386 HydrophobicContact CB-CE 4.43Å; A356-M386 HydrophobicContact CB-SD 4.01Å; I359-M386 HydrophobicContact CD1-CB 3.84Å; I359-M386 HydrophobicContact CD1-CG 3.52Å; I359-M386 HydrophobicContact CD1-SD 3.69Å; K366-M386 WeakPolarHBondContact CA-O 3.41Å; C367-M386 PolarHBondContact N-O 3.43Å; C367-M386 PolarHBondContact O-N 3.4Å; F384-M386 HydrophobicContact CE1-CB 4.09Å; F384-M386 HydrophobicContact CE1-CE 4.03Å; F384-M386 HydrophobicContact CZ-CE 4.02Å
387	E	87.6	Confident	69.7	Low	30 Å²	30	79.5 Å²	79.5	14%	0.14	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	153.2	173.4	-57.4	-166.5	169.2	0	0	111.3	K366 H385 E389 E390	K366-E387 HydrophobicContact CD-CG 4.12Å; K366-E387 WeakPolarHBondContact CE-OE1 3.4Å; K366-E387 HydrophobicContact CG-CG 4.13Å; K366-E387 IonicContact NZ-OE1 3.07Å; K366-E387 PolarHBondContact NZ-OE1 3.44Å; H385-E387 IonicContact NE2-OE1 2.64Å; E387-E389 PolarHBondContact O-N 3.28Å; E387-E390 WeakPolarHBondContact O-CB 3.45Å; E387-E390 PolarHBondContact O-N 3.35Å
388	C	83.9	Confident	68.9	Low	57 Å²	57	78.5 Å²	78.5	39%	0.385	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-59.3	-30.8	-179.5	-171.6	0	0	0	0	113.6	I359 Q365 E390 L391	I359-C388 HydrophobicContact CG2-CB 3.74Å; Q365-C388 PolarHBondContact O-N 2.96Å; C388-E390 PolarHBondContact O-N 2.91Å; C388-L391 WeakPolarHBondContact O-CB 2.99Å; C388-L391 PolarHBondContact O-N 3.49Å
389	E	77.6	Confident	68	Low	118 Å²	118	79 Å²	79	55%	0.551	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-67.2	-16.6	178.1	-61.1	176.7	-170.6	0	0	113.3	E387	E387-E389 PolarHBondContact O-N 3.28Å
390	E	76.1	Confident	67	Low	35 Å²	35	85.4 Å²	85.4	16%	0.164	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-82.6	-15.1	178.3	-63.9	177.4	-157.2	0	0	113	E387 C388 E392 K393 L398	E387-E390 WeakPolarHBondContact O-CB 3.45Å; E387-E390 PolarHBondContact O-N 3.35Å; C388-E390 PolarHBondContact O-N 2.91Å; E390-E392 PolarHBondContact O-N 3.32Å; E390-K393 PolarHBondContact O-N 2.85Å; E390-L398 HydrophobicContact CB-CD2 4.43Å; E390-L398 HydrophobicContact CG-CD2 4.05Å
391	L	70.8	Confident	65.1	Low	76 Å²	76	92.8 Å²	92.8	40%	0.398	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.3	176.5	-73.4	172.4	0	0	0	112.9	A356 I359 C388	A356-L391 HydrophobicContact CB-CD2 3.75Å; I359-L391 HydrophobicContact CB-CD1 4.14Å; I359-L391 HydrophobicContact CG2-CD1 3.38Å; I359-L391 HydrophobicContact CG2-CG 4.3Å; C388-L391 WeakPolarHBondContact O-CB 2.99Å; C388-L391 PolarHBondContact O-N 3.49Å
392	E	59.6	Low	63.6	Low	183 Å²	183	96.2 Å²	96.2	86%	0.855	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-9.2	-176.5	-61.7	-175.7	168.7	0	0	113.4	E390	E390-E392 PolarHBondContact O-N 3.32Å
393	K	58.9	Low	61.9	Low	123 Å²	123	97.6 Å²	97.6	54%	0.535	50%	0.499	S	S	.	.	S	Bend	trans	-93	127.5	-177.6	-66.2	176	-172.9	166.4	0	110.2	E390	E390-K393 PolarHBondContact O-N 2.85Å
394	S	44.9	Very low	60.1	Low	104 Å²	104	97.7 Å²	97.7	73%	0.727	51%	0.505	S	S	*	.			trans	-61.4	147.3	179.2	55.8	0	0	0	0	112.3	D396	S394-D396 PolarHBondContact O-N 3.47Å
395	S	48.3	Very low	58.3	Low	88 Å²	88	103.3 Å²	103.3	62%	0.615	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-4	-161.9	-168.2	0	0	0	0	118.2
396	D	39.3	Very low	56.8	Low	147 Å²	147	108.5 Å²	108.5	79%	0.786	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-3.4	-167.7	-85.3	-13.1	0	0	0	115.7	S394	S394-D396 PolarHBondContact O-N 3.47Å
397	M	36.7	Very low	55.9	Low	164 Å²	164	109.8 Å²	109.8	81%	0.808	57%	0.565	S	S	*	*			trans	-138.1	54.9	-173.9	-74.8	-86.7	102	0	0	113.3
398	L	43.3	Very low	55.2	Low	68 Å²	68	111.1 Å²	111.1	36%	0.356	57%	0.573	S	S	.	*			trans	-108.6	101.5	167.7	-71.6	167.5	0	0	0	109.8	E390 R400	E390-L398 HydrophobicContact CB-CD2 4.43Å; E390-L398 HydrophobicContact CG-CD2 4.05Å; L398-R400 PolarHBondContact O-N 2.86Å
399	T	39.9	Very low	55	Low	136 Å²	136	115.4 Å²	115.4	83%	0.834	58%	0.583	S	S	*	*			trans	-58.9	98.9	171	25.1	0	0	0	0	110	E401	T399-E401 PolarHBondContact O-N 3.39Å
400	R	49.2	Very low	55.3	Low	187 Å²	187	111.5 Å²	111.5	71%	0.706	57%	0.565	S	S	*	*			trans	-67.7	94.7	164.3	-71.4	-172.2	-167.4	151	14.7	109.2	E348 L398	E348-R400 IonicContact OE1-CZ 3.68Å; E348-R400 IonicContact OE1-NE 3.92Å; E348-R400 PolarHBondContact OE1-NE 2.87Å; E348-R400 IonicContact OE1-NH1 3.3Å; E348-R400 IonicContact OE1-NH2 2.95Å; E348-R400 PolarHBondContact OE1-NH2 2.8Å; E348-R400 IonicContact OE2-CZ 2.72Å; E348-R400 IonicContact OE2-NE 2.92Å; E348-R400 IonicContact OE2-NH1 2.81Å; E348-R400 PolarHBondContact OE2-NH1 2.95Å; E348-R400 VanDerWaalsContact OE2-NH1 3.17Å; E348-R400 IonicContact OE2-NH2 3.91Å; E348-R400 PolarHBondContact OE2-NH2 2.9Å; L398-R400 PolarHBondContact O-N 2.86Å
401	E	40.4	Very low	55.9	Low	186 Å²	186	110 Å²	110	87%	0.869	56%	0.557	S	S	*	*			trans	-169.9	49.7	153.9	-107.6	176.2	-149.7	0	0	109.4	T399 D403	T399-E401 PolarHBondContact O-N 3.39Å; E401-D403 PolarHBondContact O-N 3.38Å
402	H	47.2	Very low	56.8	Low	135 Å²	135	106.3 Å²	106.3	63%	0.625	54%	0.538	S	S	*	.			trans	-71.4	93.4	156	-83.7	-52.3	0	0	0	107.3	A404	H402-A404 PolarHBondContact O-N 2.78Å
403	D	45.6	Very low	58.1	Low	76 Å²	76	99.3 Å²	99.3	41%	0.406	51%	0.505	S	S	.	.			trans	-34.7	97	173	-155.9	-2.6	0	0	0	110.5	E401 N405 K406	E401-D403 PolarHBondContact O-N 3.38Å; D403-N405 PolarHBondContact O-N 3.41Å; D403-N405 PolarHBondContact OD1-ND2 3.39Å; D403-K406 HydrophobicContact CB-CD 4.18Å; D403-K406 HydrophobicContact CB-CG 4.3Å; D403-K406 WeakPolarHBondContact O-CB 3.04Å; D403-K406 PolarHBondContact O-N 2.87Å; D403-K406 WeakPolarHBondContact OD2-CE 3.1Å; D403-K406 IonicContact OD2-NZ 3.47Å
404	A	50.5	Low	59.6	Low	58 Å²	58	97.6 Å²	97.6	48%	0.479	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-55	-21	-175.2	0	0	0	0	0	112.2	H402 K406 I407	H402-A404 PolarHBondContact O-N 2.78Å; A404-K406 PolarHBondContact O-N 3.38Å; A404-I407 PolarHBondContact O-N 2.99Å
405	N	50	Low	61.8	Low	150 Å²	150	92.6 Å²	92.6	80%	0.802	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-61.9	-13.8	172.2	-62.6	-41.8	0	0	0	114.7	D403	D403-N405 PolarHBondContact O-N 3.41Å; D403-N405 PolarHBondContact OD1-ND2 3.39Å
406	K	55.6	Low	63.8	Low	149 Å²	149	89.5 Å²	89.5	65%	0.648	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-99	-10.7	-179.4	-65.4	-179.7	-174.9	170.1	0	114	D403 A404	D403-K406 HydrophobicContact CB-CD 4.18Å; D403-K406 HydrophobicContact CB-CG 4.3Å; D403-K406 WeakPolarHBondContact O-CB 3.04Å; D403-K406 PolarHBondContact O-N 2.87Å; D403-K406 WeakPolarHBondContact OD2-CE 3.1Å; D403-K406 IonicContact OD2-NZ 3.47Å; A404-K406 PolarHBondContact O-N 3.38Å
407	I	68.7	Low	66.1	Low	36 Å²	36	87.8 Å²	87.8	19%	0.185	43%	0.428	C	S	.	.	S	Bend	trans	-88	125.4	-179.6	-60.9	178.6	0	0	0	109.2	T368 F370 V383 H385 A404 Y409	T368-I407 HydrophobicContact CG2-CG2 4.35Å; F370-I407 HydrophobicContact CE1-CG2 4.19Å; F370-I407 HydrophobicContact CZ-CG2 3.96Å; V383-I407 HydrophobicContact CG1-CD1 4.21Å; H385-I407 HydrophobicContact CB-CD1 3.83Å; A404-I407 PolarHBondContact O-N 2.99Å; I407-Y409 PolarHBondContact O-N 3.13Å
408	N	72.3	Confident	68.6	Low	57 Å²	57	82.3 Å²	82.3	31%	0.305	40%	0.404	S	S	.	.			trans	-73.4	110	176.7	-173	-10.9	0	0	0	110.2	M410	N408-M410 WeakPolarHBondContact OD1-CB 3.33Å; N408-M410 PolarHBondContact OD1-N 3.16Å
409	Y	80.5	Confident	70.8	Confident	148 Å²	148	82.2 Å²	82.2	58%	0.58	40%	0.402	S	S	*	.			trans	-90.9	2.6	-179.7	52.7	-93.8	0	0	0	113.6	I407 Y411 A412 Q413	I407-Y409 PolarHBondContact O-N 3.13Å; Y409-Y411 PolarHBondContact O-N 2.85Å; Y409-A412 PolarHBondContact O-N 2.96Å; Y409-Q413 WeakPolarHBondContact O-CB 3.45Å; Y409-Q413 PolarHBondContact O-N 2.79Å
410	M	83.6	Confident	73.2	Confident	35 Å²	35	82 Å²	82	17%	0.172	39%	0.391	C	S	.	.	H	α-helix	trans	-61.3	-44.4	-176	175.3	-179.6	60.9	0	0	113.3	N408 Q413 Y414 F433 W435 T436	N408-M410 WeakPolarHBondContact OD1-CB 3.33Å; N408-M410 PolarHBondContact OD1-N 3.16Å; M410-Q413 PolarHBondContact O-N 3.2Å; M410-Y414 PolarHBondContact O-N 3.24Å; M410-F433 HydrophobicContact CE-CB 3.84Å; M410-F433 HydrophobicContact CE-CD1 3.54Å; M410-F433 HydrophobicContact CE-CE1 4.4Å; M410-F433 HydrophobicContact CE-CG 3.98Å; M410-F433 HydrophobicContact CG-CD1 3.96Å; M410-F433 HydrophobicContact CG-CE1 4.04Å; M410-F433 HydrophobicContact SD-CD1 3.57Å; M410-F433 VanDerWaalsContact SD-CD1 3.57Å; M410-F433 HydrophobicContact SD-CE1 4.25Å; M410-F433 HydrophobicContact SD-CG 4.49Å; M410-W435 HydrophobicContact SD-CZ2 4.26Å; M410-W435 PolarHBondContact SD-NE1 3.32Å; M410-T436 HydrophobicContact CE-CG2 3.7Å
411	Y	88.8	Confident	75.3	Confident	3 Å²	3	75.7 Å²	75.7	1%	0.012	38%	0.375	C	S	.	.	H	α-helix	trans	-65.4	-43.7	178.6	-54.8	-65	0	0	0	110.6	Y409 Q413 Y414 V415 L422 I424 V427 F433 L451	Y409-Y411 PolarHBondContact O-N 2.85Å; Y411-Q413 VanDerWaalsContact C-N 3.32Å; Y411-Q413 PolarHBondContact O-N 3.26Å; Y411-Y414 WeakPolarHBondContact O-CB 3.5Å; Y411-Y414 PolarHBondContact O-N 3.05Å; Y411-V415 WeakPolarHBondContact O-CG2 3.4Å; Y411-V415 PolarHBondContact O-N 2.95Å; Y411-L422 HydrophobicContact CD1-CD2 4.23Å; Y411-I424 HydrophobicContact CD1-CD1 4.22Å; Y411-I424 HydrophobicContact CE1-CD1 4.01Å; Y411-V427 VanDerWaalsContact OH-CG1 3.31Å; Y411-V427 WeakPolarHBondContact OH-CG1 3.31Å; Y411-F433 HydrophobicContact CD1-CD1 4.21Å; Y411-F433 HydrophobicContact CD1-CD2 4.02Å; Y411-F433 HydrophobicContact CD1-CE1 4.1Å; Y411-F433 AromaticContact CD1-CE2 3.92Å; Y411-F433 HydrophobicContact CD1-CE2 3.92Å; Y411-F433 HydrophobicContact CD1-CG 4.15Å; Y411-F433 AromaticContact CD1-CZ 3.94Å; Y411-F433 HydrophobicContact CD1-CZ 3.94Å; Y411-F433 HydrophobicContact CE1-CB 4.05Å; Y411-F433 HydrophobicContact CE1-CD1 4.05Å; Y411-F433 AromaticContact CE1-CD2 3.62Å; Y411-F433 HydrophobicContact CE1-CD2 3.62Å; Y411-F433 HydrophobicContact CE1-CE1 4.39Å; Y411-F433 HydrophobicContact CE1-CE2 4.01Å; Y411-F433 AromaticContact CE1-CG 3.63Å; Y411-F433 HydrophobicContact CE1-CG 3.63Å; Y411-F433 HydrophobicContact CE1-CZ 4.36Å; Y411-L451 HydrophobicContact CD1-CD2 3.67Å; Y411-L451 HydrophobicContact CD2-CD1 4.32Å; Y411-L451 HydrophobicContact CD2-CD2 3.83Å; Y411-L451 HydrophobicContact CE1-CD2 4.12Å; Y411-L451 HydrophobicContact CE2-CD2 4.26Å; Y411-L451 HydrophobicContact CG-CD2 3.51Å
412	A	89.5	Confident	77.8	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-40.2	175.3	0	0	0	0	0	112	F370 F380 Y409 V415 K416 V467	F370-A412 HydrophobicContact CD1-CB 4.25Å; F370-A412 HydrophobicContact CD2-CB 3.48Å; F370-A412 VanDerWaalsContact CD2-CB 3.48Å; F370-A412 HydrophobicContact CE1-CB 4.3Å; F370-A412 HydrophobicContact CE2-CB 3.52Å; F370-A412 HydrophobicContact CG-CB 3.87Å; F370-A412 HydrophobicContact CZ-CB 3.96Å; F380-A412 HydrophobicContact CE2-CB 4.11Å; F380-A412 HydrophobicContact CZ-CB 3.78Å; Y409-A412 PolarHBondContact O-N 2.96Å; A412-V415 PolarHBondContact O-N 3.47Å; A412-K416 WeakPolarHBondContact O-CB 3.39Å; A412-K416 PolarHBondContact O-N 3.41Å; A412-V467 HydrophobicContact CB-CB 4.23Å; A412-V467 HydrophobicContact CB-CG1 3.98Å
413	Q	87.5	Confident	80	Confident	35 Å²	35	61.9 Å²	61.9	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-41	176.6	-167.8	70	9.2	0	0	111.8	Y409 M410 Y411 K416 N417	Y409-Q413 WeakPolarHBondContact O-CB 3.45Å; Y409-Q413 PolarHBondContact O-N 2.79Å; M410-Q413 PolarHBondContact O-N 3.2Å; Y411-Q413 VanDerWaalsContact C-N 3.32Å; Y411-Q413 PolarHBondContact O-N 3.26Å; Q413-K416 PolarHBondContact O-N 3.47Å; Q413-N417 WeakPolarHBondContact O-CB 3.41Å; Q413-N417 PolarHBondContact O-N 2.89Å; Q413-N417 PolarHBondContact O-ND2 3.49Å
414	Y	89.8	Confident	82.2	Confident	87 Å²	87	58.3 Å²	58.3	34%	0.341	29%	0.293	S	S	.	.	H	α-helix	trans	-57.6	-50.7	174	178.2	-89.5	0	0	0	110.4	M410 Y411 K416 N417 T418 L422 F433	M410-Y414 PolarHBondContact O-N 3.24Å; Y411-Y414 WeakPolarHBondContact O-CB 3.5Å; Y411-Y414 PolarHBondContact O-N 3.05Å; Y414-K416 PolarHBondContact O-N 3.48Å; Y414-N417 PolarHBondContact O-N 3Å; Y414-N417 VanDerWaalsContact O-N 3.16Å; Y414-T418 HydrophobicContact CD1-CG2 4.15Å; Y414-T418 HydrophobicContact CD2-CG2 4.35Å; Y414-T418 HydrophobicContact CE1-CG2 3.75Å; Y414-T418 HydrophobicContact CE2-CG2 3.98Å; Y414-T418 HydrophobicContact CG-CG2 4.43Å; Y414-T418 WeakPolarHBondContact O-CG2 3.48Å; Y414-T418 PolarHBondContact O-N 3.12Å; Y414-T418 PolarHBondContact O-OG1 3.3Å; Y414-T418 VanDerWaalsContact O-OG1 3.11Å; Y414-L422 HydrophobicContact CD1-CD2 3.98Å; Y414-L422 HydrophobicContact CE1-CD1 4.26Å; Y414-F433 HydrophobicContact CD1-CZ 4.38Å; Y414-F433 HydrophobicContact CD2-CE1 4.44Å; Y414-F433 HydrophobicContact CD2-CZ 4.15Å; Y414-F433 HydrophobicContact CG-CE1 4.44Å; Y414-F433 AromaticContact CG-CZ 3.98Å; Y414-F433 HydrophobicContact CG-CZ 3.98Å
415	V	91.9	Very high	83.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-38	179.1	169.7	0	0	0	0	112.6	Y411 A412 N417 M419 L422 C453 P455 V467	Y411-V415 WeakPolarHBondContact O-CG2 3.4Å; Y411-V415 PolarHBondContact O-N 2.95Å; A412-V415 PolarHBondContact O-N 3.47Å; V415-N417 VanDerWaalsContact C-N 3.27Å; V415-N417 PolarHBondContact O-N 3.3Å; V415-M419 WeakPolarHBondContact O-CA 3.39Å; V415-M419 PolarHBondContact O-N 3.47Å; V415-L422 HydrophobicContact CG2-CB 3.55Å; V415-L422 HydrophobicContact CG2-CD2 4.23Å; V415-C453 HydrophobicContact CG2-CB 3.97Å; V415-P455 HydrophobicContact CG1-CB 3.84Å; V415-P455 VanDerWaalsContact CG1-CD 3.45Å; V415-P455 HydrophobicContact CG1-CG 4.04Å; V415-V467 HydrophobicContact CB-CG1 4.1Å; V415-V467 HydrophobicContact CG1-CG1 3.85Å
416	K	88.9	Confident	85.6	Confident	23 Å²	23	54.5 Å²	54.5	10%	0.1	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-44.3	172.8	-176.2	-169.8	-180	-176.6	0	110.7	V372 S377 S379 F380 A412 Q413 Y414 V464 V467	V372-K416 HydrophobicContact CG2-CD 4.05Å; V372-K416 HydrophobicContact CG2-CG 4.26Å; S377-K416 PolarHBondContact O-NZ 3.24Å; S379-K416 PolarHBondContact O-NZ 3.13Å; F380-K416 HydrophobicContact CE1-CD 4.06Å; F380-K416 HydrophobicContact CZ-CB 4.45Å; F380-K416 HydrophobicContact CZ-CD 4.2Å; A412-K416 WeakPolarHBondContact O-CB 3.39Å; A412-K416 PolarHBondContact O-N 3.41Å; Q413-K416 PolarHBondContact O-N 3.47Å; Y414-K416 PolarHBondContact O-N 3.48Å; K416-V464 HydrophobicContact CG-CG1 4.44Å; K416-V467 HydrophobicContact CB-CG2 4.09Å
417	N	87.6	Confident	86.9	Confident	110 Å²	110	47.9 Å²	47.9	59%	0.588	24%	0.241	S	C	*	.	H	α-helix	trans	-78.5	-39.1	-175.6	-68.2	-11	0	0	0	113.2	Q413 Y414 V415	Q413-N417 WeakPolarHBondContact O-CB 3.41Å; Q413-N417 PolarHBondContact O-N 2.89Å; Q413-N417 PolarHBondContact O-ND2 3.49Å; Y414-N417 PolarHBondContact O-N 3Å; Y414-N417 VanDerWaalsContact O-N 3.16Å; V415-N417 VanDerWaalsContact C-N 3.27Å; V415-N417 PolarHBondContact O-N 3.3Å
418	T	90.3	Very high	87.4	Confident	49 Å²	49	50 Å²	50	30%	0.301	26%	0.258	S	S	.	.	H	α-helix	trans	-80.8	-24.6	178.8	59.3	0	0	0	0	112.7	Y414 E420	Y414-T418 HydrophobicContact CD1-CG2 4.15Å; Y414-T418 HydrophobicContact CD2-CG2 4.35Å; Y414-T418 HydrophobicContact CE1-CG2 3.75Å; Y414-T418 HydrophobicContact CE2-CG2 3.98Å; Y414-T418 HydrophobicContact CG-CG2 4.43Å; Y414-T418 WeakPolarHBondContact O-CG2 3.48Å; Y414-T418 PolarHBondContact O-N 3.12Å; Y414-T418 PolarHBondContact O-OG1 3.3Å; Y414-T418 VanDerWaalsContact O-OG1 3.11Å; T418-E420 PolarHBondContact O-N 2.95Å; T418-E420 PolarHBondContact OG1-N 3.3Å
419	M	89.2	Confident	87.9	Confident	67 Å²	67	54.8 Å²	54.8	33%	0.33	28%	0.277	S	S	.	.			trans	59.3	20.8	-172.5	-52.3	178.8	56.6	0	0	114	V415 K457 N462 V464	V415-M419 WeakPolarHBondContact O-CA 3.39Å; V415-M419 PolarHBondContact O-N 3.47Å; M419-K457 WeakPolarHBondContact O-CE 3.16Å; M419-K457 PolarHBondContact O-NZ 3.19Å; M419-N462 WeakPolarHBondContact CE-O 3.41Å; M419-V464 HydrophobicContact CB-CG2 4.39Å; M419-V464 HydrophobicContact CE-CG2 4.19Å; M419-V464 HydrophobicContact CG-CG2 3.82Å
420	E	90.7	Very high	87.9	Confident	130 Å²	130	49.1 Å²	49.1	61%	0.607	26%	0.256	S	S	*	.	S	Bend	trans	-121.1	147.5	-179.3	-72.4	-174.7	168.2	0	0	110.9	T418	T418-E420 PolarHBondContact O-N 2.95Å; T418-E420 PolarHBondContact OG1-N 3.3Å
421	P	92.4	Very high	87.7	Confident	56 Å²	56	56.7 Å²	56.7	36%	0.364	29%	0.288	S	S	.	.			trans	-63.6	149.1	175.1	30.4	-37.3	0	0	0	111.6	C453 T454 E493	P421-C453 CarbonylContact C-O 3.54Å; P421-C453 WeakPolarHBondContact CA-O 3.5Å; P421-T454 HydrophobicContact CB-CG2 4.48Å; P421-E493 WeakPolarHBondContact CG-OE1 3.47Å
422	L	93.9	Very high	87.3	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	108.5	-180	174.8	65.6	0	0	0	109.3	Y411 Y414 V415 I424 F433 L451 L452 C453	Y411-L422 HydrophobicContact CD1-CD2 4.23Å; Y414-L422 HydrophobicContact CD1-CD2 3.98Å; Y414-L422 HydrophobicContact CE1-CD1 4.26Å; V415-L422 HydrophobicContact CG2-CB 3.55Å; V415-L422 HydrophobicContact CG2-CD2 4.23Å; L422-I424 HydrophobicContact CD1-CD1 4.28Å; L422-I424 HydrophobicContact CD1-CG1 4Å; L422-I424 HydrophobicContact CD2-CD1 4.17Å; L422-I424 HydrophobicContact CG-CD1 4.23Å; L422-I424 HydrophobicContact CG-CG1 4.05Å; L422-F433 HydrophobicContact CD2-CE2 4.05Å; L422-F433 HydrophobicContact CD2-CZ 4.02Å; L422-L451 HydrophobicContact CD2-CD2 4.42Å; L422-L452 CarbonylContact O-C 3.59Å; L422-L452 WeakPolarHBondContact O-CA 3.44Å; L422-C453 HydrophobicContact CB-CB 4.37Å; L422-C453 PolarHBondContact N-O 3.36Å; L422-C453 PolarHBondContact O-N 3.08Å
423	N	93.5	Very high	86.8	Confident	28 Å²	28	62.8 Å²	62.8	15%	0.15	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129	168.4	-174.2	-2.4	0	0	0	110.1	L451 L452 F484 E489	N423-L451 PolarHBondContact OD1-O 3.06Å; N423-L452 HydrophobicContact CB-CD1 3.92Å; N423-F484 PolarHBondContact ND2-O 3.5Å; N423-E489 HydrophobicContact CB-CG 4.21Å; N423-E489 WeakPolarHBondContact CB-OE1 3.25Å; N423-E489 VanDerWaalsContact CG-OE1 3.29Å; N423-E489 PolarHBondContact ND2-OE1 2.91Å
424	I	91.1	Very high	85.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	104.8	174.8	-50.6	-178.6	0	0	0	108.1	Y411 L422 D426 V427 D430 F433 S450 L451	Y411-I424 HydrophobicContact CD1-CD1 4.22Å; Y411-I424 HydrophobicContact CE1-CD1 4.01Å; L422-I424 HydrophobicContact CD1-CD1 4.28Å; L422-I424 HydrophobicContact CD1-CG1 4Å; L422-I424 HydrophobicContact CD2-CD1 4.17Å; L422-I424 HydrophobicContact CG-CD1 4.23Å; L422-I424 HydrophobicContact CG-CG1 4.05Å; I424-D426 VanDerWaalsContact C-N 3.32Å; I424-D426 PolarHBondContact O-N 2.85Å; I424-V427 HydrophobicContact CB-CG2 4.21Å; I424-V427 HydrophobicContact CG2-CB 4.4Å; I424-V427 HydrophobicContact CG2-CG2 3.87Å; I424-D430 HydrophobicContact CG2-CB 3.77Å; I424-F433 HydrophobicContact CD1-CD2 3.96Å; I424-F433 HydrophobicContact CD1-CE2 3.88Å; I424-S450 WeakPolarHBondContact O-CA 3.41Å; I424-L451 HydrophobicContact CB-CB 4.18Å; I424-L451 HydrophobicContact CD1-CD2 3.83Å; I424-L451 HydrophobicContact CG1-CD2 4.31Å; I424-L451 PolarHBondContact N-O 2.98Å; I424-L451 PolarHBondContact O-N 3.29Å
425	P	86.3	Confident	83.7	Confident	80 Å²	80	68 Å²	68	52%	0.519	34%	0.338	S	S	.	.	S	Bend	trans	-61.3	-38.5	179.2	-27.1	35.7	0	0	0	113.6	P483	P425-P483 HydrophobicContact CB-CB 3.79Å
426	D	84.8	Confident	82	Confident	47 Å²	47	69.7 Å²	69.7	25%	0.251	35%	0.348	S	S	.	.			trans	-144.5	103.4	178.7	-172.4	-16.4	0	0	0	109.9	I424 S428 K429 D430 R449	I424-D426 VanDerWaalsContact C-N 3.32Å; I424-D426 PolarHBondContact O-N 2.85Å; D426-S428 PolarHBondContact O-N 3.2Å; D426-S428 WeakPolarHBondContact OD1-CB 3.5Å; D426-S428 PolarHBondContact OD1-N 3.4Å; D426-S428 VanDerWaalsContact OD1-N 3.08Å; D426-S428 PolarHBondContact OD1-OG 3.43Å; D426-K429 HydrophobicContact CB-CB 4.4Å; D426-K429 HydrophobicContact CB-CD 4.19Å; D426-K429 HydrophobicContact CB-CG 4.4Å; D426-K429 PolarHBondContact O-N 2.9Å; D426-K429 VanDerWaalsContact O-N 3.09Å; D426-K429 WeakPolarHBondContact OD2-CD 3.42Å; D426-K429 WeakPolarHBondContact OD2-CE 3.25Å; D426-K429 IonicContact OD2-NZ 2.66Å; D426-K429 PolarHBondContact OD2-NZ 3.26Å; D426-D430 PolarHBondContact O-N 2.97Å; D426-R449 CarbonylContact C-O 3.55Å; D426-R449 VanDerWaalsContact CA-O 3.24Å; D426-R449 WeakPolarHBondContact CA-O 3.21Å
427	V	84.6	Confident	80.2	Confident	11 Å²	11	72.3 Å²	72.3	7%	0.067	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-60.5	-31.2	-176.8	175.5	0	0	0	0	112	Y411 I424 K429 D430 I448 R449 L451	Y411-V427 VanDerWaalsContact OH-CG1 3.31Å; Y411-V427 WeakPolarHBondContact OH-CG1 3.31Å; I424-V427 HydrophobicContact CB-CG2 4.21Å; I424-V427 HydrophobicContact CG2-CB 4.4Å; I424-V427 HydrophobicContact CG2-CG2 3.87Å; V427-K429 PolarHBondContact O-N 3.37Å; V427-D430 PolarHBondContact O-N 2.92Å; V427-I448 HydrophobicContact CG2-CG2 3.81Å; V427-R449 PolarHBondContact N-O 3.42Å; V427-L451 HydrophobicContact CG2-CB 4Å
428	S	79.1	Confident	78.1	Confident	79 Å²	79	75 Å²	75	55%	0.552	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.4	-19.8	179.4	72.1	0	0	0	0	113.7	D426	D426-S428 PolarHBondContact O-N 3.2Å; D426-S428 WeakPolarHBondContact OD1-CB 3.5Å; D426-S428 PolarHBondContact OD1-N 3.4Å; D426-S428 VanDerWaalsContact OD1-N 3.08Å; D426-S428 PolarHBondContact OD1-OG 3.43Å
429	K	81.4	Confident	75.9	Confident	159 Å²	159	78.4 Å²	78.4	69%	0.691	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-102.4	-7.1	-178.9	-65.5	177.7	-175.1	135.1	0	113.2	D426 V427 K431	D426-K429 HydrophobicContact CB-CB 4.4Å; D426-K429 HydrophobicContact CB-CD 4.19Å; D426-K429 HydrophobicContact CB-CG 4.4Å; D426-K429 PolarHBondContact O-N 2.9Å; D426-K429 VanDerWaalsContact O-N 3.09Å; D426-K429 WeakPolarHBondContact OD2-CD 3.42Å; D426-K429 WeakPolarHBondContact OD2-CE 3.25Å; D426-K429 IonicContact OD2-NZ 2.66Å; D426-K429 PolarHBondContact OD2-NZ 3.26Å; V427-K429 PolarHBondContact O-N 3.37Å; K429-K431 PolarHBondContact O-N 3.08Å
430	D	81.2	Confident	73.8	Confident	28 Å²	28	81.1 Å²	81.1	15%	0.15	41%	0.412	C	S	.	.			trans	-78	116.8	-176.5	-163	-52	0	0	0	111.2	I424 D426 V427 R432	I424-D430 HydrophobicContact CG2-CB 3.77Å; D426-D430 PolarHBondContact O-N 2.97Å; V427-D430 PolarHBondContact O-N 2.92Å; D430-R432 VanDerWaalsContact C-N 3.32Å; D430-R432 PolarHBondContact O-N 3.39Å; D430-R432 WeakPolarHBondContact OD1-CA 3.15Å; D430-R432 WeakPolarHBondContact OD1-CB 3.26Å; D430-R432 WeakPolarHBondContact OD1-CG 3.28Å; D430-R432 PolarHBondContact OD1-N 3.28Å; D430-R432 IonicContact OD1-NE 3.26Å; D430-R432 PolarHBondContact OD1-NE 3.38Å; D430-R432 IonicContact OD2-CZ 3.45Å; D430-R432 IonicContact OD2-NE 3.73Å; D430-R432 PolarHBondContact OD2-NE 2.9Å; D430-R432 IonicContact OD2-NH2 3.75Å; D430-R432 PolarHBondContact OD2-NH2 2.96Å
431	K	78.9	Confident	71.5	Confident	195 Å²	195	78 Å²	78	85%	0.848	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.1	-177.5	-63.2	-177.6	-179	178.1	0	113.7	K429 F433	K429-K431 PolarHBondContact O-N 3.08Å; K431-F433 VanDerWaalsContact C-N 3.27Å; K431-F433 PolarHBondContact O-N 3.3Å
432	R	81.1	Confident	69.1	Low	119 Å²	119	81.7 Å²	81.7	45%	0.449	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.3	-180	-60.9	174.1	-74.1	-173.9	-3.6	112.1	D430 P434	D430-R432 VanDerWaalsContact C-N 3.32Å; D430-R432 PolarHBondContact O-N 3.39Å; D430-R432 WeakPolarHBondContact OD1-CA 3.15Å; D430-R432 WeakPolarHBondContact OD1-CB 3.26Å; D430-R432 WeakPolarHBondContact OD1-CG 3.28Å; D430-R432 PolarHBondContact OD1-N 3.28Å; D430-R432 IonicContact OD1-NE 3.26Å; D430-R432 PolarHBondContact OD1-NE 3.38Å; D430-R432 IonicContact OD2-CZ 3.45Å; D430-R432 IonicContact OD2-NE 3.73Å; D430-R432 PolarHBondContact OD2-NE 2.9Å; D430-R432 IonicContact OD2-NH2 3.75Å; D430-R432 PolarHBondContact OD2-NH2 2.96Å; R432-P434 VanDerWaalsContact C-CD 3.45Å; R432-P434 WeakPolarHBondContact O-CD 3.45Å
433	F	79.3	Confident	66.5	Low	11 Å²	11	88.7 Å²	88.7	5%	0.048	47%	0.474	C	S	.	.	S	Bend	trans	-129.3	60.3	-173.9	-55.9	-72.9	0	0	0	113.1	M410 Y411 Y414 L422 I424 K431 W435 T436	M410-F433 HydrophobicContact CE-CB 3.84Å; M410-F433 HydrophobicContact CE-CD1 3.54Å; M410-F433 HydrophobicContact CE-CE1 4.4Å; M410-F433 HydrophobicContact CE-CG 3.98Å; M410-F433 HydrophobicContact CG-CD1 3.96Å; M410-F433 HydrophobicContact CG-CE1 4.04Å; M410-F433 HydrophobicContact SD-CD1 3.57Å; M410-F433 VanDerWaalsContact SD-CD1 3.57Å; M410-F433 HydrophobicContact SD-CE1 4.25Å; M410-F433 HydrophobicContact SD-CG 4.49Å; Y411-F433 HydrophobicContact CD1-CD1 4.21Å; Y411-F433 HydrophobicContact CD1-CD2 4.02Å; Y411-F433 HydrophobicContact CD1-CE1 4.1Å; Y411-F433 AromaticContact CD1-CE2 3.92Å; Y411-F433 HydrophobicContact CD1-CE2 3.92Å; Y411-F433 HydrophobicContact CD1-CG 4.15Å; Y411-F433 AromaticContact CD1-CZ 3.94Å; Y411-F433 HydrophobicContact CD1-CZ 3.94Å; Y411-F433 HydrophobicContact CE1-CB 4.05Å; Y411-F433 HydrophobicContact CE1-CD1 4.05Å; Y411-F433 AromaticContact CE1-CD2 3.62Å; Y411-F433 HydrophobicContact CE1-CD2 3.62Å; Y411-F433 HydrophobicContact CE1-CE1 4.39Å; Y411-F433 HydrophobicContact CE1-CE2 4.01Å; Y411-F433 AromaticContact CE1-CG 3.63Å; Y411-F433 HydrophobicContact CE1-CG 3.63Å; Y411-F433 HydrophobicContact CE1-CZ 4.36Å; Y414-F433 HydrophobicContact CD1-CZ 4.38Å; Y414-F433 HydrophobicContact CD2-CE1 4.44Å; Y414-F433 HydrophobicContact CD2-CZ 4.15Å; Y414-F433 HydrophobicContact CG-CE1 4.44Å; Y414-F433 AromaticContact CG-CZ 3.98Å; Y414-F433 HydrophobicContact CG-CZ 3.98Å; L422-F433 HydrophobicContact CD2-CE2 4.05Å; L422-F433 HydrophobicContact CD2-CZ 4.02Å; I424-F433 HydrophobicContact CD1-CD2 3.96Å; I424-F433 HydrophobicContact CD1-CE2 3.88Å; K431-F433 VanDerWaalsContact C-N 3.27Å; K431-F433 PolarHBondContact O-N 3.3Å; F433-W435 PolarHBondContact O-N 3.47Å; F433-T436 PolarHBondContact O-OG1 3.38Å
434	P	58	Low	64.1	Low	65 Å²	65	92 Å²	92	42%	0.422	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-67.7	-33.8	-164.6	24	-32.5	0	0	0	115.4	R432 T436 T437	R432-P434 VanDerWaalsContact C-CD 3.45Å; R432-P434 WeakPolarHBondContact O-CD 3.45Å; P434-T436 PolarHBondContact O-N 2.94Å; P434-T436 VanDerWaalsContact O-N 3.11Å; P434-T437 PolarHBondContact O-N 3.39Å; P434-T437 PolarHBondContact O-OG1 2.92Å
435	W	54.3	Low	62	Low	166 Å²	166	97.8 Å²	97.8	63%	0.629	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-71.6	-1.7	-176.1	35.4	63.8	0	0	0	115.2	M410 F433	M410-W435 HydrophobicContact SD-CZ2 4.26Å; M410-W435 PolarHBondContact SD-NE1 3.32Å; F433-W435 PolarHBondContact O-N 3.47Å
436	T	55.3	Low	60.5	Low	37 Å²	37	98.6 Å²	98.6	23%	0.227	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-79.9	-17.5	176.9	57.3	0	0	0	0	113.5	M410 F433 P434	M410-T436 HydrophobicContact CE-CG2 3.7Å; F433-T436 PolarHBondContact O-OG1 3.38Å; P434-T436 PolarHBondContact O-N 2.94Å; P434-T436 VanDerWaalsContact O-N 3.11Å
437	T	50.2	Low	59.7	Low	78 Å²	78	100.7 Å²	100.7	48%	0.479	54%	0.541	S	S	.	.	S	Bend	trans	-88.4	-22.6	178.6	43.5	0	0	0	0	113.6	P434	P434-T437 PolarHBondContact O-N 3.39Å; P434-T437 PolarHBondContact O-OG1 2.92Å
438	E	45	Very low	59.5	Low	166 Å²	166	103 Å²	103	78%	0.776	55%	0.552	S	S	*	*	S	Bend	trans	-89.4	-12.2	-172.5	-66.4	-174.2	162	0	0	114.7
439	N	44.3	Very low	59.8	Low	121 Å²	121	106.6 Å²	106.6	65%	0.647	55%	0.553	S	S	*	*			trans	-105.9	36.7	-172.5	-123.7	2.1	0	0	0	113.9	G441	N439-G441 PolarHBondContact O-N 3.06Å
440	T	45.5	Very low	60.3	Low	123 Å²	123	99 Å²	99	76%	0.755	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	3.7	-178.9	38.6	0	0	0	0	115.1
441	G	41.4	Very low	60.8	Low	65 Å²	65	97.7 Å²	97.7	67%	0.67	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-13.7	-177.4	0	0	0	0	0	116.3	N439	N439-G441 PolarHBondContact O-N 3.06Å
442	N	41.1	Very low	61.5	Low	133 Å²	133	88.4 Å²	88.4	71%	0.711	47%	0.473	S	S	*	.	S	Bend	trans	-104.9	111.5	178.9	-86.6	-14.5	0	0	0	111.5	S444	N442-S444 PolarHBondContact O-N 3.07Å
443	V	40.4	Very low	62.2	Low	150 Å²	150	82.8 Å²	82.8	91%	0.909	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	42.2	-165.7	-177.6	0	0	0	0	114.2
444	S	41.9	Very low	62.9	Low	97 Å²	97	82.4 Å²	82.4	68%	0.678	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.6	13.4	172.8	65.8	0	0	0	0	115.3	N442 Q446	N442-S444 PolarHBondContact O-N 3.07Å; S444-Q446 PolarHBondContact O-N 3.32Å
445	Q	48.8	Very low	64.7	Low	124 Å²	124	79.7 Å²	79.7	58%	0.579	43%	0.433	S	S	*	.			trans	-86	86.3	164.2	-76.4	178.4	-11.7	0	0	108.5	C447	Q445-C447 PolarHBondContact O-N 3.33Å; Q445-C447 VanDerWaalsContact O-N 3.12Å
446	Q	53.8	Low	66.5	Low	97 Å²	97	71.8 Å²	71.8	45%	0.453	40%	0.403	S	S	.	.			trans	-51	120.5	162.3	-79.7	172.1	-21.4	0	0	108.1	S444 I448	S444-Q446 PolarHBondContact O-N 3.32Å; Q446-I448 PolarHBondContact O-N 3.32Å
447	C	67.5	Low	68	Low	91 Å²	91	73.2 Å²	73.2	62%	0.615	41%	0.406	S	S	*	.			trans	-51.8	108.2	-169.6	-75.2	0	0	0	0	112.8	Q445 R449 N472	Q445-C447 PolarHBondContact O-N 3.33Å; Q445-C447 VanDerWaalsContact O-N 3.12Å; C447-R449 HydrophobicContact CB-CG 4.44Å; C447-R449 PolarHBondContact O-N 3.22Å; C447-N472 PolarHBondContact O-ND2 3.01Å; C447-N472 VanDerWaalsContact O-ND2 3.11Å
448	I	81.4	Confident	69.5	Low	59 Å²	59	70.1 Å²	70.1	30%	0.303	39%	0.386	S	S	.	.			trans	-66.3	113.9	164	-53	178.6	0	0	0	106.4	V427 Q446 L451 V471	V427-I448 HydrophobicContact CG2-CG2 3.81Å; Q446-I448 PolarHBondContact O-N 3.32Å; I448-L451 HydrophobicContact CG2-CB 4.44Å; I448-L451 HydrophobicContact CG2-CD1 4.21Å; I448-V471 HydrophobicContact CB-CG1 4.32Å; I448-V471 HydrophobicContact CG1-CG1 4.07Å; I448-V471 HydrophobicContact CG2-CG1 3.98Å; I448-V471 HydrophobicContact CG2-CG2 4.44Å
449	R	85.9	Confident	70.5	Confident	154 Å²	154	65.4 Å²	65.4	58%	0.581	38%	0.382	S	S	*	.			trans	-106	-49.1	178.6	-72.5	-176.1	178.9	172.3	1.9	111.2	D426 V427 C447 N472 V481	D426-R449 CarbonylContact C-O 3.55Å; D426-R449 VanDerWaalsContact CA-O 3.24Å; D426-R449 WeakPolarHBondContact CA-O 3.21Å; V427-R449 PolarHBondContact N-O 3.42Å; C447-R449 HydrophobicContact CB-CG 4.44Å; C447-R449 PolarHBondContact O-N 3.22Å; R449-N472 PolarHBondContact N-OD1 2.81Å; R449-V481 HydrophobicContact CB-CB 4.42Å; R449-V481 HydrophobicContact CB-CG1 3.96Å
450	S	90	Very high	71.5	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	39%	0.391	C	S	.	.	S	Bend	trans	-118.8	145.7	171.9	60.8	0	0	0	0	110.9	I424 N472 K473 V481 K482	I424-S450 WeakPolarHBondContact O-CA 3.41Å; S450-N472 PolarHBondContact N-OD1 3.33Å; S450-N472 VanDerWaalsContact N-OD1 3.16Å; S450-N472 PolarHBondContact O-N 3.3Å; S450-N472 WeakPolarHBondContact OG-CA 3.41Å; S450-K473 PolarHBondContact OG-N 3.21Å; S450-K473 VanDerWaalsContact OG-N 3.16Å; S450-V481 VanDerWaalsContact OG-CG1 3.28Å; S450-V481 WeakPolarHBondContact OG-CG1 3.46Å; S450-K482 WeakPolarHBondContact CB-O 3.37Å; S450-K482 PolarHBondContact OG-O 3.13Å
451	L	92.6	Very high	72.4	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.2	-175.5	-175	87.5	0	0	0	110.2	Y411 L422 N423 I424 V427 I448 Q469 L470 V471	Y411-L451 HydrophobicContact CD1-CD2 3.67Å; Y411-L451 HydrophobicContact CD2-CD1 4.32Å; Y411-L451 HydrophobicContact CD2-CD2 3.83Å; Y411-L451 HydrophobicContact CE1-CD2 4.12Å; Y411-L451 HydrophobicContact CE2-CD2 4.26Å; Y411-L451 HydrophobicContact CG-CD2 3.51Å; L422-L451 HydrophobicContact CD2-CD2 4.42Å; N423-L451 PolarHBondContact OD1-O 3.06Å; I424-L451 HydrophobicContact CB-CB 4.18Å; I424-L451 HydrophobicContact CD1-CD2 3.83Å; I424-L451 HydrophobicContact CG1-CD2 4.31Å; I424-L451 PolarHBondContact N-O 2.98Å; I424-L451 PolarHBondContact O-N 3.29Å; V427-L451 HydrophobicContact CG2-CB 4Å; I448-L451 HydrophobicContact CG2-CB 4.44Å; I448-L451 HydrophobicContact CG2-CD1 4.21Å; L451-Q469 HydrophobicContact CD1-CG 3.7Å; L451-L470 WeakPolarHBondContact CA-O 3.5Å; L451-V471 HydrophobicContact CD1-CG2 3.88Å
452	L	94.6	Very high	73.9	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.7	167.1	177.1	62.6	0	0	0	109	M362 L422 N423 L470 F484 D488 E489 L492	M362-L452 HydrophobicContact CE-CD2 4.16Å; L422-L452 CarbonylContact O-C 3.59Å; L422-L452 WeakPolarHBondContact O-CA 3.44Å; N423-L452 HydrophobicContact CB-CD1 3.92Å; L452-L470 HydrophobicContact CB-CB 4.45Å; L452-L470 HydrophobicContact CD2-CD1 4.49Å; L452-L470 PolarHBondContact N-O 3.11Å; L452-L470 PolarHBondContact O-N 3.45Å; L452-F484 HydrophobicContact CB-CB 4.35Å; L452-F484 HydrophobicContact CB-CD1 3.89Å; L452-F484 HydrophobicContact CB-CD2 3.66Å; L452-F484 HydrophobicContact CB-CE1 4Å; L452-F484 HydrophobicContact CB-CE2 3.81Å; L452-F484 HydrophobicContact CB-CG 3.71Å; L452-F484 HydrophobicContact CB-CZ 3.97Å; L452-F484 HydrophobicContact CD2-CB 4.44Å; L452-F484 HydrophobicContact CD2-CD1 3.83Å; L452-F484 HydrophobicContact CD2-CE1 4.27Å; L452-F484 HydrophobicContact CD2-CG 4.19Å; L452-D488 HydrophobicContact CD2-CB 4.31Å; L452-E489 HydrophobicContact CD1-CG 3.79Å; L452-L492 HydrophobicContact CD2-CB 4.17Å; L452-L492 HydrophobicContact CD2-CD2 3.65Å; L452-L492 HydrophobicContact CG-CD2 3.71Å
453	C	94.8	Very high	76	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	127.1	-175.9	-169.1	0	0	0	0	111	V415 P421 L422 V467 C468 Q469	V415-C453 HydrophobicContact CG2-CB 3.97Å; P421-C453 CarbonylContact C-O 3.54Å; P421-C453 WeakPolarHBondContact CA-O 3.5Å; L422-C453 HydrophobicContact CB-CB 4.37Å; L422-C453 PolarHBondContact N-O 3.36Å; L422-C453 PolarHBondContact O-N 3.08Å; C453-V467 WeakPolarHBondContact SG-CG1 3.48Å; C453-C468 CarbonylContact C-O 3.58Å; C453-C468 VanDerWaalsContact CA-O 3.25Å; C453-C468 WeakPolarHBondContact CA-O 3.27Å; C453-C468 PolarHBondContact SG-O 2.87Å; C453-C468 VanDerWaalsContact SG-O 3.34Å; C453-Q469 HydrophobicContact CB-CB 4.47Å; C453-Q469 HydrophobicContact CB-CG 4.31Å
454	T	95.3	Very high	78.3	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137.7	-170.9	-59.5	0	0	0	0	110.8	P421 C468 L492 E493 V496	P421-T454 HydrophobicContact CB-CG2 4.48Å; T454-C468 PolarHBondContact N-O 3.09Å; T454-C468 PolarHBondContact O-N 3.29Å; T454-L492 WeakPolarHBondContact OG1-CD2 3.44Å; T454-E493 HydrophobicContact CG2-CG 4Å; T454-V496 HydrophobicContact CG2-CG1 4.34Å; T454-V496 HydrophobicContact CG2-CG2 3.74Å
455	P	94	Very high	80.5	Confident	8 Å²	8	58.6 Å²	58.6	5%	0.052	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.9	179	29.8	-31.9	0	0	0	111.3	V415 K457 V464	V415-P455 HydrophobicContact CG1-CB 3.84Å; V415-P455 VanDerWaalsContact CG1-CD 3.45Å; V415-P455 HydrophobicContact CG1-CG 4.04Å; P455-K457 HydrophobicContact CB-CG 4.44Å; P455-V464 HydrophobicContact CB-CG1 4.24Å; P455-V464 HydrophobicContact CB-CG2 4.18Å
456	I	92.8	Very high	82.5	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	114.6	170.8	-52.7	176.6	0	0	0	107.4	I369 V464 I465 G466 C468 V496 G500 I503	I369-I456 HydrophobicContact CG2-CD1 3.79Å; I456-V464 WeakPolarHBondContact O-CA 3.48Å; I456-I465 HydrophobicContact CB-CG1 4.5Å; I456-I465 HydrophobicContact CG2-CD1 4.24Å; I456-I465 HydrophobicContact CG2-CG1 3.99Å; I456-I465 WeakPolarHBondContact O-CG1 3.26Å; I456-I465 PolarHBondContact O-N 2.94Å; I456-G466 WeakPolarHBondContact CA-O 3.25Å; I456-G466 WeakPolarHBondContact CB-O 3.34Å; I456-G466 PolarHBondContact N-O 2.67Å; I456-G466 PolarHBondContact O-N 3.27Å; I456-C468 HydrophobicContact CD1-CB 4.22Å; I456-C468 HydrophobicContact CG1-CB 4.27Å; I456-V496 HydrophobicContact CG1-CB 4.19Å; I456-V496 HydrophobicContact CG1-CG1 4.21Å; I456-G500 VanDerWaalsContact CG2-CA 3.41Å; I456-I503 HydrophobicContact CD1-CD1 4.17Å; I456-I503 HydrophobicContact CG2-CD1 4.46Å
457	K	87.7	Confident	84.4	Confident	66 Å²	66	48.1 Å²	48.1	29%	0.287	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.7	-174.2	-59.8	-176.7	-173.2	174.1	0	111.8	M419 P455 N462 K463 V464	M419-K457 WeakPolarHBondContact O-CE 3.16Å; M419-K457 PolarHBondContact O-NZ 3.19Å; P455-K457 HydrophobicContact CB-CG 4.44Å; K457-N462 WeakPolarHBondContact CD-OD1 3.14Å; K457-K463 CarbonylContact C-O 3.59Å; K457-K463 WeakPolarHBondContact CA-O 3.37Å; K457-V464 HydrophobicContact CG-CG2 4.4Å
458	N	80.5	Confident	85.8	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	22%	0.216	C	C	.	.			trans	-76.7	120.1	167.7	-176.2	-34.9	0	0	0	109.7	K460 K461 N462 K463 I465 Q504	N458-K460 PolarHBondContact O-N 3.5Å; N458-K460 VanDerWaalsContact O-N 3.07Å; N458-K460 PolarHBondContact OD1-N 3.32Å; N458-K461 PolarHBondContact O-N 3.41Å; N458-N462 PolarHBondContact O-N 3.1Å; N458-K463 PolarHBondContact N-O 3.4Å; N458-I465 HydrophobicContact CB-CG2 3.86Å; N458-Q504 VanDerWaalsContact CG-OE1 3.3Å; N458-Q504 VanDerWaalsContact ND2-CD 3.3Å; N458-Q504 PolarHBondContact ND2-NE2 2.82Å; N458-Q504 PolarHBondContact ND2-OE1 3.01Å; N458-Q504 PolarHBondContact OD1-OE1 3.28Å
459	G	66.7	Low	86.4	Confident	67 Å²	67	41.3 Å²	41.3	69%	0.691	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.5	-176.9	0	0	0	0	0	115.5
460	K	64	Low	86.8	Confident	190 Å²	190	34 Å²	34	83%	0.826	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-29.3	-179.7	-68.1	-176.2	179.6	176.5	0	114.6	N458	N458-K460 PolarHBondContact O-N 3.5Å; N458-K460 VanDerWaalsContact O-N 3.07Å; N458-K460 PolarHBondContact OD1-N 3.32Å
461	K	64.9	Low	86.8	Confident	156 Å²	156	34.2 Å²	34.2	68%	0.678	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-2.2	-171.2	-67.3	-175.4	179.8	177.8	0	113.8	N458 K463	N458-K461 PolarHBondContact O-N 3.41Å; K461-K463 HydrophobicContact CB-CB 4.2Å; K461-K463 PolarHBondContact O-N 3.15Å
462	N	73.9	Confident	86.7	Confident	102 Å²	102	34.5 Å²	34.5	55%	0.545	18%	0.178	S	C	.	.			trans	51.4	20.4	-170.5	-158.6	29.8	0	0	0	113.4	M419 K457 N458	M419-N462 WeakPolarHBondContact CE-O 3.41Å; K457-N462 WeakPolarHBondContact CD-OD1 3.14Å; N458-N462 PolarHBondContact O-N 3.1Å
463	K	84.1	Confident	86.6	Confident	73 Å²	73	35.2 Å²	35.2	32%	0.317	18%	0.181	S	C	.	.			trans	-83.4	136.3	-179.6	-177.5	178.4	177	-177.7	0	109.1	E374 K457 N458 K461 I465	E374-K463 VanDerWaalsContact CG-NZ 3.29Å; E374-K463 IonicContact OE1-NZ 2.7Å; E374-K463 PolarHBondContact OE1-NZ 2.92Å; K457-K463 CarbonylContact C-O 3.59Å; K457-K463 WeakPolarHBondContact CA-O 3.37Å; N458-K463 PolarHBondContact N-O 3.4Å; K461-K463 HydrophobicContact CB-CB 4.2Å; K461-K463 PolarHBondContact O-N 3.15Å; K463-I465 PolarHBondContact O-N 3Å
464	V	88.5	Confident	86.2	Confident	12 Å²	12	37.8 Å²	37.8	7%	0.073	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	117	172.9	-176.7	0	0	0	0	108.8	V372 K416 M419 P455 I456 K457 G466 V467	V372-V464 HydrophobicContact CG2-CG1 4.39Å; K416-V464 HydrophobicContact CG-CG1 4.44Å; M419-V464 HydrophobicContact CB-CG2 4.39Å; M419-V464 HydrophobicContact CE-CG2 4.19Å; M419-V464 HydrophobicContact CG-CG2 3.82Å; P455-V464 HydrophobicContact CB-CG1 4.24Å; P455-V464 HydrophobicContact CB-CG2 4.18Å; I456-V464 WeakPolarHBondContact O-CA 3.48Å; K457-V464 HydrophobicContact CG-CG2 4.4Å; V464-G466 WeakPolarHBondContact CG1-O 3.44Å; V464-V467 HydrophobicContact CG1-CG2 4.17Å
465	I	89.4	Confident	85.5	Confident	14 Å²	14	40.8 Å²	40.8	7%	0.072	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-14.5	177	57.3	170.2	0	0	0	112	V372 I456 N458 K463 G500 I503 Q504	V372-I465 PolarHBondContact N-O 3.4Å; I456-I465 HydrophobicContact CB-CG1 4.5Å; I456-I465 HydrophobicContact CG2-CD1 4.24Å; I456-I465 HydrophobicContact CG2-CG1 3.99Å; I456-I465 WeakPolarHBondContact O-CG1 3.26Å; I456-I465 PolarHBondContact O-N 2.94Å; N458-I465 HydrophobicContact CB-CG2 3.86Å; K463-I465 PolarHBondContact O-N 3Å; I465-G500 WeakPolarHBondContact CD1-O 3.38Å; I465-I503 HydrophobicContact CD1-CG2 4.49Å; I465-Q504 HydrophobicContact CD1-CB 4.5Å
466	G	91.3	Very high	84.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	178	174.4	0	0	0	0	0	112.1	F370 I456 V464	F370-G466 CarbonylContact O-C 3.59Å; F370-G466 VanDerWaalsContact O-C 3.31Å; F370-G466 WeakPolarHBondContact O-CA 3.43Å; I456-G466 WeakPolarHBondContact CA-O 3.25Å; I456-G466 WeakPolarHBondContact CB-O 3.34Å; I456-G466 PolarHBondContact N-O 2.67Å; I456-G466 PolarHBondContact O-N 3.27Å; V464-G466 WeakPolarHBondContact CG1-O 3.44Å
467	V	93.7	Very high	83.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.1	175.8	-178.4	0	0	0	0	108.8	I369 F370 F380 A412 V415 K416 C453 V464	I369-V467 CarbonylContact C-O 3.58Å; I369-V467 WeakPolarHBondContact CA-O 3.26Å; F370-V467 HydrophobicContact CB-CB 4.39Å; F370-V467 HydrophobicContact CD2-CB 4.46Å; F370-V467 PolarHBondContact N-O 3.09Å; F370-V467 PolarHBondContact O-N 2.92Å; F380-V467 HydrophobicContact CE1-CG2 4.17Å; A412-V467 HydrophobicContact CB-CB 4.23Å; A412-V467 HydrophobicContact CB-CG1 3.98Å; V415-V467 HydrophobicContact CB-CG1 4.1Å; V415-V467 HydrophobicContact CG1-CG1 3.85Å; K416-V467 HydrophobicContact CB-CG2 4.09Å; C453-V467 WeakPolarHBondContact SG-CG1 3.48Å; V464-V467 HydrophobicContact CG1-CG2 4.17Å
468	C	95.1	Very high	82.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.007	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.4	174.8	-173.4	0	0	0	0	109.2	C453 T454 I456 V496	C453-C468 CarbonylContact C-O 3.58Å; C453-C468 VanDerWaalsContact CA-O 3.25Å; C453-C468 WeakPolarHBondContact CA-O 3.27Å; C453-C468 PolarHBondContact SG-O 2.87Å; C453-C468 VanDerWaalsContact SG-O 3.34Å; T454-C468 PolarHBondContact N-O 3.09Å; T454-C468 PolarHBondContact O-N 3.29Å; I456-C468 HydrophobicContact CD1-CB 4.22Å; I456-C468 HydrophobicContact CG1-CB 4.27Å; C468-V496 HydrophobicContact CB-CG1 4.04Å
469	Q	94.3	Very high	81.8	Confident	6 Å²	6	50.9 Å²	50.9	3%	0.028	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.7	179.9	-175.4	-176.6	-67.4	0	0	110.1	T368 F370 L451 C453	T368-Q469 PolarHBondContact N-O 3.49Å; T368-Q469 PolarHBondContact O-N 2.89Å; F370-Q469 HydrophobicContact CE2-CB 3.94Å; L451-Q469 HydrophobicContact CD1-CG 3.7Å; C453-Q469 HydrophobicContact CB-CB 4.47Å; C453-Q469 HydrophobicContact CB-CG 4.31Å
470	L	94.8	Very high	82.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	135.9	177.8	-47.9	-172.5	0	0	0	110	I358 M362 V364 K366 C367 L451 L452 F484 L492	I358-L470 HydrophobicContact CG2-CD1 3.68Å; I358-L470 HydrophobicContact CG2-CD2 3.46Å; I358-L470 VanDerWaalsContact CG2-CD2 3.46Å; I358-L470 HydrophobicContact CG2-CG 4.24Å; M362-L470 HydrophobicContact CE-CD1 4.02Å; M362-L470 HydrophobicContact SD-CD1 3.53Å; M362-L470 VanDerWaalsContact SD-CD1 3.53Å; V364-L470 HydrophobicContact CB-CB 4.46Å; V364-L470 HydrophobicContact CG1-CB 4.13Å; V364-L470 HydrophobicContact CG1-CD1 4.19Å; V364-L470 HydrophobicContact CG2-CB 4.48Å; V364-L470 HydrophobicContact CG2-CD2 4.37Å; K366-L470 WeakPolarHBondContact O-CA 3.31Å; C367-L470 HydrophobicContact CB-CD2 3.97Å; L451-L470 WeakPolarHBondContact CA-O 3.5Å; L452-L470 HydrophobicContact CB-CB 4.45Å; L452-L470 HydrophobicContact CD2-CD1 4.49Å; L452-L470 PolarHBondContact N-O 3.11Å; L452-L470 PolarHBondContact O-N 3.45Å; L470-F484 HydrophobicContact CB-CE1 4.37Å; L470-F484 HydrophobicContact CB-CZ 3.99Å; L470-L492 HydrophobicContact CD1-CD1 4.13Å; L470-L492 HydrophobicContact CD1-CD2 3.73Å; L470-L492 HydrophobicContact CD1-CG 4.49Å; L470-L492 HydrophobicContact CG-CD2 4.04Å
471	V	91.1	Very high	83.5	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.042	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.1	-177.9	172.4	0	0	0	0	109.6	Q365 K366 I448 L451	Q365-V471 PolarHBondContact N-O 3.01Å; Q365-V471 VanDerWaalsContact N-O 3.1Å; K366-V471 HydrophobicContact CB-CB 4.17Å; K366-V471 PolarHBondContact N-O 3.02Å; K366-V471 PolarHBondContact O-N 2.89Å; I448-V471 HydrophobicContact CB-CG1 4.32Å; I448-V471 HydrophobicContact CG1-CG1 4.07Å; I448-V471 HydrophobicContact CG2-CG1 3.98Å; I448-V471 HydrophobicContact CG2-CG2 4.44Å; L451-V471 HydrophobicContact CD1-CG2 3.88Å
472	N	90.3	Very high	84.6	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.4	94.4	174.2	-66	-19.9	0	0	0	113.3	V364 Q365 C447 R449 S450 M474 V481	V364-N472 WeakPolarHBondContact CA-O 3.18Å; Q365-N472 HydrophobicContact CB-CB 3.87Å; Q365-N472 PolarHBondContact N-O 3.07Å; Q365-N472 PolarHBondContact OE1-ND2 2.95Å; C447-N472 PolarHBondContact O-ND2 3.01Å; C447-N472 VanDerWaalsContact O-ND2 3.11Å; R449-N472 PolarHBondContact N-OD1 2.81Å; S450-N472 PolarHBondContact N-OD1 3.33Å; S450-N472 VanDerWaalsContact N-OD1 3.16Å; S450-N472 PolarHBondContact O-N 3.3Å; S450-N472 WeakPolarHBondContact OG-CA 3.41Å; N472-M474 HydrophobicContact CB-SD 4.41Å; N472-M474 PolarHBondContact O-N 3.28Å; N472-V481 HydrophobicContact CB-CG1 3.94Å; N472-V481 HydrophobicContact CB-CG2 3.99Å
473	K	91.1	Very high	85.3	Confident	15 Å²	15	41.5 Å²	41.5	7%	0.065	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	123.1	167	-179.1	74.1	179.4	-156.2	0	109.4	M362 V364 S450 V481 K482 F484 D488	M362-K473 WeakPolarHBondContact O-CD 3.33Å; M362-K473 WeakPolarHBondContact O-CE 3.26Å; M362-K473 PolarHBondContact O-NZ 3.4Å; V364-K473 HydrophobicContact CG1-CD 4.41Å; S450-K473 PolarHBondContact OG-N 3.21Å; S450-K473 VanDerWaalsContact OG-N 3.16Å; K473-V481 CarbonylContact O-C 3.48Å; K473-V481 VanDerWaalsContact O-CA 3.31Å; K473-V481 WeakPolarHBondContact O-CA 3.31Å; K473-K482 HydrophobicContact CB-CG 4.11Å; K473-K482 WeakPolarHBondContact CB-O 3.36Å; K473-K482 HydrophobicContact CG-CD 4.27Å; K473-K482 HydrophobicContact CG-CG 3.61Å; K473-K482 PolarHBondContact O-N 3.03Å; K473-F484 HydrophobicContact CB-CD1 4.03Å; K473-F484 HydrophobicContact CB-CD2 4.37Å; K473-F484 HydrophobicContact CB-CE1 3.81Å; K473-F484 HydrophobicContact CB-CE2 4.14Å; K473-F484 HydrophobicContact CB-CG 4.31Å; K473-F484 HydrophobicContact CB-CZ 3.86Å; K473-F484 HydrophobicContact CD-CD1 4.19Å; K473-F484 HydrophobicContact CD-CE1 4.02Å; K473-F484 HydrophobicContact CG-CD1 4.43Å; K473-F484 HydrophobicContact CG-CE1 4.42Å; K473-D488 IonicContact NZ-OD1 3.31Å; K473-D488 PolarHBondContact NZ-OD1 2.96Å
474	M	87	Confident	85.5	Confident	54 Å²	54	38.4 Å²	38.4	27%	0.266	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	150.5	-178.6	-55.3	-59.9	-75.2	0	0	110.8	Q363 Q365 N472 G479 V481	Q363-M474 WeakPolarHBondContact O-CB 3.41Å; Q363-M474 PolarHBondContact O-N 3.31Å; Q365-M474 HydrophobicContact CB-CG 4.42Å; Q365-M474 HydrophobicContact CB-SD 4.19Å; N472-M474 HydrophobicContact CB-SD 4.41Å; N472-M474 PolarHBondContact O-N 3.28Å; M474-G479 VanDerWaalsContact CE-O 3.29Å; M474-G479 WeakPolarHBondContact CE-O 3.16Å; M474-V481 HydrophobicContact SD-CG2 4.17Å
475	E	81.2	Confident	85.3	Confident	66 Å²	66	41.6 Å²	41.6	31%	0.308	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-101.8	123.1	168.4	-176.4	172.5	-115.7	0	0	109.4	N477 T478 G479 K480	E475-N477 VanDerWaalsContact C-N 3.29Å; E475-N477 PolarHBondContact O-N 3.1Å; E475-T478 PolarHBondContact O-N 3.42Å; E475-T478 WeakPolarHBondContact OE2-CB 3.36Å; E475-T478 WeakPolarHBondContact OE2-CG2 3.31Å; E475-T478 PolarHBondContact OE2-OG1 3.21Å; E475-G479 WeakPolarHBondContact O-CA 3.28Å; E475-G479 PolarHBondContact O-N 3.04Å; E475-K480 PolarHBondContact N-O 3.46Å
476	E	67.7	Low	84.9	Confident	81 Å²	81	46.2 Å²	46.2	38%	0.379	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-41.6	-170.2	-72.5	-161.2	149.3	0	0	114.4	K116 V122 Q363	K116-E476 WeakPolarHBondContact CE-OE2 3.38Å; K116-E476 IonicContact NZ-OE2 3.67Å; K116-E476 PolarHBondContact NZ-OE2 3.27Å; V122-E476 HydrophobicContact CG2-CG 3.73Å; V122-E476 WeakPolarHBondContact CG2-OE1 3.43Å; V122-E476 WeakPolarHBondContact CG2-OE2 3.48Å; Q363-E476 PolarHBondContact NE2-OE1 3.43Å; Q363-E476 VanDerWaalsContact OE1-CG 3.28Å
477	N	67.4	Low	84.4	Confident	98 Å²	98	50.7 Å²	50.7	52%	0.524	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-22	-168.7	-69	-9.7	0	0	0	113.4	K116 G120 E475	K116-N477 PolarHBondContact NZ-OD1 2.94Å; G120-N477 VanDerWaalsContact CA-ND2 3.32Å; G120-N477 WeakPolarHBondContact CA-ND2 3.22Å; E475-N477 VanDerWaalsContact C-N 3.29Å; E475-N477 PolarHBondContact O-N 3.1Å
478	T	70.8	Confident	84	Confident	75 Å²	75	51.4 Å²	51.4	46%	0.46	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-16.2	-172	70.9	0	0	0	0	113	E475 K480	E475-T478 PolarHBondContact O-N 3.42Å; E475-T478 WeakPolarHBondContact OE2-CB 3.36Å; E475-T478 WeakPolarHBondContact OE2-CG2 3.31Å; E475-T478 PolarHBondContact OE2-OG1 3.21Å; T478-K480 PolarHBondContact O-N 3.27Å; T478-K480 VanDerWaalsContact O-N 3.15Å; T478-K480 WeakPolarHBondContact OG1-CB 3.33Å; T478-K480 PolarHBondContact OG1-N 3.43Å; T478-K480 VanDerWaalsContact OG1-N 3.14Å
479	G	70.2	Confident	83.6	Confident	47 Å²	47	53.9 Å²	53.9	49%	0.485	28%	0.281	S	S	.	.			trans	63.2	11.3	-171.5	0	0	0	0	0	113.4	M474 E475	M474-G479 VanDerWaalsContact CE-O 3.29Å; M474-G479 WeakPolarHBondContact CE-O 3.16Å; E475-G479 WeakPolarHBondContact O-CA 3.28Å; E475-G479 PolarHBondContact O-N 3.04Å
480	K	82.2	Confident	83.2	Confident	147 Å²	147	57.2 Å²	57.2	64%	0.639	30%	0.297	S	S	*	.			trans	-78.8	150.4	177.5	-69.9	-177.7	178.9	176	0	110.6	E475 T478	E475-K480 PolarHBondContact N-O 3.46Å; T478-K480 PolarHBondContact O-N 3.27Å; T478-K480 VanDerWaalsContact O-N 3.15Å; T478-K480 WeakPolarHBondContact OG1-CB 3.33Å; T478-K480 PolarHBondContact OG1-N 3.43Å; T478-K480 VanDerWaalsContact OG1-N 3.14Å
481	V	84.6	Confident	82.7	Confident	43 Å²	43	58.5 Å²	58.5	26%	0.261	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.5	174.6	-175.9	0	0	0	0	109.6	R449 S450 N472 K473 M474	R449-V481 HydrophobicContact CB-CB 4.42Å; R449-V481 HydrophobicContact CB-CG1 3.96Å; S450-V481 VanDerWaalsContact OG-CG1 3.28Å; S450-V481 WeakPolarHBondContact OG-CG1 3.46Å; N472-V481 HydrophobicContact CB-CG1 3.94Å; N472-V481 HydrophobicContact CB-CG2 3.99Å; K473-V481 CarbonylContact O-C 3.48Å; K473-V481 VanDerWaalsContact O-CA 3.31Å; K473-V481 WeakPolarHBondContact O-CA 3.31Å; M474-V481 HydrophobicContact SD-CG2 4.17Å
482	K	87.5	Confident	82.7	Confident	53 Å²	53	58.2 Å²	58.2	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	161.9	174.1	67.4	178.9	177.3	-177.4	0	111.2	S450 K473	S450-K482 WeakPolarHBondContact CB-O 3.37Å; S450-K482 PolarHBondContact OG-O 3.13Å; K473-K482 HydrophobicContact CB-CG 4.11Å; K473-K482 WeakPolarHBondContact CB-O 3.36Å; K473-K482 HydrophobicContact CG-CD 4.27Å; K473-K482 HydrophobicContact CG-CG 3.61Å; K473-K482 PolarHBondContact O-N 3.03Å
483	P	88.3	Confident	82.6	Confident	74 Å²	74	61.9 Å²	61.9	48%	0.481	32%	0.318	S	S	.	.			trans	-71.6	152.3	172.3	30	-35.2	0	0	0	111.2	P425	P425-P483 HydrophobicContact CB-CB 3.79Å
484	F	89.3	Confident	82.4	Confident	8 Å²	8	62.6 Å²	62.6	4%	0.035	33%	0.326	C	S	.	.			trans	-72.5	135.4	169.4	-66.8	-88.1	0	0	0	109.6	V364 N423 L452 L470 K473 D488	V364-F484 HydrophobicContact CG1-CE1 3.59Å; V364-F484 HydrophobicContact CG1-CZ 3.74Å; N423-F484 PolarHBondContact ND2-O 3.5Å; L452-F484 HydrophobicContact CB-CB 4.35Å; L452-F484 HydrophobicContact CB-CD1 3.89Å; L452-F484 HydrophobicContact CB-CD2 3.66Å; L452-F484 HydrophobicContact CB-CE1 4Å; L452-F484 HydrophobicContact CB-CE2 3.81Å; L452-F484 HydrophobicContact CB-CG 3.71Å; L452-F484 HydrophobicContact CB-CZ 3.97Å; L452-F484 HydrophobicContact CD2-CB 4.44Å; L452-F484 HydrophobicContact CD2-CD1 3.83Å; L452-F484 HydrophobicContact CD2-CE1 4.27Å; L452-F484 HydrophobicContact CD2-CG 4.19Å; L470-F484 HydrophobicContact CB-CE1 4.37Å; L470-F484 HydrophobicContact CB-CZ 3.99Å; K473-F484 HydrophobicContact CB-CD1 4.03Å; K473-F484 HydrophobicContact CB-CD2 4.37Å; K473-F484 HydrophobicContact CB-CE1 3.81Å; K473-F484 HydrophobicContact CB-CE2 4.14Å; K473-F484 HydrophobicContact CB-CG 4.31Å; K473-F484 HydrophobicContact CB-CZ 3.86Å; K473-F484 HydrophobicContact CD-CD1 4.19Å; K473-F484 HydrophobicContact CD-CE1 4.02Å; K473-F484 HydrophobicContact CG-CD1 4.43Å; K473-F484 HydrophobicContact CG-CE1 4.42Å; F484-D488 WeakPolarHBondContact CA-OD2 3.26Å; F484-D488 HydrophobicContact CB-CB 4.19Å; F484-D488 HydrophobicContact CD1-CB 3.93Å
485	N	84.1	Confident	82.4	Confident	79 Å²	79	60 Å²	60	42%	0.422	31%	0.314	S	S	.	.			trans	-95.5	175	177.4	66.6	37.5	0	0	0	111.4	N487 D488 E489	N485-N487 PolarHBondContact O-N 2.99Å; N485-N487 WeakPolarHBondContact OD1-CA 3.43Å; N485-N487 VanDerWaalsContact OD1-CB 3.3Å; N485-N487 WeakPolarHBondContact OD1-CB 3.17Å; N485-N487 PolarHBondContact OD1-N 3.03Å; N485-D488 PolarHBondContact N-OD2 3.48Å; N485-D488 WeakPolarHBondContact O-CB 3.24Å; N485-D488 PolarHBondContact O-N 3.02Å; N485-D488 VanDerWaalsContact O-N 3.12Å; N485-D488 PolarHBondContact OD1-N 3.4Å; N485-D488 PolarHBondContact OD1-OD2 3.42Å; N485-E489 PolarHBondContact O-N 3.12Å
486	R	80.6	Confident	82.8	Confident	111 Å²	111	57.2 Å²	57.2	42%	0.419	30%	0.301	S	S	.	.	H	α-helix	trans	-61.7	-28.2	179.9	-165.1	-179.7	-176.4	168.4	-1.8	113.2	S194 E489 Q490	S194-R486 WeakPolarHBondContact O-CD 3.22Å; S194-R486 PolarHBondContact O-NH1 3.22Å; R486-E489 PolarHBondContact O-N 3.41Å; R486-Q490 WeakPolarHBondContact O-CG 3.49Å; R486-Q490 PolarHBondContact O-N 2.97Å
487	N	80.6	Confident	83.8	Confident	94 Å²	94	58 Å²	58	50%	0.503	31%	0.307	S	S	.	.	H	α-helix	trans	-71.9	-37.3	176.9	-62.3	-20.4	0	0	0	111.1	N485 E489 F491	N485-N487 PolarHBondContact O-N 2.99Å; N485-N487 WeakPolarHBondContact OD1-CA 3.43Å; N485-N487 VanDerWaalsContact OD1-CB 3.3Å; N485-N487 WeakPolarHBondContact OD1-CB 3.17Å; N485-N487 PolarHBondContact OD1-N 3.03Å; N487-E489 VanDerWaalsContact C-N 3.34Å; N487-F491 VanDerWaalsContact O-CB 3.26Å; N487-F491 WeakPolarHBondContact O-CB 3.46Å; N487-F491 PolarHBondContact O-N 3.22Å
488	D	86.6	Confident	84.7	Confident	16 Å²	16	56 Å²	56	9%	0.086	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-42.7	173.5	-64.2	-58.5	0	0	0	110.9	M362 L452 K473 F484 N485 L492	M362-D488 HydrophobicContact CE-CB 3.83Å; M362-D488 VanDerWaalsContact CE-O 3.31Å; M362-D488 WeakPolarHBondContact CE-O 3.34Å; L452-D488 HydrophobicContact CD2-CB 4.31Å; K473-D488 IonicContact NZ-OD1 3.31Å; K473-D488 PolarHBondContact NZ-OD1 2.96Å; F484-D488 WeakPolarHBondContact CA-OD2 3.26Å; F484-D488 HydrophobicContact CB-CB 4.19Å; F484-D488 HydrophobicContact CD1-CB 3.93Å; N485-D488 PolarHBondContact N-OD2 3.48Å; N485-D488 WeakPolarHBondContact O-CB 3.24Å; N485-D488 PolarHBondContact O-N 3.02Å; N485-D488 VanDerWaalsContact O-N 3.12Å; N485-D488 PolarHBondContact OD1-N 3.4Å; N485-D488 PolarHBondContact OD1-OD2 3.42Å; D488-L492 WeakPolarHBondContact O-CB 3.47Å; D488-L492 PolarHBondContact O-N 3.14Å
489	E	87.1	Confident	85.6	Confident	52 Å²	52	52.5 Å²	52.5	24%	0.243	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-55.5	175.4	-70.3	174.9	-175.2	0	0	111.8	N423 L452 N485 R486 N487 F491 L492 E493	N423-E489 HydrophobicContact CB-CG 4.21Å; N423-E489 WeakPolarHBondContact CB-OE1 3.25Å; N423-E489 VanDerWaalsContact CG-OE1 3.29Å; N423-E489 PolarHBondContact ND2-OE1 2.91Å; L452-E489 HydrophobicContact CD1-CG 3.79Å; N485-E489 PolarHBondContact O-N 3.12Å; R486-E489 PolarHBondContact O-N 3.41Å; N487-E489 VanDerWaalsContact C-N 3.34Å; E489-F491 VanDerWaalsContact C-N 3.27Å; E489-F491 PolarHBondContact O-N 3.49Å; E489-L492 PolarHBondContact O-N 3.09Å; E489-E493 WeakPolarHBondContact O-CB 3.12Å; E489-E493 WeakPolarHBondContact O-CG 3.28Å; E489-E493 PolarHBondContact O-N 2.76Å
490	Q	84.4	Confident	86.4	Confident	76 Å²	76	50.3 Å²	50.3	36%	0.355	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-39.1	-178.9	-73.7	-179.8	-2.4	0	0	112.2	R486 A494	R486-Q490 WeakPolarHBondContact O-CG 3.49Å; R486-Q490 PolarHBondContact O-N 2.97Å; Q490-A494 WeakPolarHBondContact O-CB 3.48Å; Q490-A494 PolarHBondContact O-N 3.06Å
491	F	85.1	Confident	86.6	Confident	28 Å²	28	46.7 Å²	46.7	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-50.2	176.7	177	-91.2	0	0	0	111.1	L333 L336 F361 M362 N487 E489 E493 A494 F495	L333-F491 HydrophobicContact CD2-CD2 3.79Å; L333-F491 HydrophobicContact CD2-CE2 3.4Å; L333-F491 VanDerWaalsContact CD2-CE2 3.4Å; L333-F491 HydrophobicContact CD2-CZ 4.09Å; L333-F491 HydrophobicContact CG-CE2 4.26Å; L336-F491 HydrophobicContact CD1-CE2 4.2Å; L336-F491 HydrophobicContact CD1-CZ 3.68Å; F361-F491 HydrophobicContact CD1-CD1 4.23Å; F361-F491 AromaticContact CD1-CE1 3.47Å; F361-F491 HydrophobicContact CD1-CE1 3.47Å; F361-F491 VanDerWaalsContact CD1-CE1 3.47Å; F361-F491 AromaticContact CD1-CE2 3.85Å; F361-F491 HydrophobicContact CD1-CE2 3.85Å; F361-F491 AromaticContact CD1-CZ 3.25Å; F361-F491 HydrophobicContact CD1-CZ 3.25Å; F361-F491 HydrophobicContact CE1-CD1 4.15Å; F361-F491 AromaticContact CE1-CD2 3.78Å; F361-F491 HydrophobicContact CE1-CD2 3.78Å; F361-F491 AromaticContact CE1-CE1 3.67Å; F361-F491 HydrophobicContact CE1-CE1 3.67Å; F361-F491 AromaticContact CE1-CE2 3.23Å; F361-F491 HydrophobicContact CE1-CE2 3.23Å; F361-F491 HydrophobicContact CE1-CG 4.2Å; F361-F491 AromaticContact CE1-CZ 3.18Å; F361-F491 HydrophobicContact CE1-CZ 3.18Å; F361-F491 HydrophobicContact CG-CZ 4.18Å; F361-F491 HydrophobicContact CZ-CD2 4.48Å; F361-F491 AromaticContact CZ-CE2 3.82Å; F361-F491 HydrophobicContact CZ-CE2 3.82Å; F361-F491 HydrophobicContact CZ-CZ 4.05Å; M362-F491 HydrophobicContact CE-CD1 4.13Å; M362-F491 HydrophobicContact CG-CD1 3.92Å; M362-F491 HydrophobicContact CG-CE1 3.87Å; M362-F491 HydrophobicContact SD-CD1 3.73Å; M362-F491 HydrophobicContact SD-CE1 4.01Å; N487-F491 VanDerWaalsContact O-CB 3.26Å; N487-F491 WeakPolarHBondContact O-CB 3.46Å; N487-F491 PolarHBondContact O-N 3.22Å; E489-F491 VanDerWaalsContact C-N 3.27Å; E489-F491 PolarHBondContact O-N 3.49Å; F491-E493 VanDerWaalsContact C-N 3.33Å; F491-E493 PolarHBondContact O-N 3.49Å; F491-A494 PolarHBondContact O-N 3.3Å; F491-F495 HydrophobicContact CE1-CB 4.19Å; F491-F495 HydrophobicContact CE1-CG 4.36Å; F491-F495 HydrophobicContact CZ-CB 4.43Å; F491-F495 HydrophobicContact CZ-CD2 4.46Å; F491-F495 HydrophobicContact CZ-CG 4.43Å; F491-F495 WeakPolarHBondContact O-CB 3.35Å; F491-F495 PolarHBondContact O-N 3.11Å
492	L	89.9	Confident	86.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-42.4	-179.4	-175.7	60.5	0	0	0	111	I358 M362 L452 T454 L470 D488 E489 A494 F495 V496	I358-L492 HydrophobicContact CD1-CD1 4.24Å; M362-L492 HydrophobicContact CE-CB 4.14Å; M362-L492 HydrophobicContact SD-CB 4.19Å; M362-L492 HydrophobicContact SD-CD1 4.13Å; L452-L492 HydrophobicContact CD2-CB 4.17Å; L452-L492 HydrophobicContact CD2-CD2 3.65Å; L452-L492 HydrophobicContact CG-CD2 3.71Å; T454-L492 WeakPolarHBondContact OG1-CD2 3.44Å; L470-L492 HydrophobicContact CD1-CD1 4.13Å; L470-L492 HydrophobicContact CD1-CD2 3.73Å; L470-L492 HydrophobicContact CD1-CG 4.49Å; L470-L492 HydrophobicContact CG-CD2 4.04Å; D488-L492 WeakPolarHBondContact O-CB 3.47Å; D488-L492 PolarHBondContact O-N 3.14Å; E489-L492 PolarHBondContact O-N 3.09Å; L492-A494 PolarHBondContact O-N 3.04Å; L492-F495 PolarHBondContact O-N 3.37Å; L492-V496 HydrophobicContact CD1-CG1 3.91Å; L492-V496 HydrophobicContact CG-CG1 4.18Å; L492-V496 WeakPolarHBondContact O-CG1 3.41Å; L492-V496 WeakPolarHBondContact O-CG2 3.35Å; L492-V496 PolarHBondContact O-N 3.09Å
493	E	88.7	Confident	86.6	Confident	83 Å²	83	42.1 Å²	42.1	39%	0.388	21%	0.213	S	C	.	.	H	α-helix	trans	-56.1	-45.7	174.2	-79.1	-180	-144.9	0	0	112.9	P421 T454 E489 F491 V496	P421-E493 WeakPolarHBondContact CG-OE1 3.47Å; T454-E493 HydrophobicContact CG2-CG 4Å; E489-E493 WeakPolarHBondContact O-CB 3.12Å; E489-E493 WeakPolarHBondContact O-CG 3.28Å; E489-E493 PolarHBondContact O-N 2.76Å; F491-E493 VanDerWaalsContact C-N 3.33Å; F491-E493 PolarHBondContact O-N 3.49Å; E493-V496 VanDerWaalsContact O-CG2 3.23Å; E493-V496 WeakPolarHBondContact O-CG2 3.46Å
494	A	86.9	Confident	86.4	Confident	30 Å²	30	41.3 Å²	41.3	25%	0.248	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-41.5	176.7	0	0	0	0	0	111.5	L333 Q490 F491 L492 I497	L333-A494 HydrophobicContact CD1-CB 4.01Å; L333-A494 HydrophobicContact CD2-CB 4.36Å; Q490-A494 WeakPolarHBondContact O-CB 3.48Å; Q490-A494 PolarHBondContact O-N 3.06Å; F491-A494 PolarHBondContact O-N 3.3Å; L492-A494 PolarHBondContact O-N 3.04Å; A494-I497 WeakPolarHBondContact O-CB 3.36Å; A494-I497 PolarHBondContact O-N 3.46Å
495	F	88	Confident	86.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.5	-37.6	-175.6	-167.9	-113.7	0	0	0	113.1	L333 L336 I340 I354 T357 I358 F491 L492 I497 F498 C499	L333-F495 HydrophobicContact CD2-CB 4.47Å; L333-F495 HydrophobicContact CD2-CD2 4.42Å; L336-F495 HydrophobicContact CB-CD2 4.39Å; L336-F495 HydrophobicContact CB-CE2 3.58Å; L336-F495 HydrophobicContact CB-CZ 4.3Å; L336-F495 HydrophobicContact CD1-CE2 4.34Å; I340-F495 HydrophobicContact CD1-CE1 4.02Å; I340-F495 HydrophobicContact CD1-CE2 3.82Å; I340-F495 HydrophobicContact CD1-CZ 3.33Å; I340-F495 HydrophobicContact CG1-CZ 4.42Å; I354-F495 HydrophobicContact CG2-CE1 4.48Å; T357-F495 HydrophobicContact CG2-CE1 4.36Å; T357-F495 HydrophobicContact CG2-CE2 4.43Å; T357-F495 HydrophobicContact CG2-CZ 3.69Å; I358-F495 HydrophobicContact CD1-CD1 4.01Å; I358-F495 HydrophobicContact CD1-CE1 3.98Å; I358-F495 HydrophobicContact CG1-CD1 3.74Å; I358-F495 HydrophobicContact CG1-CE1 3.52Å; F491-F495 HydrophobicContact CE1-CB 4.19Å; F491-F495 HydrophobicContact CE1-CG 4.36Å; F491-F495 HydrophobicContact CZ-CB 4.43Å; F491-F495 HydrophobicContact CZ-CD2 4.46Å; F491-F495 HydrophobicContact CZ-CG 4.43Å; F491-F495 WeakPolarHBondContact O-CB 3.35Å; F491-F495 PolarHBondContact O-N 3.11Å; L492-F495 PolarHBondContact O-N 3.37Å; F495-I497 PolarHBondContact O-N 3.36Å; F495-F498 PolarHBondContact O-N 2.81Å; F495-F498 VanDerWaalsContact O-N 3.14Å; F495-C499 PolarHBondContact O-N 3.02Å; F495-C499 VanDerWaalsContact O-N 3.14Å; F495-C499 PolarHBondContact O-SG 3.2Å
496	V	89.6	Confident	86.3	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-65.4	-20.2	178.6	-66.6	0	0	0	0	113.2	T454 I456 C468 L492 E493 C499 G500	T454-V496 HydrophobicContact CG2-CG1 4.34Å; T454-V496 HydrophobicContact CG2-CG2 3.74Å; I456-V496 HydrophobicContact CG1-CB 4.19Å; I456-V496 HydrophobicContact CG1-CG1 4.21Å; C468-V496 HydrophobicContact CB-CG1 4.04Å; L492-V496 HydrophobicContact CD1-CG1 3.91Å; L492-V496 HydrophobicContact CG-CG1 4.18Å; L492-V496 WeakPolarHBondContact O-CG1 3.41Å; L492-V496 WeakPolarHBondContact O-CG2 3.35Å; L492-V496 PolarHBondContact O-N 3.09Å; E493-V496 VanDerWaalsContact O-CG2 3.23Å; E493-V496 WeakPolarHBondContact O-CG2 3.46Å; V496-C499 PolarHBondContact O-N 3.02Å; V496-G500 PolarHBondContact O-N 3.25Å
497	I	87.2	Confident	86.4	Confident	98 Å²	98	37.3 Å²	37.3	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-49.5	172.6	-62.5	168.8	0	0	0	109.5	A494 F495 C499 G500 L501	A494-I497 WeakPolarHBondContact O-CB 3.36Å; A494-I497 PolarHBondContact O-N 3.46Å; F495-I497 PolarHBondContact O-N 3.36Å; I497-C499 VanDerWaalsContact C-N 3.34Å; I497-C499 PolarHBondContact O-N 3.45Å; I497-G500 PolarHBondContact O-N 3.19Å; I497-L501 HydrophobicContact CG2-CD1 4.07Å; I497-L501 WeakPolarHBondContact O-CD1 3.37Å; I497-L501 PolarHBondContact O-N 3.3Å; I497-L501 VanDerWaalsContact O-N 3.11Å
498	F	87.2	Confident	86.5	Confident	56 Å²	56	38 Å²	38	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-40	177.1	-62.3	-72	0	0	0	111.8	L333 L334 A337 F341 F495 G500 L501 G502	L333-F498 HydrophobicContact CB-CE2 4.46Å; L334-F498 HydrophobicContact CD2-CZ 4.45Å; A337-F498 HydrophobicContact CB-CB 4.08Å; A337-F498 HydrophobicContact CB-CD1 3.71Å; A337-F498 HydrophobicContact CB-CD2 4.22Å; A337-F498 HydrophobicContact CB-CE1 4.16Å; A337-F498 HydrophobicContact CB-CG 3.74Å; F341-F498 HydrophobicContact CE2-CB 4.41Å; F341-F498 HydrophobicContact CE2-CD1 4.36Å; F495-F498 PolarHBondContact O-N 2.81Å; F495-F498 VanDerWaalsContact O-N 3.14Å; F498-G500 VanDerWaalsContact C-N 3.29Å; F498-G500 PolarHBondContact O-N 2.88Å; F498-L501 PolarHBondContact O-N 2.93Å; F498-G502 PolarHBondContact O-N 3.23Å
499	C	88.7	Confident	86.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-42.8	173.9	-60	0	0	0	0	111.5	I354 F495 V496 I497 G502 I503	I354-C499 HydrophobicContact CD1-CB 3.89Å; I354-C499 HydrophobicContact CG1-CB 4.4Å; I354-C499 HydrophobicContact CG2-CB 4.34Å; I354-C499 WeakPolarHBondContact CG2-SG 3.45Å; F495-C499 PolarHBondContact O-N 3.02Å; F495-C499 VanDerWaalsContact O-N 3.14Å; F495-C499 PolarHBondContact O-SG 3.2Å; V496-C499 PolarHBondContact O-N 3.02Å; I497-C499 VanDerWaalsContact C-N 3.34Å; I497-C499 PolarHBondContact O-N 3.45Å; C499-G502 PolarHBondContact O-N 3.03Å; C499-I503 WeakPolarHBondContact O-CB 3.33Å; C499-I503 VanDerWaalsContact O-CG1 3.26Å; C499-I503 WeakPolarHBondContact O-CG1 3.48Å; C499-I503 PolarHBondContact O-N 3.47Å
500	G	88.1	Confident	86.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-41.7	178.5	0	0	0	0	0	113.2	I456 I465 V496 I497 F498 Q504	I456-G500 VanDerWaalsContact CG2-CA 3.41Å; I465-G500 WeakPolarHBondContact CD1-O 3.38Å; V496-G500 PolarHBondContact O-N 3.25Å; I497-G500 PolarHBondContact O-N 3.19Å; F498-G500 VanDerWaalsContact C-N 3.29Å; F498-G500 PolarHBondContact O-N 2.88Å; G500-Q504 WeakPolarHBondContact O-CB 3.41Å; G500-Q504 PolarHBondContact O-N 3.39Å; G500-Q504 VanDerWaalsContact O-N 3.08Å
501	L	85.3	Confident	86.2	Confident	71 Å²	71	42.3 Å²	42.3	37%	0.372	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-44.5	173	-87.1	83	0	0	0	111.7	F341 I497 F498 N505	F341-L501 HydrophobicContact CE1-CB 4.39Å; F341-L501 HydrophobicContact CZ-CB 3.92Å; I497-L501 HydrophobicContact CG2-CD1 4.07Å; I497-L501 WeakPolarHBondContact O-CD1 3.37Å; I497-L501 PolarHBondContact O-N 3.3Å; I497-L501 VanDerWaalsContact O-N 3.11Å; F498-L501 PolarHBondContact O-N 2.93Å; L501-N505 WeakPolarHBondContact O-CB 3.13Å; L501-N505 VanDerWaalsContact O-CG 3.31Å; L501-N505 PolarHBondContact O-N 2.79Å
502	G	86.1	Confident	86.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-55	177.9	0	0	0	0	0	112.1	I350 F498 C499 Q504 N505 T506	I350-G502 VanDerWaalsContact CD1-C 3.46Å; F498-G502 PolarHBondContact O-N 3.23Å; C499-G502 PolarHBondContact O-N 3.03Å; G502-Q504 VanDerWaalsContact C-N 3.34Å; G502-Q504 PolarHBondContact O-N 3.44Å; G502-N505 PolarHBondContact O-N 2.85Å; G502-T506 PolarHBondContact O-N 2.62Å; G502-T506 PolarHBondContact O-OG1 2.59Å; G502-T506 VanDerWaalsContact O-OG1 3.12Å
503	I	87	Confident	85.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.3	-46.8	-179.6	-70.6	165	0	0	0	110.9	L347 L351 I354 I371 I456 I465 C499 T506 Q507	L347-I503 HydrophobicContact CD1-CB 4.45Å; L347-I503 HydrophobicContact CD1-CG1 4.38Å; L347-I503 HydrophobicContact CD1-CG2 3.85Å; L351-I503 HydrophobicContact CD2-CD1 3.81Å; L351-I503 HydrophobicContact CD2-CG1 4.09Å; I354-I503 HydrophobicContact CD1-CD1 4.18Å; I354-I503 HydrophobicContact CD1-CG1 4.11Å; I371-I503 HydrophobicContact CD1-CD1 4.21Å; I371-I503 HydrophobicContact CD1-CG2 4.35Å; I456-I503 HydrophobicContact CD1-CD1 4.17Å; I456-I503 HydrophobicContact CG2-CD1 4.46Å; I465-I503 HydrophobicContact CD1-CG2 4.49Å; C499-I503 WeakPolarHBondContact O-CB 3.33Å; C499-I503 VanDerWaalsContact O-CG1 3.26Å; C499-I503 WeakPolarHBondContact O-CG1 3.48Å; C499-I503 PolarHBondContact O-N 3.47Å; I503-T506 PolarHBondContact O-N 3.14Å; I503-Q507 HydrophobicContact CG2-CG 4.46Å; I503-Q507 WeakPolarHBondContact O-CG 3.41Å; I503-Q507 PolarHBondContact O-N 3.46Å
504	Q	84.2	Confident	85.5	Confident	57 Å²	57	53.8 Å²	53.8	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-44.8	-178.8	-175.4	-176.7	1.7	0	0	112.2	N458 I465 G500 G502 T506 Q507 M508	N458-Q504 VanDerWaalsContact CG-OE1 3.3Å; N458-Q504 VanDerWaalsContact ND2-CD 3.3Å; N458-Q504 PolarHBondContact ND2-NE2 2.82Å; N458-Q504 PolarHBondContact ND2-OE1 3.01Å; N458-Q504 PolarHBondContact OD1-OE1 3.28Å; I465-Q504 HydrophobicContact CD1-CB 4.5Å; G500-Q504 WeakPolarHBondContact O-CB 3.41Å; G500-Q504 PolarHBondContact O-N 3.39Å; G500-Q504 VanDerWaalsContact O-N 3.08Å; G502-Q504 VanDerWaalsContact C-N 3.34Å; G502-Q504 PolarHBondContact O-N 3.44Å; Q504-T506 VanDerWaalsContact C-N 3.34Å; Q504-T506 PolarHBondContact O-N 3.17Å; Q504-Q507 PolarHBondContact O-N 2.99Å; Q504-M508 WeakPolarHBondContact O-CB 3.04Å; Q504-M508 PolarHBondContact O-N 3.27Å
505	N	84.6	Confident	84.9	Confident	55 Å²	55	55 Å²	55	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-60.4	-47.6	178.9	-77	-8.8	0	0	0	110.3	L501 G502 Q507 M508 Y509	L501-N505 WeakPolarHBondContact O-CB 3.13Å; L501-N505 VanDerWaalsContact O-CG 3.31Å; L501-N505 PolarHBondContact O-N 2.79Å; G502-N505 PolarHBondContact O-N 2.85Å; N505-Q507 PolarHBondContact O-N 2.82Å; N505-M508 WeakPolarHBondContact O-CB 3.43Å; N505-M508 PolarHBondContact O-N 3.46Å; N505-Y509 WeakPolarHBondContact O-CD2 3.42Å; N505-Y509 PolarHBondContact O-N 3.32Å
506	T	85.8	Confident	84.5	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-43.7	179	-56.1	0	0	0	0	112.5	L347 I350 G502 I503 Q504 M508 Y509 E510	L347-T506 HydrophobicContact CB-CG2 4.44Å; L347-T506 VanDerWaalsContact N-CG2 3.31Å; I350-T506 HydrophobicContact CG2-CG2 4.42Å; G502-T506 PolarHBondContact O-N 2.62Å; G502-T506 PolarHBondContact O-OG1 2.59Å; G502-T506 VanDerWaalsContact O-OG1 3.12Å; I503-T506 PolarHBondContact O-N 3.14Å; Q504-T506 VanDerWaalsContact C-N 3.34Å; Q504-T506 PolarHBondContact O-N 3.17Å; T506-M508 VanDerWaalsContact C-N 3.31Å; T506-M508 PolarHBondContact O-N 2.61Å; T506-Y509 PolarHBondContact O-N 2.93Å; T506-E510 PolarHBondContact O-N 3.19Å
507	Q	83.9	Confident	84	Confident	59 Å²	59	62.4 Å²	62.4	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-39.9	175.1	-75.3	177.9	-23.8	0	0	112.5	L347 I503 Q504 N505 A511	L347-Q507 HydrophobicContact CD1-CG 4.28Å; L347-Q507 HydrophobicContact CD2-CG 4.26Å; I503-Q507 HydrophobicContact CG2-CG 4.46Å; I503-Q507 WeakPolarHBondContact O-CG 3.41Å; I503-Q507 PolarHBondContact O-N 3.46Å; Q504-Q507 PolarHBondContact O-N 2.99Å; N505-Q507 PolarHBondContact O-N 2.82Å; Q507-A511 WeakPolarHBondContact O-CB 3.22Å; Q507-A511 PolarHBondContact O-N 3.4Å
508	M	82.3	Confident	83.6	Confident	107 Å²	107	65.1 Å²	65.1	53%	0.527	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-43	176.6	-176.9	177.2	70.6	0	0	111.5	Q504 N505 T506 A511 V512	Q504-M508 WeakPolarHBondContact O-CB 3.04Å; Q504-M508 PolarHBondContact O-N 3.27Å; N505-M508 WeakPolarHBondContact O-CB 3.43Å; N505-M508 PolarHBondContact O-N 3.46Å; T506-M508 VanDerWaalsContact C-N 3.31Å; T506-M508 PolarHBondContact O-N 2.61Å; M508-A511 PolarHBondContact O-N 3.33Å; M508-V512 WeakPolarHBondContact O-CG2 3.45Å; M508-V512 PolarHBondContact O-N 2.97Å; M508-V512 VanDerWaalsContact O-N 3.09Å
509	Y	83.8	Confident	83.1	Confident	141 Å²	141	68.2 Å²	68.2	55%	0.553	34%	0.343	S	S	*	.	H	α-helix	trans	-61.4	-48	175.3	-83.3	-71.3	0	0	0	112	N505 T506 A511 V512 E513	N505-Y509 WeakPolarHBondContact O-CD2 3.42Å; N505-Y509 PolarHBondContact O-N 3.32Å; T506-Y509 PolarHBondContact O-N 2.93Å; Y509-A511 VanDerWaalsContact C-N 3.28Å; Y509-A511 PolarHBondContact O-N 3.37Å; Y509-V512 PolarHBondContact O-N 2.96Å; Y509-V512 VanDerWaalsContact O-N 3.14Å; Y509-E513 PolarHBondContact O-N 2.98Å
510	E	84.1	Confident	82.4	Confident	46 Å²	46	74.7 Å²	74.7	22%	0.215	38%	0.375	C	S	.	.	H	α-helix	trans	-61	-36.4	177.3	-74.5	-176.8	-177.6	0	0	112.8	S346 L347 T506 R514	S346-E510 WeakPolarHBondContact CA-OE1 3.49Å; L347-E510 PolarHBondContact N-OE1 3.09Å; T506-E510 PolarHBondContact O-N 3.19Å; E510-R514 WeakPolarHBondContact O-CB 3.24Å; E510-R514 PolarHBondContact O-N 3.14Å; E510-R514 PolarHBondContact O-NE 2.91Å; E510-R514 IonicContact OE2-NH2 3.59Å
511	A	83.4	Confident	82.2	Confident	48 Å²	48	78.8 Å²	78.8	40%	0.397	40%	0.4	S	S	.	.	H	α-helix	trans	-65.6	-40.9	176.3	0	0	0	0	0	111.6	Q507 M508 Y509 A515	Q507-A511 WeakPolarHBondContact O-CB 3.22Å; Q507-A511 PolarHBondContact O-N 3.4Å; M508-A511 PolarHBondContact O-N 3.33Å; Y509-A511 VanDerWaalsContact C-N 3.28Å; Y509-A511 PolarHBondContact O-N 3.37Å; A511-A515 WeakPolarHBondContact O-CB 3.47Å; A511-A515 PolarHBondContact O-N 3.35Å
512	V	83.2	Confident	81.9	Confident	70 Å²	70	79.1 Å²	79.1	42%	0.424	41%	0.405	S	S	.	.	H	α-helix	trans	-64.4	-46.7	175.4	171.9	0	0	0	0	110.9	M508 Y509 R514 A515 M516	M508-V512 WeakPolarHBondContact O-CG2 3.45Å; M508-V512 PolarHBondContact O-N 2.97Å; M508-V512 VanDerWaalsContact O-N 3.09Å; Y509-V512 PolarHBondContact O-N 2.96Å; Y509-V512 VanDerWaalsContact O-N 3.14Å; V512-R514 PolarHBondContact O-N 2.72Å; V512-A515 PolarHBondContact O-N 3.05Å; V512-M516 HydrophobicContact CG1-CE 3.83Å; V512-M516 HydrophobicContact CG1-CG 4.46Å; V512-M516 HydrophobicContact CG1-SD 4.26Å; V512-M516 WeakPolarHBondContact O-CG 3.43Å; V512-M516 PolarHBondContact O-N 3.45Å
513	E	82.8	Confident	81.3	Confident	132 Å²	132	83.4 Å²	83.4	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-60.9	-43.9	177.4	-74.6	-165.5	141.1	0	0	112.2	Y509 A515 M516 A517	Y509-E513 PolarHBondContact O-N 2.98Å; E513-A515 VanDerWaalsContact C-N 3.32Å; E513-A515 PolarHBondContact O-N 3.26Å; E513-M516 PolarHBondContact O-N 2.95Å; E513-A517 WeakPolarHBondContact O-CB 3.38Å; E513-A517 PolarHBondContact O-N 2.85Å
514	R	82.8	Confident	80.9	Confident	150 Å²	150	90 Å²	90	57%	0.566	46%	0.458	S	S	*	.	H	α-helix	trans	-61.2	-40.2	174.6	-84	-177.1	-90.5	143.4	-10.5	112.3	E510 V512 K518	E510-R514 WeakPolarHBondContact O-CB 3.24Å; E510-R514 PolarHBondContact O-N 3.14Å; E510-R514 PolarHBondContact O-NE 2.91Å; E510-R514 IonicContact OE2-NH2 3.59Å; V512-R514 PolarHBondContact O-N 2.72Å; R514-K518 WeakPolarHBondContact O-CG 3.41Å; R514-K518 PolarHBondContact O-N 3.08Å
515	A	75.8	Confident	80.9	Confident	56 Å²	56	91 Å²	91	46%	0.463	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-42.9	176.4	0	0	0	0	0	111.7	A511 V512 E513 K518 Q519	A511-A515 WeakPolarHBondContact O-CB 3.47Å; A511-A515 PolarHBondContact O-N 3.35Å; V512-A515 PolarHBondContact O-N 3.05Å; E513-A515 VanDerWaalsContact C-N 3.32Å; E513-A515 PolarHBondContact O-N 3.26Å; A515-K518 PolarHBondContact O-N 3.11Å; A515-Q519 WeakPolarHBondContact O-CB 3.37Å; A515-Q519 PolarHBondContact O-N 3.01Å
516	M	78.9	Confident	80.6	Confident	109 Å²	109	92.8 Å²	92.8	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-45.4	174.8	-72.7	-177.6	173.5	0	0	111.8	V512 E513 K518 Q519 M520	V512-M516 HydrophobicContact CG1-CE 3.83Å; V512-M516 HydrophobicContact CG1-CG 4.46Å; V512-M516 HydrophobicContact CG1-SD 4.26Å; V512-M516 WeakPolarHBondContact O-CG 3.43Å; V512-M516 PolarHBondContact O-N 3.45Å; E513-M516 PolarHBondContact O-N 2.95Å; M516-K518 PolarHBondContact O-N 2.77Å; M516-Q519 WeakPolarHBondContact O-CB 3.48Å; M516-Q519 PolarHBondContact O-N 2.83Å; M516-M520 WeakPolarHBondContact O-CG 3.45Å; M516-M520 PolarHBondContact O-N 3.37Å
517	A	78.8	Confident	80.4	Confident	54 Å²	54	93.5 Å²	93.5	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-44.7	176.8	0	0	0	0	0	111.9	E513 Q519 M520 V521	E513-A517 WeakPolarHBondContact O-CB 3.38Å; E513-A517 PolarHBondContact O-N 2.85Å; A517-Q519 VanDerWaalsContact C-N 3.33Å; A517-Q519 PolarHBondContact O-N 3.14Å; A517-M520 PolarHBondContact O-N 3.14Å; A517-V521 WeakPolarHBondContact O-CG2 3.38Å; A517-V521 PolarHBondContact O-N 3.06Å
518	K	79.2	Confident	80.3	Confident	154 Å²	154	99.2 Å²	99.2	67%	0.67	50%	0.502	S	S	*	.	H	α-helix	trans	-59.9	-42	174.2	-74.5	176.9	179.9	-176.9	0	112	R514 A515 M516 T522	R514-K518 WeakPolarHBondContact O-CG 3.41Å; R514-K518 PolarHBondContact O-N 3.08Å; A515-K518 PolarHBondContact O-N 3.11Å; M516-K518 PolarHBondContact O-N 2.77Å; K518-T522 WeakPolarHBondContact O-CB 3.3Å; K518-T522 PolarHBondContact O-N 3.23Å; K518-T522 PolarHBondContact O-OG1 3.48Å
519	Q	76.4	Confident	80.4	Confident	121 Å²	121	100 Å²	100	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-44.1	176.9	-176.3	-179	3	0	0	111.5	A515 M516 A517 T522 L523	A515-Q519 WeakPolarHBondContact O-CB 3.37Å; A515-Q519 PolarHBondContact O-N 3.01Å; M516-Q519 WeakPolarHBondContact O-CB 3.48Å; M516-Q519 PolarHBondContact O-N 2.83Å; A517-Q519 VanDerWaalsContact C-N 3.33Å; A517-Q519 PolarHBondContact O-N 3.14Å; Q519-T522 WeakPolarHBondContact O-CB 3.36Å; Q519-T522 PolarHBondContact O-N 3.16Å; Q519-L523 HydrophobicContact CG-CD1 4.32Å; Q519-L523 WeakPolarHBondContact O-CG 3.4Å; Q519-L523 PolarHBondContact O-N 3.45Å
520	M	74.6	Confident	80.4	Confident	138 Å²	138	93.6 Å²	93.6	68%	0.68	48%	0.48	S	S	*	.	H	α-helix	trans	-59.8	-48	177.5	-72.6	-174.3	72.3	0	0	111.9	M516 A517 T522 L523 E524	M516-M520 WeakPolarHBondContact O-CG 3.45Å; M516-M520 PolarHBondContact O-N 3.37Å; A517-M520 PolarHBondContact O-N 3.14Å; M520-T522 VanDerWaalsContact C-N 3.29Å; M520-T522 PolarHBondContact O-N 3.16Å; M520-L523 PolarHBondContact O-N 3.36Å; M520-E524 PolarHBondContact O-N 3.33Å
521	V	84.2	Confident	80.7	Confident	86 Å²	86	92.2 Å²	92.2	52%	0.521	48%	0.476	S	S	.	.	H	α-helix	trans	-60.8	-40.7	176.4	174.5	0	0	0	0	111	A517 L523 E524 V525	A517-V521 WeakPolarHBondContact O-CG2 3.38Å; A517-V521 PolarHBondContact O-N 3.06Å; V521-L523 PolarHBondContact O-N 3.38Å; V521-E524 PolarHBondContact O-N 3.01Å; V521-V525 WeakPolarHBondContact O-CG2 3.44Å; V521-V525 PolarHBondContact O-N 2.89Å
522	T	77.5	Confident	81	Confident	78 Å²	78	90.3 Å²	90.3	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-44.4	177.9	-55.5	0	0	0	0	111.5	K518 Q519 M520 E524 V525 L526	K518-T522 WeakPolarHBondContact O-CB 3.3Å; K518-T522 PolarHBondContact O-N 3.23Å; K518-T522 PolarHBondContact O-OG1 3.48Å; Q519-T522 WeakPolarHBondContact O-CB 3.36Å; Q519-T522 PolarHBondContact O-N 3.16Å; M520-T522 VanDerWaalsContact C-N 3.29Å; M520-T522 PolarHBondContact O-N 3.16Å; T522-E524 VanDerWaalsContact C-N 3.32Å; T522-E524 PolarHBondContact O-N 3.42Å; T522-V525 PolarHBondContact O-N 2.88Å; T522-L526 HydrophobicContact CG2-CD1 4.22Å; T522-L526 VanDerWaalsContact O-CG 3.31Å; T522-L526 WeakPolarHBondContact O-CG 3.49Å; T522-L526 PolarHBondContact O-N 3.11Å
523	L	74.4	Confident	81.2	Confident	90 Å²	90	89.1 Å²	89.1	47%	0.471	46%	0.458	S	S	.	.	H	α-helix	trans	-64.7	-36.3	176.8	-72.8	173.7	0	0	0	112.3	Q519 M520 V521 L526 S527	Q519-L523 HydrophobicContact CG-CD1 4.32Å; Q519-L523 WeakPolarHBondContact O-CG 3.4Å; Q519-L523 PolarHBondContact O-N 3.45Å; M520-L523 PolarHBondContact O-N 3.36Å; V521-L523 PolarHBondContact O-N 3.38Å; L523-L526 PolarHBondContact O-N 3.35Å; L523-S527 VanDerWaalsContact O-CB 3.29Å; L523-S527 WeakPolarHBondContact O-CB 3.26Å; L523-S527 PolarHBondContact O-N 3.02Å
524	E	78	Confident	81.3	Confident	139 Å²	139	88.2 Å²	88.2	65%	0.65	45%	0.453	S	S	*	.	H	α-helix	trans	-63.1	-46.5	175.2	-173	178.1	-177.6	0	0	111.7	M520 V521 T522 L526 S527 Y528	M520-E524 PolarHBondContact O-N 3.33Å; V521-E524 PolarHBondContact O-N 3.01Å; T522-E524 VanDerWaalsContact C-N 3.32Å; T522-E524 PolarHBondContact O-N 3.42Å; E524-L526 PolarHBondContact O-N 2.58Å; E524-S527 WeakPolarHBondContact O-CB 3.48Å; E524-S527 PolarHBondContact O-N 3.43Å; E524-Y528 PolarHBondContact O-N 2.74Å
525	V	84.1	Confident	81.4	Confident	77 Å²	77	88.8 Å²	88.8	47%	0.467	46%	0.462	S	S	.	.	H	α-helix	trans	-61.4	-44.1	175.6	173	0	0	0	0	111.1	V521 T522 Y528 H529	V521-V525 WeakPolarHBondContact O-CG2 3.44Å; V521-V525 PolarHBondContact O-N 2.89Å; T522-V525 PolarHBondContact O-N 2.88Å; V525-Y528 PolarHBondContact O-N 3.44Å; V525-H529 PolarHBondContact O-CD2 3.04Å; V525-H529 VanDerWaalsContact O-CD2 3.22Å; V525-H529 PolarHBondContact O-N 2.98Å; V525-H529 VanDerWaalsContact O-N 3.15Å
526	L	79.3	Confident	81.8	Confident	92 Å²	92	90.3 Å²	90.3	48%	0.482	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-44.2	176	-72.3	171.9	0	0	0	111.8	T522 L523 E524 Y528 H529 A530	T522-L526 HydrophobicContact CG2-CD1 4.22Å; T522-L526 VanDerWaalsContact O-CG 3.31Å; T522-L526 WeakPolarHBondContact O-CG 3.49Å; T522-L526 PolarHBondContact O-N 3.11Å; L523-L526 PolarHBondContact O-N 3.35Å; E524-L526 PolarHBondContact O-N 2.58Å; L526-Y528 VanDerWaalsContact C-N 3.32Å; L526-Y528 PolarHBondContact O-N 3.18Å; L526-H529 PolarHBondContact O-N 3.46Å; L526-A530 VanDerWaalsContact O-CB 3.25Å; L526-A530 WeakPolarHBondContact O-CB 3.35Å; L526-A530 PolarHBondContact O-N 2.9Å
527	S	80.6	Confident	82.1	Confident	16 Å²	16	85.1 Å²	85.1	11%	0.112	44%	0.435	C	S	.	.	H	α-helix	trans	-59.2	-40.9	175.9	157.7	0	0	0	0	112.3	L523 E524 A530 S531 S695 P696	L523-S527 VanDerWaalsContact O-CB 3.29Å; L523-S527 WeakPolarHBondContact O-CB 3.26Å; L523-S527 PolarHBondContact O-N 3.02Å; E524-S527 WeakPolarHBondContact O-CB 3.48Å; E524-S527 PolarHBondContact O-N 3.43Å; S527-A530 PolarHBondContact O-N 3.45Å; S527-S531 VanDerWaalsContact O-CB 3.32Å; S527-S531 WeakPolarHBondContact O-CB 3.49Å; S527-S531 PolarHBondContact O-N 3.43Å; S527-S531 PolarHBondContact O-OG 3.28Å; S527-S695 PolarHBondContact OG-OG 3.49Å; S527-P696 WeakPolarHBondContact OG-CD 3.49Å
528	Y	82.1	Confident	82.4	Confident	180 Å²	180	89.9 Å²	89.9	71%	0.706	44%	0.441	S	S	*	.	H	α-helix	trans	-61.5	-46.7	176.2	-179.9	-99.2	0	0	0	111.8	E524 V525 L526 S531	E524-Y528 PolarHBondContact O-N 2.74Å; V525-Y528 PolarHBondContact O-N 3.44Å; L526-Y528 VanDerWaalsContact C-N 3.32Å; L526-Y528 PolarHBondContact O-N 3.18Å; Y528-S531 PolarHBondContact O-N 2.94Å
529	H	84.8	Confident	82.7	Confident	122 Å²	122	88.5 Å²	88.5	57%	0.565	44%	0.437	S	S	*	.	H	α-helix	trans	-72.8	-30.1	178.8	-72	-65.2	0	0	0	113.4	V525 L526 K604	V525-H529 PolarHBondContact O-CD2 3.04Å; V525-H529 VanDerWaalsContact O-CD2 3.22Å; V525-H529 PolarHBondContact O-N 2.98Å; V525-H529 VanDerWaalsContact O-N 3.15Å; L526-H529 PolarHBondContact O-N 3.46Å; H529-K604 WeakPolarHBondContact O-CE 3.37Å; H529-K604 PolarHBondContact O-NZ 3.35Å
530	A	84.5	Confident	83.1	Confident	7 Å²	7	82.8 Å²	82.8	6%	0.058	41%	0.41	C	S	.	.	H	α-helix	trans	-73.1	-33.4	175.6	0	0	0	0	0	112.3	L526 S527 N605 M691	L526-A530 VanDerWaalsContact O-CB 3.25Å; L526-A530 WeakPolarHBondContact O-CB 3.35Å; L526-A530 PolarHBondContact O-N 2.9Å; S527-A530 PolarHBondContact O-N 3.45Å; A530-N605 PolarHBondContact O-ND2 2.67Å; A530-M691 HydrophobicContact CB-CE 3.59Å
531	S	89.2	Confident	83.4	Confident	18 Å²	18	79.3 Å²	79.3	13%	0.126	39%	0.392	C	S	.	.	S	Bend	trans	-70.4	144.7	-178.4	-65.9	0	0	0	0	112.3	S527 Y528 S601 K604 N698	S527-S531 VanDerWaalsContact O-CB 3.32Å; S527-S531 WeakPolarHBondContact O-CB 3.49Å; S527-S531 PolarHBondContact O-N 3.43Å; S527-S531 PolarHBondContact O-OG 3.28Å; Y528-S531 PolarHBondContact O-N 2.94Å; S531-S601 WeakPolarHBondContact CA-OG 3.44Å; S531-K604 PolarHBondContact O-NZ 3Å; S531-N698 PolarHBondContact OG-ND2 3.06Å
532	A	89.1	Confident	83.3	Confident	7 Å²	7	79.3 Å²	79.3	6%	0.058	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-64.6	146.5	172	0	0	0	0	0	111.5	L600 S601	A532-L600 HydrophobicContact CB-CB 3.43Å; A532-L600 VanDerWaalsContact CB-CB 3.43Å; A532-L600 HydrophobicContact CB-CD1 4.42Å; A532-S601 PolarHBondContact N-OG 2.72Å
533	A	87.6	Confident	83.3	Confident	45 Å²	45	78.5 Å²	78.5	37%	0.372	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-62.7	146.8	176.2	0	0	0	0	0	110.9	E535 E536 T537	A533-E535 PolarHBondContact O-N 3.15Å; A533-E536 HydrophobicContact CB-CG 4.34Å; A533-E536 PolarHBondContact O-N 3.02Å; A533-T537 PolarHBondContact O-N 2.71Å; A533-T537 VanDerWaalsContact O-N 3.1Å; A533-T537 PolarHBondContact O-OG1 3.19Å
534	E	85.2	Confident	83.3	Confident	113 Å²	113	74.6 Å²	74.6	53%	0.528	37%	0.369	S	S	.	.	H	α-helix	trans	-61.5	-35	178.2	-73.1	-165	-174.6	0	0	112.4	T537 R538	E534-T537 WeakPolarHBondContact O-CB 3.34Å; E534-T537 PolarHBondContact O-N 2.96Å; E534-R538 WeakPolarHBondContact O-CG 3.4Å; E534-R538 PolarHBondContact O-N 2.92Å; E534-R538 IonicContact OE2-CZ 2.71Å; E534-R538 IonicContact OE2-NH2 3.19Å; E534-R538 PolarHBondContact OE2-NH2 2.91Å
535	E	86.1	Confident	83	Confident	162 Å²	162	72 Å²	72	76%	0.757	37%	0.371	S	S	*	.	H	α-helix	trans	-63.9	-49.3	179.5	-64.8	179.7	178.6	0	0	111.7	A533 T537 R538 E539	A533-E535 PolarHBondContact O-N 3.15Å; E535-T537 PolarHBondContact O-N 2.89Å; E535-R538 PolarHBondContact O-N 3.23Å; E535-R538 VanDerWaalsContact O-N 3.17Å; E535-E539 PolarHBondContact O-N 2.82Å
536	E	83.8	Confident	82.3	Confident	88 Å²	88	72 Å²	72	41%	0.411	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-37.6	175.1	-66.8	-178.2	-152.9	0	0	111.5	A533 E539 L540 L600	A533-E536 HydrophobicContact CB-CG 4.34Å; A533-E536 PolarHBondContact O-N 3.02Å; E536-E539 PolarHBondContact O-N 3.5Å; E536-L540 PolarHBondContact O-N 3.11Å; E536-L600 HydrophobicContact CB-CD1 4.2Å
537	T	85.8	Confident	81.8	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.006	38%	0.381	C	S	.	.	H	α-helix	trans	-65.2	-43.4	177.1	-56.3	0	0	0	0	111.2	A533 E534 E535 L540 Q541 E593 C596 R597	A533-T537 PolarHBondContact O-N 2.71Å; A533-T537 VanDerWaalsContact O-N 3.1Å; A533-T537 PolarHBondContact O-OG1 3.19Å; E534-T537 WeakPolarHBondContact O-CB 3.34Å; E534-T537 PolarHBondContact O-N 2.96Å; E535-T537 PolarHBondContact O-N 2.89Å; T537-L540 PolarHBondContact O-N 3.49Å; T537-Q541 VanDerWaalsContact O-CB 3.25Å; T537-Q541 WeakPolarHBondContact O-CB 3.49Å; T537-Q541 PolarHBondContact O-N 3.45Å; T537-E593 HydrophobicContact CG2-CG 4.47Å; T537-C596 HydrophobicContact CG2-CB 4.39Å; T537-R597 HydrophobicContact CG2-CB 3.82Å; T537-R597 HydrophobicContact CG2-CG 4.37Å
538	R	84.6	Confident	81.6	Confident	153 Å²	153	72.3 Å²	72.3	58%	0.577	38%	0.384	S	S	*	.	H	α-helix	trans	-66.5	-38	177.6	-72.8	177.3	-165.2	173.2	10	111.8	E534 E535 Q541 S542	E534-R538 WeakPolarHBondContact O-CG 3.4Å; E534-R538 PolarHBondContact O-N 2.92Å; E534-R538 IonicContact OE2-CZ 2.71Å; E534-R538 IonicContact OE2-NH2 3.19Å; E534-R538 PolarHBondContact OE2-NH2 2.91Å; E535-R538 PolarHBondContact O-N 3.23Å; E535-R538 VanDerWaalsContact O-N 3.17Å; R538-Q541 PolarHBondContact O-N 3.35Å; R538-S542 WeakPolarHBondContact O-CB 3.45Å; R538-S542 PolarHBondContact O-N 3.49Å
539	E	84.4	Confident	81.6	Confident	125 Å²	125	65.3 Å²	65.3	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-50.7	175.5	-174.5	178.5	-162.1	0	0	111.2	E535 E536 Q541 S542 L543	E535-E539 PolarHBondContact O-N 2.82Å; E536-E539 PolarHBondContact O-N 3.5Å; E539-Q541 VanDerWaalsContact C-N 3.32Å; E539-Q541 PolarHBondContact O-N 2.95Å; E539-S542 PolarHBondContact O-N 3.26Å; E539-L543 WeakPolarHBondContact O-CB 3.36Å; E539-L543 PolarHBondContact O-N 2.9Å
540	L	84.3	Confident	81.8	Confident	1 Å²	1	62 Å²	62	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-61	-41.6	176.2	177.6	61.1	0	0	0	111.6	E536 T537 L543 A544 L569 A572 L573 I576 C596 L600	E536-L540 PolarHBondContact O-N 3.11Å; T537-L540 PolarHBondContact O-N 3.49Å; L540-L543 PolarHBondContact O-N 3.26Å; L540-A544 VanDerWaalsContact O-CB 3.22Å; L540-A544 WeakPolarHBondContact O-CB 3.34Å; L540-A544 PolarHBondContact O-N 2.93Å; L540-L569 HydrophobicContact CB-CD1 4.49Å; L540-L569 HydrophobicContact CD1-CD1 3.8Å; L540-A572 HydrophobicContact CD1-CB 4.25Å; L540-A572 HydrophobicContact CD2-CB 4.13Å; L540-L573 HydrophobicContact CD1-CD2 3.76Å; L540-L573 HydrophobicContact CD1-CG 4.18Å; L540-I576 HydrophobicContact CD1-CD1 4.12Å; L540-I576 HydrophobicContact CD2-CD1 4.18Å; L540-I576 HydrophobicContact CG-CD1 4.16Å; L540-C596 HydrophobicContact CD2-CB 3.92Å; L540-C596 HydrophobicContact CG-CB 4.27Å; L540-L600 HydrophobicContact CB-CD1 4.09Å; L540-L600 HydrophobicContact CD2-CD1 3.81Å; L540-L600 HydrophobicContact CD2-CD2 3.89Å; L540-L600 HydrophobicContact CD2-CG 3.65Å
541	Q	82.9	Confident	82	Confident	66 Å²	66	62 Å²	62	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-45.3	177.6	-177.8	-177.3	10.7	0	0	111.6	T537 R538 E539 L543 A544 A545	T537-Q541 VanDerWaalsContact O-CB 3.25Å; T537-Q541 WeakPolarHBondContact O-CB 3.49Å; T537-Q541 PolarHBondContact O-N 3.45Å; R538-Q541 PolarHBondContact O-N 3.35Å; E539-Q541 VanDerWaalsContact C-N 3.32Å; E539-Q541 PolarHBondContact O-N 2.95Å; Q541-L543 VanDerWaalsContact C-N 3.31Å; Q541-L543 PolarHBondContact O-N 3.04Å; Q541-A544 PolarHBondContact O-N 2.92Å; Q541-A545 VanDerWaalsContact O-CB 3.3Å; Q541-A545 WeakPolarHBondContact O-CB 3.44Å; Q541-A545 PolarHBondContact O-N 2.85Å
542	S	81.3	Confident	82	Confident	86 Å²	86	69.2 Å²	69.2	60%	0.601	38%	0.383	S	S	*	.	H	α-helix	trans	-61.6	-42.1	177.5	-176.5	0	0	0	0	111.2	R538 E539 A546	R538-S542 WeakPolarHBondContact O-CB 3.45Å; R538-S542 PolarHBondContact O-N 3.49Å; E539-S542 PolarHBondContact O-N 3.26Å; S542-A546 PolarHBondContact O-N 2.95Å
543	L	77.8	Confident	82	Confident	60 Å²	60	73.5 Å²	73.5	31%	0.314	41%	0.409	S	S	.	.	H	α-helix	trans	-69.5	-43.2	179.1	-174.3	60.9	0	0	0	111.9	E539 L540 Q541 A546 V547 L569 L573	E539-L543 WeakPolarHBondContact O-CB 3.36Å; E539-L543 PolarHBondContact O-N 2.9Å; L540-L543 PolarHBondContact O-N 3.26Å; Q541-L543 VanDerWaalsContact C-N 3.31Å; Q541-L543 PolarHBondContact O-N 3.04Å; L543-A546 PolarHBondContact O-N 3.06Å; L543-V547 PolarHBondContact O-N 3.5Å; L543-L569 HydrophobicContact CD2-CD1 4.29Å; L543-L569 HydrophobicContact CD2-CD2 3.49Å; L543-L569 VanDerWaalsContact CD2-CD2 3.49Å; L543-L569 HydrophobicContact CD2-CG 3.85Å; L543-L573 HydrophobicContact CD2-CD1 3.79Å; L543-L573 HydrophobicContact CD2-CG 4.49Å; L543-L573 HydrophobicContact CG-CD1 4.09Å; L543-L573 HydrophobicContact CG-CD2 4.36Å
544	A	74.4	Confident	82.1	Confident	8 Å²	8	72.9 Å²	72.9	7%	0.066	40%	0.399	C	S	.	.	H	α-helix	trans	-65.3	-39.7	177.5	0	0	0	0	0	111.7	L540 Q541 A546 V548 L573 I576 H592	L540-A544 VanDerWaalsContact O-CB 3.22Å; L540-A544 WeakPolarHBondContact O-CB 3.34Å; L540-A544 PolarHBondContact O-N 2.93Å; Q541-A544 PolarHBondContact O-N 2.92Å; A544-A546 PolarHBondContact O-N 3.32Å; A544-V548 HydrophobicContact CB-CG2 3.76Å; A544-V548 WeakPolarHBondContact O-CG2 3.49Å; A544-V548 PolarHBondContact O-N 3.02Å; A544-L573 HydrophobicContact CB-CD2 3.99Å; A544-I576 HydrophobicContact CB-CD1 4.02Å; A544-H592 WeakPolarHBondContact CB-NE2 3.5Å
545	A	71.4	Confident	82.6	Confident	84 Å²	84	72.8 Å²	72.8	69%	0.694	40%	0.397	S	S	*	.	H	α-helix	trans	-63.2	-29.5	175.9	0	0	0	0	0	112.9	Q541	Q541-A545 VanDerWaalsContact O-CB 3.3Å; Q541-A545 WeakPolarHBondContact O-CB 3.44Å; Q541-A545 PolarHBondContact O-N 2.85Å
546	A	68.4	Low	83.1	Confident	77 Å²	77	65 Å²	65	64%	0.636	36%	0.361	S	S	*	.	H	α-helix	trans	-89.2	-40.7	-178.8	0	0	0	0	0	113.5	S542 L543 A544	S542-A546 PolarHBondContact O-N 2.95Å; L543-A546 PolarHBondContact O-N 3.06Å; A544-A546 PolarHBondContact O-N 3.32Å
547	V	69	Low	83.7	Confident	86 Å²	86	62.9 Å²	62.9	52%	0.521	35%	0.354	S	S	.	.	H	α-helix	trans	-154.3	62.9	-164.4	-164.7	0	0	0	0	111.5	L543 P549	L543-V547 PolarHBondContact O-N 3.5Å; V547-P549 HydrophobicContact CG1-CG 4.43Å; V547-P549 WeakPolarHBondContact O-CD 3.33Å
548	V	76.9	Confident	84.3	Confident	29 Å²	29	66.5 Å²	66.5	18%	0.176	37%	0.373	C	S	.	.			trans	-78.1	106.3	159	-178.4	0	0	0	0	107.4	A544 L573 I576 R577	A544-V548 HydrophobicContact CB-CG2 3.76Å; A544-V548 WeakPolarHBondContact O-CG2 3.49Å; A544-V548 PolarHBondContact O-N 3.02Å; V548-L573 HydrophobicContact CG2-CD2 4.44Å; V548-I576 HydrophobicContact CG2-CG2 4.19Å; V548-R577 HydrophobicContact CG1-CB 3.77Å; V548-R577 HydrophobicContact CG1-CG 4.48Å; V548-R577 PolarHBondContact O-NH2 2.69Å
549	P	82.4	Confident	84.9	Confident	34 Å²	34	60.1 Å²	60.1	22%	0.221	35%	0.35	C	S	.	.			trans	-65.7	159.8	-177.1	-14.3	31.7	0	0	0	110.6	V547 T553 L554 R577	V547-P549 HydrophobicContact CG1-CG 4.43Å; V547-P549 WeakPolarHBondContact O-CD 3.33Å; P549-T553 HydrophobicContact CB-CG2 4.16Å; P549-L554 HydrophobicContact CB-CD1 4.29Å; P549-L554 HydrophobicContact CB-CD2 3.97Å; P549-L554 HydrophobicContact CB-CG 3.95Å; P549-L554 HydrophobicContact CG-CD2 3.91Å; P549-L554 HydrophobicContact CG-CG 4.36Å; P549-R577 PolarHBondContact O-NE 2.96Å
550	S	88.9	Confident	85.5	Confident	53 Å²	53	57.9 Å²	57.9	37%	0.371	35%	0.348	S	S	.	.			trans	-68.1	155.3	178.8	73.3	0	0	0	0	111	Q552 T553 L554	S550-Q552 PolarHBondContact O-N 3.23Å; S550-Q552 VanDerWaalsContact O-N 3.17Å; S550-T553 PolarHBondContact O-N 3Å; S550-T553 PolarHBondContact OG-N 3.44Å; S550-T553 PolarHBondContact OG-OG1 3.34Å; S550-L554 WeakPolarHBondContact O-CG 3.43Å; S550-L554 PolarHBondContact O-N 3.49Å; S550-L554 VanDerWaalsContact O-N 3.08Å
551	A	89.1	Confident	86.1	Confident	7 Å²	7	58.6 Å²	58.6	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-57.4	-30.8	176.4	0	0	0	0	0	113	L554 K555 I556 T557 R577 D581	A551-L554 PolarHBondContact O-N 3.08Å; A551-K555 WeakPolarHBondContact O-CA 3.49Å; A551-K555 PolarHBondContact O-N 3Å; A551-I556 HydrophobicContact CB-CD1 3.88Å; A551-I556 HydrophobicContact CB-CG1 3.71Å; A551-I556 PolarHBondContact O-N 2.83Å; A551-T557 HydrophobicContact CB-CG2 4.19Å; A551-R577 HydrophobicContact CB-CG 4.3Å; A551-D581 WeakPolarHBondContact CB-OD2 3.38Å
552	Q	88	Confident	86.8	Confident	168 Å²	168	56.4 Å²	56.4	79%	0.785	34%	0.343	S	S	*	.	H	α-helix	trans	-67.9	-40.8	176	-170.1	174.2	15.4	0	0	112.2	S550 K555	S550-Q552 PolarHBondContact O-N 3.23Å; S550-Q552 VanDerWaalsContact O-N 3.17Å; Q552-K555 PolarHBondContact O-N 3.28Å
553	T	90.4	Very high	87.5	Confident	98 Å²	98	52.7 Å²	52.7	60%	0.601	32%	0.316	S	S	*	.	H	α-helix	trans	-66	-40.8	175.6	-59.9	0	0	0	0	111.4	P549 S550 K555	P549-T553 HydrophobicContact CB-CG2 4.16Å; S550-T553 PolarHBondContact O-N 3Å; S550-T553 PolarHBondContact OG-N 3.44Å; S550-T553 PolarHBondContact OG-OG1 3.34Å; T553-K555 VanDerWaalsContact C-N 3.28Å; T553-K555 PolarHBondContact O-N 3.37Å
554	L	90.1	Very high	88.3	Confident	31 Å²	31	53.6 Å²	53.6	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-79.2	-10.1	-180	-60.7	170.8	0	0	0	113.3	P549 S550 A551 I556 F561 R577	P549-L554 HydrophobicContact CB-CD1 4.29Å; P549-L554 HydrophobicContact CB-CD2 3.97Å; P549-L554 HydrophobicContact CB-CG 3.95Å; P549-L554 HydrophobicContact CG-CD2 3.91Å; P549-L554 HydrophobicContact CG-CG 4.36Å; S550-L554 WeakPolarHBondContact O-CG 3.43Å; S550-L554 PolarHBondContact O-N 3.49Å; S550-L554 VanDerWaalsContact O-N 3.08Å; A551-L554 PolarHBondContact O-N 3.08Å; L554-I556 HydrophobicContact CB-CG1 4.24Å; L554-I556 HydrophobicContact CB-CG2 3.81Å; L554-I556 PolarHBondContact O-N 3.14Å; L554-I556 VanDerWaalsContact O-N 3.08Å; L554-F561 WeakPolarHBondContact O-CE2 3.48Å; L554-R577 HydrophobicContact CD1-CB 4.18Å; L554-R577 HydrophobicContact CD1-CG 4.16Å
555	K	95.1	Very high	89.1	Confident	111 Å²	111	60.4 Å²	60.4	48%	0.483	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	22.4	-176.2	-51.8	173.1	-170.4	162.1	0	113.9	A551 Q552 T553 T557 D558 F561	A551-K555 WeakPolarHBondContact O-CA 3.49Å; A551-K555 PolarHBondContact O-N 3Å; Q552-K555 PolarHBondContact O-N 3.28Å; T553-K555 VanDerWaalsContact C-N 3.28Å; T553-K555 PolarHBondContact O-N 3.37Å; K555-T557 PolarHBondContact O-N 3.18Å; K555-D558 WeakPolarHBondContact O-CB 3.36Å; K555-D558 PolarHBondContact O-N 3.07Å; K555-D558 VanDerWaalsContact O-N 3.1Å; K555-F561 HydrophobicContact CB-CD2 4.49Å
556	I	96.1	Very high	90.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-8.9	-175.7	56.2	168.3	0	0	0	113.1	A551 L554 D558 F561 C574 R577 M578 Q623 F626	A551-I556 HydrophobicContact CB-CD1 3.88Å; A551-I556 HydrophobicContact CB-CG1 3.71Å; A551-I556 PolarHBondContact O-N 2.83Å; L554-I556 HydrophobicContact CB-CG1 4.24Å; L554-I556 HydrophobicContact CB-CG2 3.81Å; L554-I556 PolarHBondContact O-N 3.14Å; L554-I556 VanDerWaalsContact O-N 3.08Å; I556-D558 VanDerWaalsContact C-N 3.34Å; I556-F561 HydrophobicContact CG2-CD2 4.32Å; I556-F561 HydrophobicContact CG2-CE2 3.92Å; I556-F561 HydrophobicContact CG2-CZ 4.36Å; I556-C574 HydrophobicContact CG2-CB 4.1Å; I556-R577 HydrophobicContact CD1-CB 4.15Å; I556-R577 HydrophobicContact CD1-CG 3.64Å; I556-M578 HydrophobicContact CB-CE 4.38Å; I556-M578 HydrophobicContact CD1-CG 4.04Å; I556-M578 HydrophobicContact CG2-CE 4.23Å; I556-Q623 HydrophobicContact CB-CG 4.34Å; I556-Q623 HydrophobicContact CG2-CG 4.5Å; I556-Q623 PolarHBondContact O-NE2 3.4Å; I556-F626 HydrophobicContact CD1-CD1 4.38Å; I556-F626 HydrophobicContact CD1-CE1 3.86Å; I556-F626 HydrophobicContact CD1-CZ 4.27Å; I556-F626 HydrophobicContact CG1-CD1 4.42Å; I556-F626 HydrophobicContact CG1-CE1 3.92Å; I556-F626 WeakPolarHBondContact O-CD1 3.4Å
557	T	96.9	Very high	91.5	Very high	42 Å²	42	56.6 Å²	56.6	26%	0.258	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-16	170.4	50.5	0	0	0	0	113.2	A551 K555 F626 A631	A551-T557 HydrophobicContact CB-CG2 4.19Å; K555-T557 PolarHBondContact O-N 3.18Å; T557-F626 HydrophobicContact CG2-CE1 3.99Å; T557-A631 WeakPolarHBondContact O-CB 3.39Å
558	D	97.1	Very high	92.6	Very high	78 Å²	78	55.3 Å²	55.3	42%	0.417	30%	0.3	S	S	.	.			trans	-89.4	131.3	-170.4	-60.1	-12.4	0	0	0	110.6	K555 I556 S560 F561 Q623	K555-D558 WeakPolarHBondContact O-CB 3.36Å; K555-D558 PolarHBondContact O-N 3.07Å; K555-D558 VanDerWaalsContact O-N 3.1Å; I556-D558 VanDerWaalsContact C-N 3.34Å; D558-S560 PolarHBondContact O-N 3.08Å; D558-F561 WeakPolarHBondContact O-CB 3.43Å; D558-F561 PolarHBondContact O-N 3.03Å; D558-F561 VanDerWaalsContact O-N 3.12Å; D558-Q623 PolarHBondContact O-NE2 3.35Å
559	F	97.6	Very high	93.2	Very high	19 Å²	19	56.9 Å²	56.9	8%	0.083	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.3	175.4	-70.9	-63.4	0	0	0	112.8	F561 A627 A628 A631 K770 P841 L842	F559-F561 VanDerWaalsContact C-N 3.26Å; F559-F561 PolarHBondContact O-N 3.29Å; F559-A627 HydrophobicContact CD1-CB 3.86Å; F559-A627 HydrophobicContact CE1-CB 3.77Å; F559-A627 HydrophobicContact CZ-CB 4.4Å; F559-A628 HydrophobicContact CE1-CB 4.25Å; F559-A628 HydrophobicContact CZ-CB 4.47Å; F559-A631 HydrophobicContact CE2-CB 4.27Å; F559-K770 WeakPolarHBondContact O-CD 3.38Å; F559-K770 PolarHBondContact O-NZ 3.49Å; F559-P841 HydrophobicContact CB-CB 4.49Å; F559-P841 HydrophobicContact CD2-CB 3.87Å; F559-P841 HydrophobicContact CD2-CG 4.1Å; F559-P841 HydrophobicContact CE2-CG 4.49Å; F559-L842 HydrophobicContact CB-CD2 4.26Å; F559-L842 HydrophobicContact CD1-CD1 4.19Å; F559-L842 HydrophobicContact CD1-CD2 3.52Å; F559-L842 HydrophobicContact CD1-CG 3.81Å; F559-L842 HydrophobicContact CE1-CD1 3.82Å; F559-L842 HydrophobicContact CE1-CD2 4.03Å; F559-L842 HydrophobicContact CE1-CG 3.91Å; F559-L842 HydrophobicContact CG-CD2 4.02Å; F559-L842 HydrophobicContact CG-CG 4.19Å; F559-L842 HydrophobicContact CZ-CD1 4.27Å; F559-L842 HydrophobicContact CZ-CG 4.36Å
560	S	97.1	Very high	93.6	Very high	78 Å²	78	59.1 Å²	59.1	55%	0.545	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	4	177.4	-63.8	0	0	0	0	114.5	D558	D558-S560 PolarHBondContact O-N 3.08Å
561	F	97.6	Very high	94	Very high	15 Å²	15	56.6 Å²	56.6	7%	0.066	30%	0.297	C	S	.	.			trans	-52.7	145.5	178.2	172.8	-90.1	0	0	0	113	L554 K555 I556 D558 F559 D563 L566 F619 Q623 K770	L554-F561 WeakPolarHBondContact O-CE2 3.48Å; K555-F561 HydrophobicContact CB-CD2 4.49Å; I556-F561 HydrophobicContact CG2-CD2 4.32Å; I556-F561 HydrophobicContact CG2-CE2 3.92Å; I556-F561 HydrophobicContact CG2-CZ 4.36Å; D558-F561 WeakPolarHBondContact O-CB 3.43Å; D558-F561 PolarHBondContact O-N 3.03Å; D558-F561 VanDerWaalsContact O-N 3.12Å; F559-F561 VanDerWaalsContact C-N 3.26Å; F559-F561 PolarHBondContact O-N 3.29Å; F561-D563 HydrophobicContact CE1-CB 4.06Å; F561-D563 HydrophobicContact CZ-CB 4.36Å; F561-L566 HydrophobicContact CE2-CD1 3.99Å; F561-L566 HydrophobicContact CZ-CD1 3.56Å; F561-F619 AromaticContact CE1-CE1 3.64Å; F561-F619 HydrophobicContact CE1-CE1 3.64Å; F561-F619 HydrophobicContact CE1-CZ 4.2Å; F561-F619 AromaticContact CZ-CE1 3.74Å; F561-F619 HydrophobicContact CZ-CE1 3.74Å; F561-F619 HydrophobicContact CZ-CZ 4.01Å; F561-Q623 HydrophobicContact CD1-CB 4.46Å; F561-Q623 HydrophobicContact CD1-CG 3.66Å; F561-Q623 HydrophobicContact CE1-CG 4.01Å; F561-Q623 HydrophobicContact CG-CG 4.05Å; F561-K770 PolarHBondContact O-NZ 3.5Å
562	S	96.8	Very high	94.2	Very high	21 Å²	21	56.3 Å²	56.3	15%	0.147	29%	0.294	C	S	.	.			trans	-137.7	139.6	175.7	-174	0	0	0	0	110.5	F564	S562-F564 WeakPolarHBondContact OG-CD2 3.31Å
563	D	96.2	Very high	94.4	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.037	26%	0.26	C	S	.	.			trans	-99.7	-1	-179.7	73.5	-60	0	0	0	113.9	F561 E565 L566 R616 F619 N620	F561-D563 HydrophobicContact CE1-CB 4.06Å; F561-D563 HydrophobicContact CZ-CB 4.36Å; D563-E565 PolarHBondContact O-N 2.93Å; D563-E565 VanDerWaalsContact O-N 3.11Å; D563-L566 HydrophobicContact CB-CD1 4.49Å; D563-L566 WeakPolarHBondContact O-CB 3.49Å; D563-L566 PolarHBondContact O-N 3.25Å; D563-R616 PolarHBondContact O-NH1 3.02Å; D563-R616 WeakPolarHBondContact OD2-CB 3.46Å; D563-R616 VanDerWaalsContact OD2-CD 3.26Å; D563-R616 WeakPolarHBondContact OD2-CD 3.44Å; D563-R616 WeakPolarHBondContact OD2-CG 3.43Å; D563-R616 IonicContact OD2-CZ 2.93Å; D563-R616 IonicContact OD2-NE 3.36Å; D563-R616 IonicContact OD2-NH1 3.92Å; D563-R616 PolarHBondContact OD2-NH1 2.98Å; D563-F619 HydrophobicContact CB-CD1 4.14Å; D563-F619 HydrophobicContact CB-CE1 3.99Å; D563-N620 PolarHBondContact OD1-ND2 3.38Å
564	F	93.9	Very high	94.7	Very high	79 Å²	79	44.2 Å²	44.2	35%	0.346	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.4	-175.8	-69.9	-44.3	0	0	0	114	S562 I774 R777 I778	S562-F564 WeakPolarHBondContact OG-CD2 3.31Å; F564-I774 HydrophobicContact CD2-CG1 4.49Å; F564-I774 HydrophobicContact CE2-CB 4.29Å; F564-I774 HydrophobicContact CE2-CG1 4.36Å; F564-I774 HydrophobicContact CE2-CG2 3.86Å; F564-R777 HydrophobicContact CE2-CB 3.96Å; F564-R777 HydrophobicContact CE2-CG 4.48Å; F564-R777 HydrophobicContact CZ-CB 3.75Å; F564-I778 HydrophobicContact CE1-CD1 4.19Å; F564-I778 HydrophobicContact CZ-CD1 3.71Å; F564-I778 HydrophobicContact CZ-CG1 4.19Å
565	E	93	Very high	95	Very high	151 Å²	151	42.8 Å²	42.8	71%	0.706	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-8.9	177	59.5	-164.8	-150.4	0	0	113.4	D563	D563-E565 PolarHBondContact O-N 2.93Å; D563-E565 VanDerWaalsContact O-N 3.11Å
566	L	94.4	Very high	95	Very high	29 Å²	29	37.5 Å²	37.5	15%	0.152	20%	0.201	C	C	.	.	S	Bend	trans	-97	140.6	-175.9	-55.6	-177.1	0	0	0	111.4	F561 D563 E570 T571 R616	F561-L566 HydrophobicContact CE2-CD1 3.99Å; F561-L566 HydrophobicContact CZ-CD1 3.56Å; D563-L566 HydrophobicContact CB-CD1 4.49Å; D563-L566 WeakPolarHBondContact O-CB 3.49Å; D563-L566 PolarHBondContact O-N 3.25Å; L566-E570 HydrophobicContact CB-CB 4.19Å; L566-E570 HydrophobicContact CD2-CB 4.43Å; L566-T571 HydrophobicContact CB-CG2 4.21Å; L566-R616 VanDerWaalsContact O-CZ 3.3Å; L566-R616 PolarHBondContact O-NH1 3.48Å; L566-R616 PolarHBondContact O-NH2 3.27Å
567	S	94.2	Very high	95	Very high	52 Å²	52	39.7 Å²	39.7	36%	0.364	21%	0.209	S	C	.	.			trans	-73.3	161.5	166.5	65.5	0	0	0	0	112	L569 E570 T571 R616	S567-L569 PolarHBondContact O-N 3.28Å; S567-E570 WeakPolarHBondContact CB-OE2 3.45Å; S567-E570 PolarHBondContact N-OE2 2.98Å; S567-E570 PolarHBondContact O-N 3.23Å; S567-E570 VanDerWaalsContact O-N 3.14Å; S567-E570 WeakPolarHBondContact OG-CG 3.34Å; S567-E570 PolarHBondContact OG-N 3.07Å; S567-E570 PolarHBondContact OG-OE2 2.98Å; S567-T571 PolarHBondContact O-N 3.39Å; S567-R616 VanDerWaalsContact C-NH2 3.33Å
568	D	91.8	Very high	95.1	Very high	60 Å²	60	37.7 Å²	37.7	32%	0.321	20%	0.197	S	C	.	.	H	α-helix	trans	-59.1	-33.1	176.7	-74.1	1	0	0	0	111.8	T571 A572 K603 R616	D568-T571 PolarHBondContact O-N 3.49Å; D568-T571 PolarHBondContact O-OG1 3.47Å; D568-A572 PolarHBondContact O-N 3.42Å; D568-K603 HydrophobicContact CB-CD 4.23Å; D568-R616 IonicContact OD1-CZ 3.32Å; D568-R616 VanDerWaalsContact OD1-CZ 3.27Å; D568-R616 IonicContact OD1-NE 2.91Å; D568-R616 PolarHBondContact OD1-NE 3.4Å; D568-R616 IonicContact OD1-NH2 2.72Å; D568-R616 PolarHBondContact OD1-NH2 3.08Å
569	L	90.2	Very high	95.1	Very high	61 Å²	61	34 Å²	34	32%	0.319	18%	0.177	S	C	.	.	H	α-helix	trans	-67.6	-43.4	176.8	-175.2	62.4	0	0	0	111.7	L540 L543 S567 T571 A572 L573	L540-L569 HydrophobicContact CB-CD1 4.49Å; L540-L569 HydrophobicContact CD1-CD1 3.8Å; L543-L569 HydrophobicContact CD2-CD1 4.29Å; L543-L569 HydrophobicContact CD2-CD2 3.49Å; L543-L569 VanDerWaalsContact CD2-CD2 3.49Å; L543-L569 HydrophobicContact CD2-CG 3.85Å; S567-L569 PolarHBondContact O-N 3.28Å; L569-T571 VanDerWaalsContact C-N 3.31Å; L569-T571 PolarHBondContact O-N 2.73Å; L569-A572 WeakPolarHBondContact O-CB 3.42Å; L569-A572 PolarHBondContact O-N 3.01Å; L569-A572 VanDerWaalsContact O-N 3.16Å; L569-L573 PolarHBondContact O-N 3.37Å
570	E	92.1	Very high	95	Very high	82 Å²	82	35.6 Å²	35.6	38%	0.383	19%	0.188	S	C	.	.	H	α-helix	trans	-63.8	-37.3	176	-72.9	164.1	128.4	0	0	111.7	L566 S567 A572 L573 C574	L566-E570 HydrophobicContact CB-CB 4.19Å; L566-E570 HydrophobicContact CD2-CB 4.43Å; S567-E570 WeakPolarHBondContact CB-OE2 3.45Å; S567-E570 PolarHBondContact N-OE2 2.98Å; S567-E570 PolarHBondContact O-N 3.23Å; S567-E570 VanDerWaalsContact O-N 3.14Å; S567-E570 WeakPolarHBondContact OG-CG 3.34Å; S567-E570 PolarHBondContact OG-N 3.07Å; S567-E570 PolarHBondContact OG-OE2 2.98Å; E570-A572 VanDerWaalsContact C-N 3.31Å; E570-A572 PolarHBondContact O-N 2.91Å; E570-L573 PolarHBondContact O-N 3.43Å; E570-C574 PolarHBondContact O-N 2.9Å; E570-C574 PolarHBondContact O-SG 3.03Å
571	T	95.4	Very high	94.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-37.7	173.6	63	0	0	0	0	112.2	L566 S567 D568 L569 C574 T575 W615 F619	L566-T571 HydrophobicContact CB-CG2 4.21Å; S567-T571 PolarHBondContact O-N 3.39Å; D568-T571 PolarHBondContact O-N 3.49Å; D568-T571 PolarHBondContact O-OG1 3.47Å; L569-T571 VanDerWaalsContact C-N 3.31Å; L569-T571 PolarHBondContact O-N 2.73Å; T571-C574 WeakPolarHBondContact O-CB 3.3Å; T571-C574 PolarHBondContact O-N 3.31Å; T571-T575 PolarHBondContact O-N 2.76Å; T571-T575 PolarHBondContact O-OG1 3.46Å; T571-T575 VanDerWaalsContact O-OG1 3.05Å; T571-W615 PolarHBondContact OG1-NE1 2.63Å; T571-F619 HydrophobicContact CG2-CD1 3.75Å; T571-F619 HydrophobicContact CG2-CE1 3.69Å; T571-F619 HydrophobicContact CG2-CG 4.22Å; T571-F619 HydrophobicContact CG2-CZ 4.14Å; T571-F619 VanDerWaalsContact O-CE2 3.26Å; T571-F619 WeakPolarHBondContact O-CE2 3.49Å
572	A	94	Very high	94.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-40.2	174.8	0	0	0	0	0	112.2	L540 D568 L569 E570 T575 I576 I599	L540-A572 HydrophobicContact CD1-CB 4.25Å; L540-A572 HydrophobicContact CD2-CB 4.13Å; D568-A572 PolarHBondContact O-N 3.42Å; L569-A572 WeakPolarHBondContact O-CB 3.42Å; L569-A572 PolarHBondContact O-N 3.01Å; L569-A572 VanDerWaalsContact O-N 3.16Å; E570-A572 VanDerWaalsContact C-N 3.31Å; E570-A572 PolarHBondContact O-N 2.91Å; A572-T575 WeakPolarHBondContact O-CB 3.03Å; A572-T575 PolarHBondContact O-N 3.43Å; A572-I576 WeakPolarHBondContact O-CG1 3.32Å; A572-I576 PolarHBondContact O-N 3.28Å; A572-I599 HydrophobicContact CB-CG2 3.9Å
573	L	92.7	Very high	94.9	Very high	13 Å²	13	36.3 Å²	36.3	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-42.1	173.4	-68.4	174.2	0	0	0	111.9	L540 L543 A544 V548 L569 E570 T575 I576 R577	L540-L573 HydrophobicContact CD1-CD2 3.76Å; L540-L573 HydrophobicContact CD1-CG 4.18Å; L543-L573 HydrophobicContact CD2-CD1 3.79Å; L543-L573 HydrophobicContact CD2-CG 4.49Å; L543-L573 HydrophobicContact CG-CD1 4.09Å; L543-L573 HydrophobicContact CG-CD2 4.36Å; A544-L573 HydrophobicContact CB-CD2 3.99Å; V548-L573 HydrophobicContact CG2-CD2 4.44Å; L569-L573 PolarHBondContact O-N 3.37Å; E570-L573 PolarHBondContact O-N 3.43Å; L573-T575 VanDerWaalsContact C-N 3.3Å; L573-T575 PolarHBondContact O-N 3.16Å; L573-I576 PolarHBondContact O-N 3.01Å; L573-R577 PolarHBondContact O-N 3.24Å
574	C	95.4	Very high	94.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.3	-43.4	172.8	-72.2	0	0	0	0	111.1	I556 E570 T571 R577 M578 F619	I556-C574 HydrophobicContact CG2-CB 4.1Å; E570-C574 PolarHBondContact O-N 2.9Å; E570-C574 PolarHBondContact O-SG 3.03Å; T571-C574 WeakPolarHBondContact O-CB 3.3Å; T571-C574 PolarHBondContact O-N 3.31Å; C574-R577 WeakPolarHBondContact O-CB 3.02Å; C574-R577 PolarHBondContact O-N 3.02Å; C574-M578 HydrophobicContact CB-CE 4.34Å; C574-M578 WeakPolarHBondContact O-CG 3.42Å; C574-M578 PolarHBondContact O-N 3.12Å; C574-F619 HydrophobicContact CB-CE2 3.55Å; C574-F619 HydrophobicContact CB-CZ 3.52Å
575	T	97.2	Very high	95	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-46.8	175.8	-55.6	0	0	0	0	111.6	T571 A572 L573 R577 M578 F579 I599 L651	T571-T575 PolarHBondContact O-N 2.76Å; T571-T575 PolarHBondContact O-OG1 3.46Å; T571-T575 VanDerWaalsContact O-OG1 3.05Å; A572-T575 WeakPolarHBondContact O-CB 3.03Å; A572-T575 PolarHBondContact O-N 3.43Å; L573-T575 VanDerWaalsContact C-N 3.3Å; L573-T575 PolarHBondContact O-N 3.16Å; T575-R577 PolarHBondContact O-N 3.18Å; T575-M578 WeakPolarHBondContact O-CB 3.36Å; T575-M578 PolarHBondContact O-N 3.2Å; T575-M578 VanDerWaalsContact O-N 3.07Å; T575-F579 HydrophobicContact CG2-CD2 4.11Å; T575-F579 HydrophobicContact CG2-CE2 3.92Å; T575-F579 WeakPolarHBondContact O-CD2 3.21Å; T575-F579 PolarHBondContact O-N 2.87Å; T575-F579 VanDerWaalsContact O-N 3.16Å; T575-I599 HydrophobicContact CG2-CD1 3.7Å; T575-I599 HydrophobicContact CG2-CG1 3.86Å; T575-I599 HydrophobicContact CG2-CG2 4.23Å; T575-L651 HydrophobicContact CG2-CD1 3.61Å; T575-L651 HydrophobicContact CG2-CD2 4.09Å
576	I	95.5	Very high	95.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-56.1	-43	174.8	-65.7	168.8	0	0	0	110.6	L540 A544 V548 A572 L573 F579 T580 I599	L540-I576 HydrophobicContact CD1-CD1 4.12Å; L540-I576 HydrophobicContact CD2-CD1 4.18Å; L540-I576 HydrophobicContact CG-CD1 4.16Å; A544-I576 HydrophobicContact CB-CD1 4.02Å; V548-I576 HydrophobicContact CG2-CG2 4.19Å; A572-I576 WeakPolarHBondContact O-CG1 3.32Å; A572-I576 PolarHBondContact O-N 3.28Å; L573-I576 PolarHBondContact O-N 3.01Å; I576-F579 PolarHBondContact O-N 3.43Å; I576-T580 WeakPolarHBondContact O-CB 3.3Å; I576-T580 PolarHBondContact O-N 2.78Å; I576-T580 PolarHBondContact O-OG1 3.1Å; I576-I599 HydrophobicContact CB-CD1 4.47Å; I576-I599 HydrophobicContact CG1-CD1 3.47Å; I576-I599 VanDerWaalsContact CG1-CD1 3.47Å
577	R	95.8	Very high	95.1	Very high	45 Å²	45	35.1 Å²	35.1	17%	0.17	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-41.1	177.1	177.4	55.1	65.2	-162.7	-2.1	111.9	V548 P549 A551 L554 I556 L573 C574 T575 F579 T580 D581	V548-R577 HydrophobicContact CG1-CB 3.77Å; V548-R577 HydrophobicContact CG1-CG 4.48Å; V548-R577 PolarHBondContact O-NH2 2.69Å; P549-R577 PolarHBondContact O-NE 2.96Å; A551-R577 HydrophobicContact CB-CG 4.3Å; L554-R577 HydrophobicContact CD1-CB 4.18Å; L554-R577 HydrophobicContact CD1-CG 4.16Å; I556-R577 HydrophobicContact CD1-CB 4.15Å; I556-R577 HydrophobicContact CD1-CG 3.64Å; L573-R577 PolarHBondContact O-N 3.24Å; C574-R577 WeakPolarHBondContact O-CB 3.02Å; C574-R577 PolarHBondContact O-N 3.02Å; T575-R577 PolarHBondContact O-N 3.18Å; R577-F579 PolarHBondContact O-N 3.24Å; R577-T580 PolarHBondContact O-N 3.49Å; R577-D581 WeakPolarHBondContact CD-OD1 3.42Å; R577-D581 WeakPolarHBondContact CD-OD2 3.27Å; R577-D581 IonicContact CZ-OD1 3.01Å; R577-D581 IonicContact NE-OD1 3.47Å; R577-D581 IonicContact NH1-OD1 2.63Å; R577-D581 PolarHBondContact NH1-OD1 3.49Å; R577-D581 WeakPolarHBondContact O-CB 3.33Å; R577-D581 PolarHBondContact O-N 2.52Å
578	M	97.9	Very high	95.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-46.5	176.4	-66.5	169.7	-163.7	0	0	112	I556 C574 T575 T580 L582 F619 Q623 F626 L647	I556-M578 HydrophobicContact CB-CE 4.38Å; I556-M578 HydrophobicContact CD1-CG 4.04Å; I556-M578 HydrophobicContact CG2-CE 4.23Å; C574-M578 HydrophobicContact CB-CE 4.34Å; C574-M578 WeakPolarHBondContact O-CG 3.42Å; C574-M578 PolarHBondContact O-N 3.12Å; T575-M578 WeakPolarHBondContact O-CB 3.36Å; T575-M578 PolarHBondContact O-N 3.2Å; T575-M578 VanDerWaalsContact O-N 3.07Å; M578-T580 VanDerWaalsContact C-N 3.31Å; M578-T580 PolarHBondContact O-N 3.02Å; M578-L582 WeakPolarHBondContact O-CB 3.45Å; M578-L582 WeakPolarHBondContact O-CG 3.43Å; M578-L582 PolarHBondContact O-N 3.42Å; M578-L582 VanDerWaalsContact O-N 3.15Å; M578-F619 HydrophobicContact CE-CD2 4.38Å; M578-F619 HydrophobicContact CE-CE2 3.58Å; M578-F619 HydrophobicContact CE-CZ 4Å; M578-Q623 HydrophobicContact CE-CB 3.62Å; M578-Q623 HydrophobicContact CE-CG 3.89Å; M578-F626 HydrophobicContact CB-CB 4.43Å; M578-F626 HydrophobicContact CB-CD2 3.7Å; M578-F626 HydrophobicContact CB-CE2 4.13Å; M578-F626 HydrophobicContact CB-CG 4.09Å; M578-F626 HydrophobicContact CG-CB 3.99Å; M578-F626 HydrophobicContact CG-CD1 4.12Å; M578-F626 HydrophobicContact CG-CD2 3.84Å; M578-F626 HydrophobicContact CG-CE2 4.34Å; M578-F626 HydrophobicContact CG-CG 3.71Å; M578-F626 WeakPolarHBondContact O-CE2 3.32Å; M578-F626 HydrophobicContact SD-CB 4.17Å; M578-L647 HydrophobicContact CB-CD2 4.32Å
579	F	97.6	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-37.3	176	-82.8	-94.7	0	0	0	112.3	T575 I576 R577 L584 V585 M590 L595 W598 L644 L647 I648 L651	T575-F579 HydrophobicContact CG2-CD2 4.11Å; T575-F579 HydrophobicContact CG2-CE2 3.92Å; T575-F579 WeakPolarHBondContact O-CD2 3.21Å; T575-F579 PolarHBondContact O-N 2.87Å; T575-F579 VanDerWaalsContact O-N 3.16Å; I576-F579 PolarHBondContact O-N 3.43Å; R577-F579 PolarHBondContact O-N 3.24Å; F579-L584 HydrophobicContact CD1-CB 4.14Å; F579-L584 HydrophobicContact CD1-CD1 3.78Å; F579-L584 HydrophobicContact CE1-CD1 4.19Å; F579-L584 HydrophobicContact CG-CD1 4.47Å; F579-L584 PolarHBondContact O-N 3.24Å; F579-V585 HydrophobicContact CB-CG2 3.99Å; F579-M590 HydrophobicContact CD1-CE 4.47Å; F579-M590 HydrophobicContact CD1-SD 4.19Å; F579-M590 HydrophobicContact CE1-CE 4.5Å; F579-L595 HydrophobicContact CB-CD2 4.14Å; F579-L595 HydrophobicContact CD1-CD1 4.25Å; F579-L595 HydrophobicContact CD2-CD1 4.28Å; F579-L595 HydrophobicContact CE1-CD1 4.38Å; F579-L595 HydrophobicContact CE2-CD1 4.41Å; F579-L595 HydrophobicContact CG-CD1 4.21Å; F579-L595 HydrophobicContact CG-CD2 4.39Å; F579-L595 HydrophobicContact CZ-CD1 4.47Å; F579-W598 AromaticContact CE2-CZ3 3.94Å; F579-W598 HydrophobicContact CE2-CZ3 3.94Å; F579-W598 HydrophobicContact CZ-CH2 4.18Å; F579-W598 AromaticContact CZ-CZ3 3.73Å; F579-W598 HydrophobicContact CZ-CZ3 3.73Å; F579-L644 HydrophobicContact CE1-CD1 4.08Å; F579-L647 HydrophobicContact CD1-CD2 4.04Å; F579-L647 HydrophobicContact CD2-CD2 3.6Å; F579-L647 HydrophobicContact CE1-CD2 4.01Å; F579-L647 HydrophobicContact CE2-CD2 3.55Å; F579-L647 HydrophobicContact CE2-CG 4.01Å; F579-L647 HydrophobicContact CG-CD2 3.84Å; F579-L647 HydrophobicContact CZ-CD2 3.76Å; F579-L647 HydrophobicContact CZ-CG 4.09Å; F579-I648 HydrophobicContact CE1-CG1 4.36Å; F579-I648 HydrophobicContact CZ-CG1 4.18Å; F579-L651 HydrophobicContact CE2-CD1 3.72Å; F579-L651 HydrophobicContact CZ-CD1 4.19Å
580	T	95.3	Very high	95.6	Very high	53 Å²	53	34.6 Å²	34.6	33%	0.325	17%	0.173	S	C	.	.	H	α-helix	trans	-69	-49	-179.1	-56.4	0	0	0	0	111.4	I576 R577 M578 L582 N583	I576-T580 WeakPolarHBondContact O-CB 3.3Å; I576-T580 PolarHBondContact O-N 2.78Å; I576-T580 PolarHBondContact O-OG1 3.1Å; R577-T580 PolarHBondContact O-N 3.49Å; M578-T580 VanDerWaalsContact C-N 3.31Å; M578-T580 PolarHBondContact O-N 3.02Å; T580-L582 VanDerWaalsContact C-N 3.29Å; T580-L582 PolarHBondContact O-N 2.96Å; T580-N583 WeakPolarHBondContact O-CA 3.5Å; T580-N583 PolarHBondContact O-N 3.44Å
581	D	96.4	Very high	95.7	Very high	46 Å²	46	37.7 Å²	37.7	25%	0.246	19%	0.185	C	C	.	.	H	α-helix	trans	-75.7	-18.2	-175.5	-75.3	17.5	0	0	0	112.5	A551 R577 F626 K630	A551-D581 WeakPolarHBondContact CB-OD2 3.38Å; R577-D581 WeakPolarHBondContact CD-OD1 3.42Å; R577-D581 WeakPolarHBondContact CD-OD2 3.27Å; R577-D581 IonicContact CZ-OD1 3.01Å; R577-D581 IonicContact NE-OD1 3.47Å; R577-D581 IonicContact NH1-OD1 2.63Å; R577-D581 PolarHBondContact NH1-OD1 3.49Å; R577-D581 WeakPolarHBondContact O-CB 3.33Å; R577-D581 PolarHBondContact O-N 2.52Å; D581-F626 HydrophobicContact CB-CE2 4.02Å; D581-F626 HydrophobicContact CB-CZ 3.93Å; D581-K630 WeakPolarHBondContact O-CE 3.38Å; D581-K630 PolarHBondContact O-NZ 2.91Å
582	L	97	Very high	95.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	6.5	165.7	-73	170	0	0	0	113.3	M578 T580 L584 F626 L629 K630 I643 L647	M578-L582 WeakPolarHBondContact O-CB 3.45Å; M578-L582 WeakPolarHBondContact O-CG 3.43Å; M578-L582 PolarHBondContact O-N 3.42Å; M578-L582 VanDerWaalsContact O-N 3.15Å; T580-L582 VanDerWaalsContact C-N 3.29Å; T580-L582 PolarHBondContact O-N 2.96Å; L582-L584 HydrophobicContact CB-CD1 4.09Å; L582-L584 HydrophobicContact CB-CD2 4.41Å; L582-L584 HydrophobicContact CB-CG 3.79Å; L582-L584 HydrophobicContact CD1-CD1 4.36Å; L582-L584 PolarHBondContact O-N 2.95Å; L582-L584 VanDerWaalsContact O-N 3.09Å; L582-F626 HydrophobicContact CD1-CD2 3.72Å; L582-F626 HydrophobicContact CD1-CE2 4.28Å; L582-F626 HydrophobicContact CD2-CD2 4.43Å; L582-F626 HydrophobicContact CG-CD2 3.79Å; L582-F626 HydrophobicContact CG-CE2 3.85Å; L582-L629 HydrophobicContact CD1-CD1 4.05Å; L582-L629 HydrophobicContact CD2-CB 4.23Å; L582-L629 HydrophobicContact CD2-CD1 4.23Å; L582-K630 HydrophobicContact CD2-CD 4.36Å; L582-I643 HydrophobicContact CB-CG2 4.44Å; L582-I643 HydrophobicContact CD1-CG2 3.86Å; L582-I643 HydrophobicContact CD2-CG2 4.1Å; L582-I643 HydrophobicContact CG-CG2 4.36Å; L582-L647 HydrophobicContact CD1-CD2 4.04Å
583	N	96.3	Very high	95.4	Very high	83 Å²	83	44.7 Å²	44.7	44%	0.444	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	12.5	-179.8	-58.3	97.6	0	0	0	115	T580 V585 Q586 N587	T580-N583 WeakPolarHBondContact O-CA 3.5Å; T580-N583 PolarHBondContact O-N 3.44Å; N583-V585 PolarHBondContact O-N 3.24Å; N583-Q586 PolarHBondContact O-N 3.17Å; N583-N587 WeakPolarHBondContact O-CB 3.27Å; N583-N587 PolarHBondContact O-N 2.88Å; N583-N587 PolarHBondContact O-OD1 2.92Å
584	L	97.3	Very high	95.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-38	-175	-56.3	179	0	0	0	112.4	F579 L582 Q586 F588 M590 I643 L644 L647	F579-L584 HydrophobicContact CD1-CB 4.14Å; F579-L584 HydrophobicContact CD1-CD1 3.78Å; F579-L584 HydrophobicContact CE1-CD1 4.19Å; F579-L584 HydrophobicContact CG-CD1 4.47Å; F579-L584 PolarHBondContact O-N 3.24Å; L582-L584 HydrophobicContact CB-CD1 4.09Å; L582-L584 HydrophobicContact CB-CD2 4.41Å; L582-L584 HydrophobicContact CB-CG 3.79Å; L582-L584 HydrophobicContact CD1-CD1 4.36Å; L582-L584 PolarHBondContact O-N 2.95Å; L582-L584 VanDerWaalsContact O-N 3.09Å; L584-Q586 VanDerWaalsContact C-N 3.31Å; L584-Q586 PolarHBondContact O-N 3.06Å; L584-F588 HydrophobicContact CB-CD2 4.4Å; L584-F588 HydrophobicContact CD2-CD2 4.38Å; L584-F588 HydrophobicContact CD2-CE2 3.95Å; L584-F588 WeakPolarHBondContact O-CD2 3.46Å; L584-F588 PolarHBondContact O-N 3.27Å; L584-M590 HydrophobicContact CB-CE 4.45Å; L584-I643 HydrophobicContact CD1-CG2 4.47Å; L584-I643 HydrophobicContact CD2-CG2 4.15Å; L584-L644 HydrophobicContact CD1-CB 4.46Å; L584-L644 HydrophobicContact CD1-CD1 4.13Å; L584-L644 HydrophobicContact CD2-CB 4.16Å; L584-L647 HydrophobicContact CD1-CD2 3.95Å
585	V	95.3	Very high	95.6	Very high	35 Å²	35	44.9 Å²	44.9	21%	0.212	22%	0.219	C	C	.	.	H	α-helix	trans	-60.6	-43.4	178	-178	0	0	0	0	110.8	F579 N583 Q589 M590 L595	F579-V585 HydrophobicContact CB-CG2 3.99Å; N583-V585 PolarHBondContact O-N 3.24Å; V585-Q589 WeakPolarHBondContact O-CA 3.41Å; V585-Q589 PolarHBondContact O-N 2.7Å; V585-Q589 VanDerWaalsContact O-N 3.15Å; V585-M590 HydrophobicContact CG1-CB 4.32Å; V585-M590 PolarHBondContact O-N 3.47Å; V585-L595 HydrophobicContact CG2-CD2 3.86Å
586	Q	94.7	Very high	95.4	Very high	129 Å²	129	44.9 Å²	44.9	60%	0.603	22%	0.219	S	C	*	.	H	α-helix	trans	-75.6	-45.4	-179.7	-176.7	62.6	42.9	0	0	111.5	N583 L584 F588 Q589	N583-Q586 PolarHBondContact O-N 3.17Å; L584-Q586 VanDerWaalsContact C-N 3.31Å; L584-Q586 PolarHBondContact O-N 3.06Å; Q586-F588 VanDerWaalsContact C-N 3.34Å; Q586-F588 PolarHBondContact O-N 2.86Å; Q586-Q589 PolarHBondContact O-NE2 3.3Å
587	N	95.7	Very high	95.4	Very high	77 Å²	77	46.2 Å²	46.2	41%	0.412	22%	0.224	S	C	.	.	H	α-helix	trans	-68	-35.7	-174	-66.6	4.1	0	0	0	111.8	N583 D640	N583-N587 WeakPolarHBondContact O-CB 3.27Å; N583-N587 PolarHBondContact O-N 2.88Å; N583-N587 PolarHBondContact O-OD1 2.92Å; N587-D640 PolarHBondContact ND2-OD2 2.61Å
588	F	96.4	Very high	95.5	Very high	19 Å²	19	44.1 Å²	44.1	8%	0.083	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	11.5	-178.2	-58	-66.9	0	0	0	114.2	L584 Q586 M590 D640 L641 L644 L704	L584-F588 HydrophobicContact CB-CD2 4.4Å; L584-F588 HydrophobicContact CD2-CD2 4.38Å; L584-F588 HydrophobicContact CD2-CE2 3.95Å; L584-F588 WeakPolarHBondContact O-CD2 3.46Å; L584-F588 PolarHBondContact O-N 3.27Å; Q586-F588 VanDerWaalsContact C-N 3.34Å; Q586-F588 PolarHBondContact O-N 2.86Å; F588-M590 VanDerWaalsContact C-N 3.27Å; F588-M590 HydrophobicContact CB-CE 4.16Å; F588-M590 HydrophobicContact CB-CG 4.3Å; F588-M590 HydrophobicContact CD2-CE 4.4Å; F588-M590 PolarHBondContact O-N 3.16Å; F588-D640 HydrophobicContact CE2-CB 4.07Å; F588-D640 HydrophobicContact CZ-CB 3.87Å; F588-L641 HydrophobicContact CD1-CD2 4.4Å; F588-L641 HydrophobicContact CE1-CD2 3.41Å; F588-L641 VanDerWaalsContact CE1-CD2 3.41Å; F588-L641 HydrophobicContact CE1-CG 4.11Å; F588-L641 HydrophobicContact CZ-CD2 3.6Å; F588-L641 HydrophobicContact CZ-CG 4Å; F588-L644 HydrophobicContact CD2-CD2 3.76Å; F588-L644 HydrophobicContact CE2-CB 4.09Å; F588-L644 HydrophobicContact CE2-CD2 3.79Å; F588-L644 HydrophobicContact CE2-CG 4.48Å; F588-L644 HydrophobicContact CG-CD2 4.15Å; F588-L644 HydrophobicContact CZ-CD2 4.22Å; F588-L704 HydrophobicContact CB-CD1 3.91Å; F588-L704 HydrophobicContact CD1-CD1 3.66Å; F588-L704 HydrophobicContact CD1-CG 4.16Å; F588-L704 HydrophobicContact CG-CD1 3.99Å
589	Q	94.8	Very high	95.5	Very high	132 Å²	132	44.1 Å²	44.1	62%	0.617	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	43.5	176.5	-61.2	-65.4	-59.6	0	0	113.3	V585 Q586 K591	V585-Q589 WeakPolarHBondContact O-CA 3.41Å; V585-Q589 PolarHBondContact O-N 2.7Å; V585-Q589 VanDerWaalsContact O-N 3.15Å; Q586-Q589 PolarHBondContact O-NE2 3.3Å; Q589-K591 PolarHBondContact O-N 3.5Å
590	M	95.6	Very high	95.4	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.059	22%	0.218	C	C	.	.			trans	-70.5	125.4	-178.1	-60.8	-178	176.9	0	0	110.5	F579 L584 V585 F588 H592 L644	F579-M590 HydrophobicContact CD1-CE 4.47Å; F579-M590 HydrophobicContact CD1-SD 4.19Å; F579-M590 HydrophobicContact CE1-CE 4.5Å; L584-M590 HydrophobicContact CB-CE 4.45Å; V585-M590 HydrophobicContact CG1-CB 4.32Å; V585-M590 PolarHBondContact O-N 3.47Å; F588-M590 VanDerWaalsContact C-N 3.27Å; F588-M590 HydrophobicContact CB-CE 4.16Å; F588-M590 HydrophobicContact CB-CG 4.3Å; F588-M590 HydrophobicContact CD2-CE 4.4Å; F588-M590 PolarHBondContact O-N 3.16Å; M590-H592 PolarHBondContact O-N 3.5Å; M590-L644 HydrophobicContact CE-CD1 3.39Å; M590-L644 HydrophobicContact CE-CD2 4.2Å; M590-L644 HydrophobicContact CE-CG 4.45Å
591	K	94.1	Very high	95.4	Very high	146 Å²	146	41.9 Å²	41.9	64%	0.635	20%	0.202	S	C	*	.			trans	-65.9	126	172.9	-65.7	-180	-178.3	178	0	109.4	Q589 E593 V594 L595	Q589-K591 PolarHBondContact O-N 3.5Å; K591-E593 VanDerWaalsContact C-N 3.29Å; K591-E593 PolarHBondContact O-N 3.5Å; K591-V594 HydrophobicContact CB-CB 4.08Å; K591-V594 HydrophobicContact CB-CG2 3.79Å; K591-V594 HydrophobicContact CD-CG2 4.2Å; K591-V594 PolarHBondContact O-N 2.78Å; K591-L595 PolarHBondContact O-N 3.22Å
592	H	91.3	Very high	95.5	Very high	63 Å²	63	39.8 Å²	39.8	29%	0.292	19%	0.191	S	C	.	.	H	α-helix	trans	-57	-41	-176.6	-171.6	66.2	0	0	0	113.1	A544 M590 L595 C596	A544-H592 WeakPolarHBondContact CB-NE2 3.5Å; M590-H592 PolarHBondContact O-N 3.5Å; H592-L595 PolarHBondContact O-N 3.15Å; H592-C596 PolarHBondContact O-N 3.27Å; H592-C596 PolarHBondContact O-SG 3.42Å
593	E	92.1	Very high	95.5	Very high	84 Å²	84	41.3 Å²	41.3	39%	0.393	20%	0.198	S	C	.	.	H	α-helix	trans	-60.5	-45	175.5	-173.5	-163.1	166.4	0	0	112.4	T537 K591 L595 C596 R597	T537-E593 HydrophobicContact CG2-CG 4.47Å; K591-E593 VanDerWaalsContact C-N 3.29Å; K591-E593 PolarHBondContact O-N 3.5Å; E593-L595 VanDerWaalsContact C-N 3.34Å; E593-C596 PolarHBondContact O-N 3.3Å; E593-R597 WeakPolarHBondContact O-CB 3.11Å; E593-R597 PolarHBondContact O-N 2.97Å; E593-R597 IonicContact OE1-CZ 2.83Å; E593-R597 IonicContact OE1-NH1 2.73Å; E593-R597 IonicContact OE1-NH2 3.67Å; E593-R597 PolarHBondContact OE1-NH2 3.41Å
594	V	94.9	Very high	95.4	Very high	18 Å²	18	41.8 Å²	41.8	11%	0.109	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-39.2	-179.7	177.2	0	0	0	0	110.5	K591 R597 W598 G697 I700	K591-V594 HydrophobicContact CB-CB 4.08Å; K591-V594 HydrophobicContact CB-CG2 3.79Å; K591-V594 HydrophobicContact CD-CG2 4.2Å; K591-V594 PolarHBondContact O-N 2.78Å; V594-R597 PolarHBondContact O-N 3.38Å; V594-W598 VanDerWaalsContact O-CB 3.3Å; V594-W598 WeakPolarHBondContact O-CB 3.36Å; V594-W598 PolarHBondContact O-N 2.84Å; V594-G697 WeakPolarHBondContact CG1-O 3.32Å; V594-I700 HydrophobicContact CG1-CG2 3.93Å
595	L	95.7	Very high	95.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-45.9	174.7	-179.7	62.4	0	0	0	111.9	F579 V585 K591 H592 E593 R597 W598 I599 I700	F579-L595 HydrophobicContact CB-CD2 4.14Å; F579-L595 HydrophobicContact CD1-CD1 4.25Å; F579-L595 HydrophobicContact CD2-CD1 4.28Å; F579-L595 HydrophobicContact CE1-CD1 4.38Å; F579-L595 HydrophobicContact CE2-CD1 4.41Å; F579-L595 HydrophobicContact CG-CD1 4.21Å; F579-L595 HydrophobicContact CG-CD2 4.39Å; F579-L595 HydrophobicContact CZ-CD1 4.47Å; V585-L595 HydrophobicContact CG2-CD2 3.86Å; K591-L595 PolarHBondContact O-N 3.22Å; H592-L595 PolarHBondContact O-N 3.15Å; E593-L595 VanDerWaalsContact C-N 3.34Å; L595-R597 PolarHBondContact O-N 3.27Å; L595-W598 HydrophobicContact CD1-CE3 4.21Å; L595-W598 PolarHBondContact O-N 2.86Å; L595-I599 HydrophobicContact CD1-CD1 4.05Å; L595-I599 HydrophobicContact CD1-CG1 4.29Å; L595-I599 HydrophobicContact CG-CD1 3.97Å; L595-I599 VanDerWaalsContact O-CG1 3.29Å; L595-I599 WeakPolarHBondContact O-CG1 3.41Å; L595-I599 PolarHBondContact O-N 2.82Å; L595-I700 HydrophobicContact CB-CG2 4.34Å; L595-I700 HydrophobicContact CD1-CG2 4.15Å
596	C	94.6	Very high	95.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-47.3	176.5	-67.4	0	0	0	0	111.2	T537 L540 H592 E593 W598 I599 L600	T537-C596 HydrophobicContact CG2-CB 4.39Å; L540-C596 HydrophobicContact CD2-CB 3.92Å; L540-C596 HydrophobicContact CG-CB 4.27Å; H592-C596 PolarHBondContact O-N 3.27Å; H592-C596 PolarHBondContact O-SG 3.42Å; E593-C596 PolarHBondContact O-N 3.3Å; C596-W598 PolarHBondContact O-N 3.42Å; C596-I599 PolarHBondContact O-N 2.98Å; C596-L600 WeakPolarHBondContact O-CG 3.47Å; C596-L600 PolarHBondContact O-N 3.1Å; C596-L600 VanDerWaalsContact O-N 3.08Å
597	R	95.1	Very high	95.5	Very high	28 Å²	28	40.2 Å²	40.2	11%	0.106	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-46.2	177.6	-165.8	177.9	-70.2	106.5	-2.2	111.3	T537 E593 V594 L595 I599 L600 S601 G697 N698	T537-R597 HydrophobicContact CG2-CB 3.82Å; T537-R597 HydrophobicContact CG2-CG 4.37Å; E593-R597 WeakPolarHBondContact O-CB 3.11Å; E593-R597 PolarHBondContact O-N 2.97Å; E593-R597 IonicContact OE1-CZ 2.83Å; E593-R597 IonicContact OE1-NH1 2.73Å; E593-R597 IonicContact OE1-NH2 3.67Å; E593-R597 PolarHBondContact OE1-NH2 3.41Å; V594-R597 PolarHBondContact O-N 3.38Å; L595-R597 PolarHBondContact O-N 3.27Å; R597-I599 PolarHBondContact O-N 3.48Å; R597-L600 PolarHBondContact O-N 3.32Å; R597-S601 WeakPolarHBondContact O-CB 3.25Å; R597-S601 PolarHBondContact O-N 2.9Å; R597-S601 PolarHBondContact O-OG 3.5Å; R597-G697 WeakPolarHBondContact CD-O 3.25Å; R597-G697 PolarHBondContact NH1-O 3.44Å; R597-N698 VanDerWaalsContact C-OD1 3.32Å; R597-N698 PolarHBondContact O-OD1 3.3Å
598	W	97.3	Very high	95.3	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-46.8	178.9	178	83.3	0	0	0	112.4	F579 V594 L595 C596 L600 S601 V602 I648 L651 N698 I700	F579-W598 AromaticContact CE2-CZ3 3.94Å; F579-W598 HydrophobicContact CE2-CZ3 3.94Å; F579-W598 HydrophobicContact CZ-CH2 4.18Å; F579-W598 AromaticContact CZ-CZ3 3.73Å; F579-W598 HydrophobicContact CZ-CZ3 3.73Å; V594-W598 VanDerWaalsContact O-CB 3.3Å; V594-W598 WeakPolarHBondContact O-CB 3.36Å; V594-W598 PolarHBondContact O-N 2.84Å; L595-W598 HydrophobicContact CD1-CE3 4.21Å; L595-W598 PolarHBondContact O-N 2.86Å; C596-W598 PolarHBondContact O-N 3.42Å; W598-L600 VanDerWaalsContact C-N 3.34Å; W598-L600 PolarHBondContact O-N 3.49Å; W598-S601 PolarHBondContact O-N 3.46Å; W598-V602 HydrophobicContact CD2-CG2 4.07Å; W598-V602 HydrophobicContact CH2-CG2 4.29Å; W598-V602 HydrophobicContact CZ2-CG2 3.71Å; W598-V602 WeakPolarHBondContact O-CG2 3.47Å; W598-V602 PolarHBondContact O-N 3.49Å; W598-I648 HydrophobicContact CH2-CB 4.47Å; W598-I648 HydrophobicContact CH2-CG1 4.1Å; W598-I648 HydrophobicContact CH2-CG2 4.4Å; W598-I648 HydrophobicContact CZ2-CB 4.49Å; W598-I648 HydrophobicContact CZ2-CG1 4.25Å; W598-I648 HydrophobicContact CZ2-CG2 3.95Å; W598-L651 HydrophobicContact CH2-CB 4.21Å; W598-L651 HydrophobicContact CH2-CD1 3.76Å; W598-L651 HydrophobicContact CZ3-CD1 3.82Å; W598-N698 WeakPolarHBondContact CA-OD1 3.06Å; W598-N698 HydrophobicContact CB-CB 4.44Å; W598-N698 PolarHBondContact N-OD1 3.03Å; W598-I700 HydrophobicContact CB-CG2 3.62Å; W598-I700 HydrophobicContact CD2-CD1 3.63Å; W598-I700 HydrophobicContact CD2-CG1 4.26Å; W598-I700 HydrophobicContact CD2-CG2 4.35Å; W598-I700 HydrophobicContact CE3-CD1 3.82Å; W598-I700 HydrophobicContact CG-CD1 4.1Å; W598-I700 HydrophobicContact CG-CG1 4.21Å; W598-I700 HydrophobicContact CG-CG2 3.88Å; W598-I700 HydrophobicContact CH2-CD1 4.31Å; W598-I700 HydrophobicContact CZ2-CD1 4.12Å; W598-I700 HydrophobicContact CZ3-CD1 4.16Å
599	I	97.3	Very high	95.1	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-45.3	177.8	-66.7	166.6	0	0	0	110.9	A572 T575 I576 L595 C596 R597 V602 K603 W615	A572-I599 HydrophobicContact CB-CG2 3.9Å; T575-I599 HydrophobicContact CG2-CD1 3.7Å; T575-I599 HydrophobicContact CG2-CG1 3.86Å; T575-I599 HydrophobicContact CG2-CG2 4.23Å; I576-I599 HydrophobicContact CB-CD1 4.47Å; I576-I599 HydrophobicContact CG1-CD1 3.47Å; I576-I599 VanDerWaalsContact CG1-CD1 3.47Å; L595-I599 HydrophobicContact CD1-CD1 4.05Å; L595-I599 HydrophobicContact CD1-CG1 4.29Å; L595-I599 HydrophobicContact CG-CD1 3.97Å; L595-I599 VanDerWaalsContact O-CG1 3.29Å; L595-I599 WeakPolarHBondContact O-CG1 3.41Å; L595-I599 PolarHBondContact O-N 2.82Å; C596-I599 PolarHBondContact O-N 2.98Å; R597-I599 PolarHBondContact O-N 3.48Å; I599-V602 PolarHBondContact O-N 3.3Å; I599-K603 WeakPolarHBondContact O-CB 3.48Å; I599-K603 PolarHBondContact O-N 2.97Å; I599-W615 HydrophobicContact CG2-CH2 4.2Å
600	L	96	Very high	95.1	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-39	178.7	-68.9	176.2	0	0	0	112.2	A532 E536 L540 C596 R597 W598 K603 K604	A532-L600 HydrophobicContact CB-CB 3.43Å; A532-L600 VanDerWaalsContact CB-CB 3.43Å; A532-L600 HydrophobicContact CB-CD1 4.42Å; E536-L600 HydrophobicContact CB-CD1 4.2Å; L540-L600 HydrophobicContact CB-CD1 4.09Å; L540-L600 HydrophobicContact CD2-CD1 3.81Å; L540-L600 HydrophobicContact CD2-CD2 3.89Å; L540-L600 HydrophobicContact CD2-CG 3.65Å; C596-L600 WeakPolarHBondContact O-CG 3.47Å; C596-L600 PolarHBondContact O-N 3.1Å; C596-L600 VanDerWaalsContact O-N 3.08Å; R597-L600 PolarHBondContact O-N 3.32Å; W598-L600 VanDerWaalsContact C-N 3.34Å; W598-L600 PolarHBondContact O-N 3.49Å; L600-K603 PolarHBondContact O-N 3.43Å; L600-K604 VanDerWaalsContact O-CB 3.25Å; L600-K604 WeakPolarHBondContact O-CB 3.18Å; L600-K604 PolarHBondContact O-N 2.66Å
601	S	96.6	Very high	95.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-47.3	175.7	-61.7	0	0	0	0	110.7	S531 A532 R597 W598 K603 K604 N605 N698	S531-S601 WeakPolarHBondContact CA-OG 3.44Å; A532-S601 PolarHBondContact N-OG 2.72Å; R597-S601 WeakPolarHBondContact O-CB 3.25Å; R597-S601 PolarHBondContact O-N 2.9Å; R597-S601 PolarHBondContact O-OG 3.5Å; W598-S601 PolarHBondContact O-N 3.46Å; S601-K603 PolarHBondContact O-N 3.25Å; S601-K604 PolarHBondContact O-N 3.45Å; S601-N605 PolarHBondContact O-N 3.34Å; S601-N605 VanDerWaalsContact O-N 3.09Å; S601-N605 PolarHBondContact O-ND2 3.49Å; S601-N698 VanDerWaalsContact CB-OD1 3.32Å; S601-N698 WeakPolarHBondContact CB-OD1 3.29Å; S601-N698 PolarHBondContact OG-OD1 2.95Å
602	V	97.6	Very high	95.2	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-56	-52.5	174.3	169.3	0	0	0	0	110.1	W598 I599 K604 N605 Y606 W615 L651 L655 I692	W598-V602 HydrophobicContact CD2-CG2 4.07Å; W598-V602 HydrophobicContact CH2-CG2 4.29Å; W598-V602 HydrophobicContact CZ2-CG2 3.71Å; W598-V602 WeakPolarHBondContact O-CG2 3.47Å; W598-V602 PolarHBondContact O-N 3.49Å; I599-V602 PolarHBondContact O-N 3.3Å; V602-K604 VanDerWaalsContact C-N 3.33Å; V602-K604 PolarHBondContact O-N 3.26Å; V602-N605 PolarHBondContact O-N 3.47Å; V602-N605 VanDerWaalsContact O-N 3.15Å; V602-Y606 HydrophobicContact CG1-CD2 4.45Å; V602-Y606 HydrophobicContact CG1-CE2 3.87Å; V602-Y606 VanDerWaalsContact O-CD2 3.27Å; V602-Y606 WeakPolarHBondContact O-CD2 3.43Å; V602-Y606 PolarHBondContact O-N 2.9Å; V602-W615 HydrophobicContact CG1-CZ3 3.96Å; V602-L651 HydrophobicContact CG1-CB 4.48Å; V602-L651 WeakPolarHBondContact CG1-O 3.45Å; V602-L655 HydrophobicContact CG1-CD2 4.06Å; V602-L655 WeakPolarHBondContact O-CD2 3.37Å; V602-I692 HydrophobicContact CG2-CD1 4.31Å; V602-I692 HydrophobicContact CG2-CG2 4.31Å
603	K	96.6	Very high	95.5	Very high	32 Å²	32	38.6 Å²	38.6	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-54.2	-46.1	176	175.9	-176.4	67.5	64.3	0	112.6	D568 I599 L600 S601 N605 Y606 W615	D568-K603 HydrophobicContact CB-CD 4.23Å; I599-K603 WeakPolarHBondContact O-CB 3.48Å; I599-K603 PolarHBondContact O-N 2.97Å; L600-K603 PolarHBondContact O-N 3.43Å; S601-K603 PolarHBondContact O-N 3.25Å; K603-N605 PolarHBondContact O-N 3.39Å; K603-Y606 PolarHBondContact O-N 3.13Å; K603-W615 HydrophobicContact CB-CD2 3.76Å; K603-W615 HydrophobicContact CB-CE3 3.87Å; K603-W615 HydrophobicContact CB-CG 4.21Å; K603-W615 HydrophobicContact CB-CH2 4.45Å; K603-W615 HydrophobicContact CB-CZ2 4.38Å; K603-W615 HydrophobicContact CB-CZ3 4.21Å; K603-W615 HydrophobicContact CD-CD2 4.44Å; K603-W615 HydrophobicContact CD-CG 4.36Å; K603-W615 HydrophobicContact CG-CB 4.24Å; K603-W615 HydrophobicContact CG-CD2 3.74Å; K603-W615 HydrophobicContact CG-CE3 4.34Å; K603-W615 HydrophobicContact CG-CG 3.66Å
604	K	95.2	Very high	95.8	Very high	93 Å²	93	36 Å²	36	40%	0.404	17%	0.17	S	C	.	.	H	α-helix	trans	-62.5	-31.6	-177.9	179.4	178.6	170.4	-173	0	112.4	H529 S531 L600 S601 V602 Y606	H529-K604 WeakPolarHBondContact O-CE 3.37Å; H529-K604 PolarHBondContact O-NZ 3.35Å; S531-K604 PolarHBondContact O-NZ 3Å; L600-K604 VanDerWaalsContact O-CB 3.25Å; L600-K604 WeakPolarHBondContact O-CB 3.18Å; L600-K604 PolarHBondContact O-N 2.66Å; S601-K604 PolarHBondContact O-N 3.45Å; V602-K604 VanDerWaalsContact C-N 3.33Å; V602-K604 PolarHBondContact O-N 3.26Å; K604-Y606 VanDerWaalsContact C-N 3.31Å
605	N	96.3	Very high	95.9	Very high	28 Å²	28	35.8 Å²	35.8	15%	0.15	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	1.1	179.4	-72.5	-85.6	0	0	0	113.6	A530 S601 V602 K603 L655 D656 I692	A530-N605 PolarHBondContact O-ND2 2.67Å; S601-N605 PolarHBondContact O-N 3.34Å; S601-N605 VanDerWaalsContact O-N 3.09Å; S601-N605 PolarHBondContact O-ND2 3.49Å; V602-N605 PolarHBondContact O-N 3.47Å; V602-N605 VanDerWaalsContact O-N 3.15Å; K603-N605 PolarHBondContact O-N 3.39Å; N605-L655 HydrophobicContact CB-CD2 3.81Å; N605-D656 PolarHBondContact O-N 2.88Å; N605-D656 VanDerWaalsContact O-N 3.1Å; N605-I692 HydrophobicContact CB-CD1 4.09Å
606	Y	97.7	Very high	96	Very high	9 Å²	9	38.3 Å²	38.3	4%	0.035	18%	0.177	C	C	.	.	S	Bend	trans	-83.2	136	161.9	-79.9	-84.8	0	0	0	111.2	V602 K603 K604 K608 W615 A618 L651 D654 L655	V602-Y606 HydrophobicContact CG1-CD2 4.45Å; V602-Y606 HydrophobicContact CG1-CE2 3.87Å; V602-Y606 VanDerWaalsContact O-CD2 3.27Å; V602-Y606 WeakPolarHBondContact O-CD2 3.43Å; V602-Y606 PolarHBondContact O-N 2.9Å; K603-Y606 PolarHBondContact O-N 3.13Å; K604-Y606 VanDerWaalsContact C-N 3.31Å; Y606-K608 PolarHBondContact O-N 3.19Å; Y606-W615 HydrophobicContact CD2-CB 4.3Å; Y606-W615 AromaticContact CD2-CE3 3.92Å; Y606-W615 HydrophobicContact CD2-CE3 3.92Å; Y606-W615 HydrophobicContact CE2-CE3 4.1Å; Y606-W615 HydrophobicContact CG-CB 4.16Å; Y606-A618 HydrophobicContact CE1-CB 3.76Å; Y606-A618 HydrophobicContact CE2-CB 3.84Å; Y606-A618 WeakPolarHBondContact OH-CB 3.37Å; Y606-L651 VanDerWaalsContact CE2-O 3.27Å; Y606-L651 WeakPolarHBondContact CE2-O 3.37Å; Y606-L651 PolarHBondContact OH-O 3.49Å; Y606-D654 HydrophobicContact CE1-CB 3.66Å; Y606-D654 WeakPolarHBondContact CE1-O 3.31Å; Y606-D654 PolarHBondContact OH-N 2.68Å; Y606-L655 HydrophobicContact CD2-CD2 3.88Å; Y606-L655 HydrophobicContact CE2-CD2 3.59Å; Y606-L655 HydrophobicContact CE2-CG 4.03Å
607	R	95.1	Very high	96.2	Very high	94 Å²	94	38.9 Å²	38.9	36%	0.355	18%	0.179	S	C	.	.			trans	-81	117.1	-175.7	-66.7	-169.3	179.9	-100.9	-2	111.6	N609 V610 D656 H657	R607-N609 VanDerWaalsContact C-N 3.25Å; R607-N609 WeakPolarHBondContact CB-OD1 3.35Å; R607-N609 PolarHBondContact O-N 2.98Å; R607-V610 HydrophobicContact CB-CG2 3.81Å; R607-V610 PolarHBondContact O-N 2.8Å; R607-D656 IonicContact CZ-OD1 2.8Å; R607-D656 IonicContact NE-OD1 2.74Å; R607-D656 PolarHBondContact NE-OD1 3.44Å; R607-D656 IonicContact NH2-OD1 3.35Å; R607-D656 PolarHBondContact NH2-OD1 3.31Å; R607-D656 IonicContact NH2-OD2 3.76Å; R607-H657 VanDerWaalsContact CD-O 3.3Å; R607-H657 WeakPolarHBondContact CD-O 3.22Å
608	K	91.4	Very high	96.4	Very high	182 Å²	182	37.5 Å²	37.5	79%	0.791	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-22.9	179.9	-67	-172.4	177.4	-175.2	0	114.4	Y606 V610	Y606-K608 PolarHBondContact O-N 3.19Å; K608-V610 VanDerWaalsContact C-N 3.28Å
609	N	91.1	Very high	96.4	Very high	134 Å²	134	37.5 Å²	37.5	72%	0.717	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.6	-179.7	66	-54.1	0	0	0	113.4	R607	R607-N609 VanDerWaalsContact C-N 3.25Å; R607-N609 WeakPolarHBondContact CB-OD1 3.35Å; R607-N609 PolarHBondContact O-N 2.98Å
610	V	95.4	Very high	96.5	Very high	7 Å²	7	38.5 Å²	38.5	4%	0.042	18%	0.18	C	C	.	.			trans	-92.1	126.4	175.9	178.8	0	0	0	0	108.9	R607 K608 H613 N614 H657 E785	R607-V610 HydrophobicContact CB-CG2 3.81Å; R607-V610 PolarHBondContact O-N 2.8Å; K608-V610 VanDerWaalsContact C-N 3.28Å; V610-H613 HydrophobicContact CG1-CB 4.01Å; V610-H613 WeakPolarHBondContact CG1-O 3.41Å; V610-N614 PolarHBondContact O-ND2 3.44Å; V610-H657 WeakPolarHBondContact CG2-O 3.26Å; V610-E785 WeakPolarHBondContact CG1-OE2 3.37Å
611	A	95.1	Very high	96.6	Very high	30 Å²	30	38.2 Å²	38.2	25%	0.248	18%	0.178	C	C	.	.	S	Bend	trans	-68	-43.5	-168.6	0	0	0	0	0	113.2	N614 E785	A611-N614 PolarHBondContact O-ND2 2.88Å; A611-N614 VanDerWaalsContact O-ND2 3.11Å; A611-E785 HydrophobicContact CB-CB 4.26Å
612	Y	97.1	Very high	96.7	Very high	27 Å²	27	38.2 Å²	38.2	11%	0.106	18%	0.178	C	C	.	.	S	Bend	trans	-111.2	-56	-178	178.5	-107.6	0	0	0	113	N614 H617 I778 L781 V782 E785	Y612-N614 PolarHBondContact O-N 2.91Å; Y612-H617 AromaticContact CE1-ND1 3.68Å; Y612-H617 AromaticContact CZ-CE1 3.96Å; Y612-H617 AromaticContact CZ-ND1 3.35Å; Y612-H617 VanDerWaalsContact CZ-ND1 3.35Å; Y612-H617 VanDerWaalsContact O-CB 3.26Å; Y612-H617 WeakPolarHBondContact O-CB 3.49Å; Y612-H617 PolarHBondContact OH-CE1 3.09Å; Y612-H617 PolarHBondContact OH-ND1 3.47Å; Y612-I778 HydrophobicContact CD2-CG2 4Å; Y612-I778 HydrophobicContact CE2-CG2 3.4Å; Y612-L781 HydrophobicContact CD2-CB 4.46Å; Y612-V782 HydrophobicContact CD1-CG2 3.72Å; Y612-V782 HydrophobicContact CD2-CG2 3.52Å; Y612-V782 HydrophobicContact CE1-CG2 3.93Å; Y612-V782 HydrophobicContact CE2-CG2 3.75Å; Y612-V782 HydrophobicContact CG-CG2 3.5Å; Y612-V782 VanDerWaalsContact CG-CG2 3.5Å; Y612-E785 WeakPolarHBondContact CA-OE2 3.39Å; Y612-E785 WeakPolarHBondContact CB-OE2 3.19Å; Y612-E785 PolarHBondContact N-OE2 3.41Å
613	H	97.9	Very high	96.8	Very high	36 Å²	36	38.2 Å²	38.2	17%	0.167	18%	0.178	C	C	.	.	S	Bend	trans	-76.4	68	-176.8	-55.7	95.4	0	0	0	111.8	V610 D654 H657 E785	V610-H613 HydrophobicContact CG1-CB 4.01Å; V610-H613 WeakPolarHBondContact CG1-O 3.41Å; H613-D654 IonicContact CD2-OD2 2.84Å; H613-D654 PolarHBondContact CD2-OD2 3.04Å; H613-D654 VanDerWaalsContact CD2-OD2 3.26Å; H613-D654 IonicContact CG-OD2 3.17Å; H613-H657 HydrophobicContact CB-CB 3.97Å; H613-H657 WeakPolarHBondContact CB-ND1 3.37Å; H613-H657 AromaticContact CG-CE1 3.77Å; H613-H657 AromaticContact CG-ND1 3.73Å; H613-H657 AromaticContact ND1-CE1 3.58Å; H613-H657 AromaticContact ND1-ND1 3.87Å; H613-E785 IonicContact CE1-OE1 3.9Å; H613-E785 PolarHBondContact CE1-OE1 3.08Å; H613-E785 IonicContact CG-OE1 2.75Å; H613-E785 PolarHBondContact N-OE2 3.4Å; H613-E785 VanDerWaalsContact N-OE2 3.13Å; H613-E785 VanDerWaalsContact ND1-CD 3.35Å; H613-E785 IonicContact ND1-OE1 2.63Å; H613-E785 PolarHBondContact ND1-OE1 3.46Å; H613-E785 IonicContact ND1-OE2 3.75Å; H613-E785 PolarHBondContact ND1-OE2 2.91Å
614	N	97.4	Very high	96.9	Very high	30 Å²	30	36.7 Å²	36.7	16%	0.16	17%	0.172	C	C	.	.	S	Bend	trans	-126.1	-175.9	178.1	61.9	50.9	0	0	0	110.5	V610 A611 Y612 R616 H617 A618	V610-N614 PolarHBondContact O-ND2 3.44Å; A611-N614 PolarHBondContact O-ND2 2.88Å; A611-N614 VanDerWaalsContact O-ND2 3.11Å; Y612-N614 PolarHBondContact O-N 2.91Å; N614-R616 PolarHBondContact O-N 3.32Å; N614-R616 VanDerWaalsContact O-N 3.08Å; N614-R616 WeakPolarHBondContact OD1-CB 3.12Å; N614-R616 PolarHBondContact OD1-N 3.1Å; N614-H617 WeakPolarHBondContact O-CB 3.39Å; N614-H617 PolarHBondContact O-N 3.37Å; N614-A618 PolarHBondContact O-N 3.3Å
615	W	98.1	Very high	97	Very high	12 Å²	12	32.3 Å²	32.3	5%	0.045	15%	0.152	C	C	.	.	H	α-helix	trans	-52.4	-35.3	-177.6	167.1	-113.7	0	0	0	113.6	T571 I599 V602 K603 Y606 H617 A618 F619 L651	T571-W615 PolarHBondContact OG1-NE1 2.63Å; I599-W615 HydrophobicContact CG2-CH2 4.2Å; V602-W615 HydrophobicContact CG1-CZ3 3.96Å; K603-W615 HydrophobicContact CB-CD2 3.76Å; K603-W615 HydrophobicContact CB-CE3 3.87Å; K603-W615 HydrophobicContact CB-CG 4.21Å; K603-W615 HydrophobicContact CB-CH2 4.45Å; K603-W615 HydrophobicContact CB-CZ2 4.38Å; K603-W615 HydrophobicContact CB-CZ3 4.21Å; K603-W615 HydrophobicContact CD-CD2 4.44Å; K603-W615 HydrophobicContact CD-CG 4.36Å; K603-W615 HydrophobicContact CG-CB 4.24Å; K603-W615 HydrophobicContact CG-CD2 3.74Å; K603-W615 HydrophobicContact CG-CE3 4.34Å; K603-W615 HydrophobicContact CG-CG 3.66Å; Y606-W615 HydrophobicContact CD2-CB 4.3Å; Y606-W615 AromaticContact CD2-CE3 3.92Å; Y606-W615 HydrophobicContact CD2-CE3 3.92Å; Y606-W615 HydrophobicContact CE2-CE3 4.1Å; Y606-W615 HydrophobicContact CG-CB 4.16Å; W615-H617 PolarHBondContact O-N 3.03Å; W615-A618 PolarHBondContact O-N 3.5Å; W615-F619 HydrophobicContact CZ2-CB 4.26Å; W615-F619 HydrophobicContact CZ2-CD2 4.42Å; W615-F619 VanDerWaalsContact O-CB 3.31Å; W615-F619 WeakPolarHBondContact O-CB 3.39Å; W615-F619 PolarHBondContact O-N 2.99Å; W615-L651 HydrophobicContact CH2-CD2 3.93Å; W615-L651 HydrophobicContact CZ3-CD2 4.04Å
616	R	97.9	Very high	97.2	Very high	54 Å²	54	31 Å²	31	20%	0.204	15%	0.146	C	C	.	.	H	α-helix	trans	-67.8	-36.7	-178.6	-60.6	-47.2	-167.3	108	-4.4	112.1	D563 L566 S567 D568 N614 N620	D563-R616 PolarHBondContact O-NH1 3.02Å; D563-R616 WeakPolarHBondContact OD2-CB 3.46Å; D563-R616 VanDerWaalsContact OD2-CD 3.26Å; D563-R616 WeakPolarHBondContact OD2-CD 3.44Å; D563-R616 WeakPolarHBondContact OD2-CG 3.43Å; D563-R616 IonicContact OD2-CZ 2.93Å; D563-R616 IonicContact OD2-NE 3.36Å; D563-R616 IonicContact OD2-NH1 3.92Å; D563-R616 PolarHBondContact OD2-NH1 2.98Å; L566-R616 VanDerWaalsContact O-CZ 3.3Å; L566-R616 PolarHBondContact O-NH1 3.48Å; L566-R616 PolarHBondContact O-NH2 3.27Å; S567-R616 VanDerWaalsContact C-NH2 3.33Å; D568-R616 IonicContact OD1-CZ 3.32Å; D568-R616 VanDerWaalsContact OD1-CZ 3.27Å; D568-R616 IonicContact OD1-NE 2.91Å; D568-R616 PolarHBondContact OD1-NE 3.4Å; D568-R616 IonicContact OD1-NH2 2.72Å; D568-R616 PolarHBondContact OD1-NH2 3.08Å; N614-R616 PolarHBondContact O-N 3.32Å; N614-R616 VanDerWaalsContact O-N 3.08Å; N614-R616 WeakPolarHBondContact OD1-CB 3.12Å; N614-R616 PolarHBondContact OD1-N 3.1Å; R616-N620 WeakPolarHBondContact O-CB 3.37Å; R616-N620 PolarHBondContact O-N 3.46Å; R616-N620 PolarHBondContact O-ND2 2.87Å
617	H	98.3	Very high	97.2	Very high	11 Å²	11	30.6 Å²	30.6	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-53.2	173.2	168.9	65.6	0	0	0	110.6	Y612 N614 W615 F619 N620 T621 H653 D654 D764	Y612-H617 AromaticContact CE1-ND1 3.68Å; Y612-H617 AromaticContact CZ-CE1 3.96Å; Y612-H617 AromaticContact CZ-ND1 3.35Å; Y612-H617 VanDerWaalsContact CZ-ND1 3.35Å; Y612-H617 VanDerWaalsContact O-CB 3.26Å; Y612-H617 WeakPolarHBondContact O-CB 3.49Å; Y612-H617 PolarHBondContact OH-CE1 3.09Å; Y612-H617 PolarHBondContact OH-ND1 3.47Å; N614-H617 WeakPolarHBondContact O-CB 3.39Å; N614-H617 PolarHBondContact O-N 3.37Å; W615-H617 PolarHBondContact O-N 3.03Å; H617-F619 VanDerWaalsContact C-N 3.33Å; H617-F619 PolarHBondContact O-N 3.43Å; H617-N620 PolarHBondContact O-N 3.35Å; H617-N620 VanDerWaalsContact O-N 3.08Å; H617-T621 PolarHBondContact CE1-OG1 3.31Å; H617-T621 PolarHBondContact O-N 3.25Å; H617-T621 PolarHBondContact O-OG1 3.41Å; H617-H653 AromaticContact CD2-CE1 3.79Å; H617-H653 AromaticContact CD2-NE2 3.81Å; H617-H653 AromaticContact NE2-CE1 3.37Å; H617-H653 PolarHBondContact NE2-CE1 3.1Å; H617-H653 AromaticContact NE2-NE2 3.13Å; H617-H653 PolarHBondContact NE2-NE2 2.87Å; H617-H653 VanDerWaalsContact NE2-NE2 3.13Å; H617-D654 IonicContact CD2-OD2 2.79Å; H617-D654 PolarHBondContact CD2-OD2 2.88Å; H617-D654 IonicContact NE2-OD2 3.58Å; H617-D654 PolarHBondContact NE2-OD2 3.22Å; H617-D764 IonicContact CE1-OD1 3.53Å; H617-D764 PolarHBondContact CE1-OD1 2.75Å; H617-D764 VanDerWaalsContact CE1-OD1 3.23Å; H617-D764 IonicContact NE2-OD1 2.73Å; H617-D764 PolarHBondContact NE2-OD1 3.19Å
618	A	98.5	Very high	97.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.1	-40.9	179.1	0	0	0	0	0	113.5	Y606 N614 W615 T621 A622	Y606-A618 HydrophobicContact CE1-CB 3.76Å; Y606-A618 HydrophobicContact CE2-CB 3.84Å; Y606-A618 WeakPolarHBondContact OH-CB 3.37Å; N614-A618 PolarHBondContact O-N 3.3Å; W615-A618 PolarHBondContact O-N 3.5Å; A618-T621 PolarHBondContact O-N 3.29Å; A618-A622 WeakPolarHBondContact O-CB 3.27Å; A618-A622 PolarHBondContact O-N 3.26Å
619	F	98.7	Very high	97.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.5	-44.6	174.1	170.7	-107.1	0	0	0	112.2	F561 D563 T571 C574 M578 W615 H617 A622 Q623	F561-F619 AromaticContact CE1-CE1 3.64Å; F561-F619 HydrophobicContact CE1-CE1 3.64Å; F561-F619 HydrophobicContact CE1-CZ 4.2Å; F561-F619 AromaticContact CZ-CE1 3.74Å; F561-F619 HydrophobicContact CZ-CE1 3.74Å; F561-F619 HydrophobicContact CZ-CZ 4.01Å; D563-F619 HydrophobicContact CB-CD1 4.14Å; D563-F619 HydrophobicContact CB-CE1 3.99Å; T571-F619 HydrophobicContact CG2-CD1 3.75Å; T571-F619 HydrophobicContact CG2-CE1 3.69Å; T571-F619 HydrophobicContact CG2-CG 4.22Å; T571-F619 HydrophobicContact CG2-CZ 4.14Å; T571-F619 VanDerWaalsContact O-CE2 3.26Å; T571-F619 WeakPolarHBondContact O-CE2 3.49Å; C574-F619 HydrophobicContact CB-CE2 3.55Å; C574-F619 HydrophobicContact CB-CZ 3.52Å; M578-F619 HydrophobicContact CE-CD2 4.38Å; M578-F619 HydrophobicContact CE-CE2 3.58Å; M578-F619 HydrophobicContact CE-CZ 4Å; W615-F619 HydrophobicContact CZ2-CB 4.26Å; W615-F619 HydrophobicContact CZ2-CD2 4.42Å; W615-F619 VanDerWaalsContact O-CB 3.31Å; W615-F619 WeakPolarHBondContact O-CB 3.39Å; W615-F619 PolarHBondContact O-N 2.99Å; H617-F619 VanDerWaalsContact C-N 3.33Å; H617-F619 PolarHBondContact O-N 3.43Å; F619-A622 PolarHBondContact O-N 3.07Å; F619-Q623 WeakPolarHBondContact O-CB 3.4Å; F619-Q623 PolarHBondContact O-N 3.42Å
620	N	98.6	Very high	97.9	Very high	22 Å²	22	14 Å²	14	12%	0.118	7%	0.068	C	C	.	.	H	α-helix	trans	-66.9	-36.7	176.8	-83.6	-72.3	0	0	0	112.2	D563 R616 H617 Q623 C624	D563-N620 PolarHBondContact OD1-ND2 3.38Å; R616-N620 WeakPolarHBondContact O-CB 3.37Å; R616-N620 PolarHBondContact O-N 3.46Å; R616-N620 PolarHBondContact O-ND2 2.87Å; H617-N620 PolarHBondContact O-N 3.35Å; H617-N620 VanDerWaalsContact O-N 3.08Å; N620-Q623 PolarHBondContact O-N 3.07Å; N620-C624 WeakPolarHBondContact O-CB 3.29Å; N620-C624 PolarHBondContact O-N 2.91Å
621	T	98.8	Very high	98	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-61	-45.3	173.1	-61.4	0	0	0	0	110.6	H617 A618 C624 M625 A650 C763 D764	H617-T621 PolarHBondContact CE1-OG1 3.31Å; H617-T621 PolarHBondContact O-N 3.25Å; H617-T621 PolarHBondContact O-OG1 3.41Å; A618-T621 PolarHBondContact O-N 3.29Å; T621-C624 PolarHBondContact O-N 3.45Å; T621-M625 PolarHBondContact O-N 2.94Å; T621-A650 HydrophobicContact CG2-CB 4.1Å; T621-C763 HydrophobicContact CG2-CB 4.03Å; T621-D764 HydrophobicContact CG2-CB 4.4Å
622	A	98.8	Very high	98.1	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.8	-38.6	174.4	0	0	0	0	0	113.1	A618 F619 M625 F626 L647 A650 L651	A618-A622 WeakPolarHBondContact O-CB 3.27Å; A618-A622 PolarHBondContact O-N 3.26Å; F619-A622 PolarHBondContact O-N 3.07Å; A622-M625 WeakPolarHBondContact O-CB 3.27Å; A622-M625 PolarHBondContact O-N 3.1Å; A622-F626 WeakPolarHBondContact O-CB 3.24Å; A622-F626 PolarHBondContact O-N 2.98Å; A622-L647 HydrophobicContact CB-CD1 4.2Å; A622-A650 HydrophobicContact CB-CB 4.01Å; A622-L651 HydrophobicContact CB-CD2 3.46Å; A622-L651 VanDerWaalsContact CB-CD2 3.46Å; A622-L651 HydrophobicContact CB-CG 3.61Å
623	Q	98.6	Very high	98.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-42.6	174.6	-174.3	-85.9	-41.2	0	0	111.5	I556 D558 F561 M578 F619 N620 M625 F626 A627	I556-Q623 HydrophobicContact CB-CG 4.34Å; I556-Q623 HydrophobicContact CG2-CG 4.5Å; I556-Q623 PolarHBondContact O-NE2 3.4Å; D558-Q623 PolarHBondContact O-NE2 3.35Å; F561-Q623 HydrophobicContact CD1-CB 4.46Å; F561-Q623 HydrophobicContact CD1-CG 3.66Å; F561-Q623 HydrophobicContact CE1-CG 4.01Å; F561-Q623 HydrophobicContact CG-CG 4.05Å; M578-Q623 HydrophobicContact CE-CB 3.62Å; M578-Q623 HydrophobicContact CE-CG 3.89Å; F619-Q623 WeakPolarHBondContact O-CB 3.4Å; F619-Q623 PolarHBondContact O-N 3.42Å; N620-Q623 PolarHBondContact O-N 3.07Å; Q623-M625 VanDerWaalsContact C-N 3.34Å; Q623-F626 PolarHBondContact O-N 3.09Å; Q623-A627 WeakPolarHBondContact O-CB 3.25Å; Q623-A627 PolarHBondContact O-N 3.22Å
624	C	98.7	Very high	98	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-64.3	-41.1	175.6	-173	0	0	0	0	111.2	N620 T621 A627 A628 C763 S766	N620-C624 WeakPolarHBondContact O-CB 3.29Å; N620-C624 PolarHBondContact O-N 2.91Å; T621-C624 PolarHBondContact O-N 3.45Å; C624-A627 PolarHBondContact O-N 2.77Å; C624-A628 VanDerWaalsContact O-CB 3.3Å; C624-A628 WeakPolarHBondContact O-CB 3.14Å; C624-A628 PolarHBondContact O-N 3.08Å; C624-C763 HydrophobicContact CB-CB 4.26Å; C624-S766 WeakPolarHBondContact CB-OG 3.4Å; C624-S766 WeakPolarHBondContact SG-CB 3.38Å
625	M	98.8	Very high	98	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.7	-48	173.2	-176.6	62.3	72.7	0	0	111	T621 A622 Q623 A627 A628 L629 L646 A650 L759 M760 C763	T621-M625 PolarHBondContact O-N 2.94Å; A622-M625 WeakPolarHBondContact O-CB 3.27Å; A622-M625 PolarHBondContact O-N 3.1Å; Q623-M625 VanDerWaalsContact C-N 3.34Å; M625-A627 PolarHBondContact O-N 3.49Å; M625-A628 PolarHBondContact O-N 2.95Å; M625-L629 HydrophobicContact CG-CD1 4.12Å; M625-L629 WeakPolarHBondContact O-CB 3.47Å; M625-L629 VanDerWaalsContact O-CG 3.24Å; M625-L629 WeakPolarHBondContact O-CG 3.5Å; M625-L629 PolarHBondContact O-N 3.03Å; M625-L629 HydrophobicContact SD-CD1 4.5Å; M625-L646 HydrophobicContact CE-CB 4.15Å; M625-L646 HydrophobicContact CE-CD1 4.37Å; M625-L646 HydrophobicContact CE-CD2 3.96Å; M625-L646 HydrophobicContact CE-CG 4.4Å; M625-L646 HydrophobicContact CG-CB 4.3Å; M625-L646 HydrophobicContact SD-CB 4.1Å; M625-L646 HydrophobicContact SD-CD1 3.96Å; M625-L646 HydrophobicContact SD-CG 4.48Å; M625-A650 HydrophobicContact CB-CB 4.4Å; M625-L759 HydrophobicContact CE-CD2 4.34Å; M625-L759 HydrophobicContact CE-CG 3.98Å; M625-L759 HydrophobicContact SD-CD2 3.77Å; M625-L759 HydrophobicContact SD-CG 3.9Å; M625-M760 HydrophobicContact CE-CG 4.22Å; M625-M760 HydrophobicContact CE-SD 3.46Å; M625-M760 WeakPolarHBondContact CE-SD 3.4Å; M625-C763 VanDerWaalsContact CA-SG 3.58Å; M625-C763 HydrophobicContact CE-CB 4.28Å
626	F	98.7	Very high	97.8	Very high	1 Å²	1	22.6 Å²	22.6	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-45.1	176.5	176.6	-96.6	0	0	0	112.4	I556 T557 M578 D581 L582 A622 Q623 L629 K630	I556-F626 HydrophobicContact CD1-CD1 4.38Å; I556-F626 HydrophobicContact CD1-CE1 3.86Å; I556-F626 HydrophobicContact CD1-CZ 4.27Å; I556-F626 HydrophobicContact CG1-CD1 4.42Å; I556-F626 HydrophobicContact CG1-CE1 3.92Å; I556-F626 WeakPolarHBondContact O-CD1 3.4Å; T557-F626 HydrophobicContact CG2-CE1 3.99Å; M578-F626 HydrophobicContact CB-CB 4.43Å; M578-F626 HydrophobicContact CB-CD2 3.7Å; M578-F626 HydrophobicContact CB-CE2 4.13Å; M578-F626 HydrophobicContact CB-CG 4.09Å; M578-F626 HydrophobicContact CG-CB 3.99Å; M578-F626 HydrophobicContact CG-CD1 4.12Å; M578-F626 HydrophobicContact CG-CD2 3.84Å; M578-F626 HydrophobicContact CG-CE2 4.34Å; M578-F626 HydrophobicContact CG-CG 3.71Å; M578-F626 WeakPolarHBondContact O-CE2 3.32Å; M578-F626 HydrophobicContact SD-CB 4.17Å; D581-F626 HydrophobicContact CB-CE2 4.02Å; D581-F626 HydrophobicContact CB-CZ 3.93Å; L582-F626 HydrophobicContact CD1-CD2 3.72Å; L582-F626 HydrophobicContact CD1-CE2 4.28Å; L582-F626 HydrophobicContact CD2-CD2 4.43Å; L582-F626 HydrophobicContact CG-CD2 3.79Å; L582-F626 HydrophobicContact CG-CE2 3.85Å; A622-F626 WeakPolarHBondContact O-CB 3.24Å; A622-F626 PolarHBondContact O-N 2.98Å; Q623-F626 PolarHBondContact O-N 3.09Å; F626-L629 PolarHBondContact O-N 3.26Å; F626-K630 HydrophobicContact CD2-CG 4.36Å; F626-K630 HydrophobicContact CE1-CG 4.13Å; F626-K630 HydrophobicContact CE2-CG 3.94Å; F626-K630 HydrophobicContact CZ-CG 3.82Å; F626-K630 WeakPolarHBondContact O-CB 3.48Å; F626-K630 PolarHBondContact O-N 3.19Å
627	A	98.4	Very high	97.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.4	-40.3	176.6	0	0	0	0	0	112.1	F559 Q623 C624 M625 L629 K630 A631 G632	F559-A627 HydrophobicContact CD1-CB 3.86Å; F559-A627 HydrophobicContact CE1-CB 3.77Å; F559-A627 HydrophobicContact CZ-CB 4.4Å; Q623-A627 WeakPolarHBondContact O-CB 3.25Å; Q623-A627 PolarHBondContact O-N 3.22Å; C624-A627 PolarHBondContact O-N 2.77Å; M625-A627 PolarHBondContact O-N 3.49Å; A627-L629 VanDerWaalsContact C-N 3.34Å; A627-L629 PolarHBondContact O-N 3.18Å; A627-K630 CarbonylContact O-C 3.55Å; A627-K630 PolarHBondContact O-N 3.35Å; A627-A631 WeakPolarHBondContact O-CA 3.48Å; A627-A631 WeakPolarHBondContact O-CB 3.37Å; A627-A631 PolarHBondContact O-N 3.15Å; A627-G632 PolarHBondContact O-N 3.09Å
628	A	98.3	Very high	97.5	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-38.3	175.8	0	0	0	0	0	112.1	F559 C624 M625 G632 K633 I634 L759	F559-A628 HydrophobicContact CE1-CB 4.25Å; F559-A628 HydrophobicContact CZ-CB 4.47Å; C624-A628 VanDerWaalsContact O-CB 3.3Å; C624-A628 WeakPolarHBondContact O-CB 3.14Å; C624-A628 PolarHBondContact O-N 3.08Å; M625-A628 PolarHBondContact O-N 2.95Å; A628-G632 CarbonylContact O-C 3.5Å; A628-G632 WeakPolarHBondContact O-CA 3.48Å; A628-G632 PolarHBondContact O-N 2.85Å; A628-K633 PolarHBondContact O-N 3.32Å; A628-I634 HydrophobicContact CB-CD1 4.13Å; A628-I634 WeakPolarHBondContact O-CB 3.48Å; A628-I634 WeakPolarHBondContact O-CG1 3.38Å; A628-I634 PolarHBondContact O-N 3.2Å; A628-L759 HydrophobicContact CB-CD1 4.32Å
629	L	98.2	Very high	97.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-46	174.2	-69.8	168.9	0	0	0	112	L582 M625 F626 A627 I634 Q635 L638 I643	L582-L629 HydrophobicContact CD1-CD1 4.05Å; L582-L629 HydrophobicContact CD2-CB 4.23Å; L582-L629 HydrophobicContact CD2-CD1 4.23Å; M625-L629 HydrophobicContact CG-CD1 4.12Å; M625-L629 WeakPolarHBondContact O-CB 3.47Å; M625-L629 VanDerWaalsContact O-CG 3.24Å; M625-L629 WeakPolarHBondContact O-CG 3.5Å; M625-L629 PolarHBondContact O-N 3.03Å; M625-L629 HydrophobicContact SD-CD1 4.5Å; F626-L629 PolarHBondContact O-N 3.26Å; A627-L629 VanDerWaalsContact C-N 3.34Å; A627-L629 PolarHBondContact O-N 3.18Å; L629-I634 HydrophobicContact CD2-CB 4.32Å; L629-I634 HydrophobicContact CD2-CG2 4.14Å; L629-I634 PolarHBondContact O-N 2.75Å; L629-Q635 HydrophobicContact CB-CB 4.31Å; L629-Q635 WeakPolarHBondContact O-CB 3.48Å; L629-Q635 PolarHBondContact O-N 2.81Å; L629-L638 HydrophobicContact CD2-CD1 3.98Å; L629-I643 HydrophobicContact CD1-CG2 3.88Å; L629-I643 HydrophobicContact CD2-CG1 4.08Å
630	K	96.9	Very high	97.4	Very high	61 Å²	61	30.5 Å²	30.5	27%	0.265	16%	0.159	S	C	.	.	H	α-helix	trans	-82.6	-74.6	-177.5	-69.1	-61.5	-170.2	-172.7	0	113.2	D581 L582 F626 A627 G632 K633	D581-K630 WeakPolarHBondContact O-CE 3.38Å; D581-K630 PolarHBondContact O-NZ 2.91Å; L582-K630 HydrophobicContact CD2-CD 4.36Å; F626-K630 HydrophobicContact CD2-CG 4.36Å; F626-K630 HydrophobicContact CE1-CG 4.13Å; F626-K630 HydrophobicContact CE2-CG 3.94Å; F626-K630 HydrophobicContact CZ-CG 3.82Å; F626-K630 WeakPolarHBondContact O-CB 3.48Å; F626-K630 PolarHBondContact O-N 3.19Å; A627-K630 CarbonylContact O-C 3.55Å; A627-K630 PolarHBondContact O-N 3.35Å; K630-G632 VanDerWaalsContact C-N 3.34Å; K630-G632 PolarHBondContact O-N 3.34Å; K630-K633 PolarHBondContact O-N 3.46Å
631	A	96.8	Very high	97.4	Very high	43 Å²	43	31.1 Å²	31.1	36%	0.355	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-39	-177.8	0	0	0	0	0	111.4	T557 F559 A627 K633 D838	T557-A631 WeakPolarHBondContact O-CB 3.39Å; F559-A631 HydrophobicContact CE2-CB 4.27Å; A627-A631 WeakPolarHBondContact O-CA 3.48Å; A627-A631 WeakPolarHBondContact O-CB 3.37Å; A627-A631 PolarHBondContact O-N 3.15Å; A631-K633 PolarHBondContact O-N 2.71Å; A631-D838 WeakPolarHBondContact O-CB 3.27Å
632	G	96.7	Very high	97.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	0.5	176.5	0	0	0	0	0	115.2	A627 A628 K630 I634 S836	A627-G632 PolarHBondContact O-N 3.09Å; A628-G632 CarbonylContact O-C 3.5Å; A628-G632 WeakPolarHBondContact O-CA 3.48Å; A628-G632 PolarHBondContact O-N 2.85Å; K630-G632 VanDerWaalsContact C-N 3.34Å; K630-G632 PolarHBondContact O-N 3.34Å; G632-I634 PolarHBondContact O-N 2.83Å; G632-S836 WeakPolarHBondContact O-CB 3.39Å; G632-S836 PolarHBondContact O-OG 2.94Å
633	K	96.9	Very high	97.3	Very high	103 Å²	103	32.2 Å²	32.2	45%	0.448	17%	0.167	S	C	.	.			trans	51.9	24.7	179.7	-53.2	-166.5	-168.2	115.6	0	115.5	A628 K630 A631 Q635 D838	A628-K633 PolarHBondContact O-N 3.32Å; K630-K633 PolarHBondContact O-N 3.46Å; A631-K633 PolarHBondContact O-N 2.71Å; K633-Q635 VanDerWaalsContact C-N 3.3Å; K633-D838 WeakPolarHBondContact CD-OD2 3.46Å; K633-D838 WeakPolarHBondContact CE-OD2 3Å; K633-D838 HydrophobicContact CG-CB 4.45Å; K633-D838 WeakPolarHBondContact CG-OD2 3.47Å; K633-D838 IonicContact NZ-OD1 2.8Å; K633-D838 PolarHBondContact NZ-OD1 2.99Å; K633-D838 IonicContact NZ-OD2 2.89Å; K633-D838 PolarHBondContact NZ-OD2 3.14Å
634	I	97	Very high	97.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.			trans	-74.9	-23.9	176.7	-62	174.4	0	0	0	111.1	A628 L629 G632 N636 K637 L638 F755 L759 L832	A628-I634 HydrophobicContact CB-CD1 4.13Å; A628-I634 WeakPolarHBondContact O-CB 3.48Å; A628-I634 WeakPolarHBondContact O-CG1 3.38Å; A628-I634 PolarHBondContact O-N 3.2Å; L629-I634 HydrophobicContact CD2-CB 4.32Å; L629-I634 HydrophobicContact CD2-CG2 4.14Å; L629-I634 PolarHBondContact O-N 2.75Å; G632-I634 PolarHBondContact O-N 2.83Å; I634-N636 PolarHBondContact O-N 3.18Å; I634-N636 VanDerWaalsContact O-N 3.1Å; I634-K637 WeakPolarHBondContact O-CB 3.27Å; I634-K637 PolarHBondContact O-N 3.11Å; I634-L638 HydrophobicContact CG2-CD1 3.95Å; I634-L638 HydrophobicContact CG2-CG 4.21Å; I634-F755 HydrophobicContact CD1-CZ 4.23Å; I634-F755 HydrophobicContact CG2-CE1 3.9Å; I634-F755 HydrophobicContact CG2-CZ 3.91Å; I634-L759 HydrophobicContact CD1-CD1 3.81Å; I634-L759 HydrophobicContact CD1-CD2 4.42Å; I634-L759 HydrophobicContact CG2-CD2 4.16Å; I634-L832 HydrophobicContact CD1-CD1 4.11Å
635	Q	96	Very high	97.3	Very high	39 Å²	39	32.2 Å²	32.2	18%	0.182	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-51	-38.5	178	177	168.9	17.8	0	0	112.4	L629 K633 K637 L638 I643	L629-Q635 HydrophobicContact CB-CB 4.31Å; L629-Q635 WeakPolarHBondContact O-CB 3.48Å; L629-Q635 PolarHBondContact O-N 2.81Å; K633-Q635 VanDerWaalsContact C-N 3.3Å; Q635-K637 PolarHBondContact O-N 3Å; Q635-K637 VanDerWaalsContact O-N 3.13Å; Q635-L638 PolarHBondContact O-N 2.77Å; Q635-I643 HydrophobicContact CB-CD1 4.48Å; Q635-I643 HydrophobicContact CG-CD1 3.84Å
636	N	94.1	Very high	97.3	Very high	137 Å²	137	32.2 Å²	32.2	73%	0.733	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	-69.2	-10.6	-178.2	-60.4	-12.4	0	0	0	114	I634	I634-N636 PolarHBondContact O-N 3.18Å; I634-N636 VanDerWaalsContact O-N 3.1Å
637	K	94.5	Very high	97.3	Very high	84 Å²	84	32.1 Å²	32.1	37%	0.365	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-104.3	-8.8	-175.2	-53.5	174.2	-173.6	-93.7	0	112.7	I634 Q635 L746 V835	I634-K637 WeakPolarHBondContact O-CB 3.27Å; I634-K637 PolarHBondContact O-N 3.11Å; Q635-K637 PolarHBondContact O-N 3Å; Q635-K637 VanDerWaalsContact O-N 3.13Å; K637-L746 HydrophobicContact CB-CD1 3.67Å; K637-L746 HydrophobicContact CD-CD1 3.85Å; K637-L746 HydrophobicContact CG-CD1 4.2Å; K637-V835 HydrophobicContact CD-CG1 4.45Å; K637-V835 PolarHBondContact NZ-O 3.37Å
638	L	96.8	Very high	97.3	Very high	16 Å²	16	32.1 Å²	32.1	8%	0.084	17%	0.166	C	C	.	.	S	Bend	trans	-122.9	157.5	-174.5	-59.1	-177.5	0	0	0	110.5	L629 I634 Q635 E642 I643 L646 F755 L756	L629-L638 HydrophobicContact CD2-CD1 3.98Å; I634-L638 HydrophobicContact CG2-CD1 3.95Å; I634-L638 HydrophobicContact CG2-CG 4.21Å; Q635-L638 PolarHBondContact O-N 2.77Å; L638-E642 HydrophobicContact CB-CB 4.4Å; L638-I643 HydrophobicContact CB-CD1 4.27Å; L638-I643 HydrophobicContact CB-CG1 3.93Å; L638-I643 HydrophobicContact CD1-CG1 4.46Å; L638-L646 HydrophobicContact CD1-CD1 3.72Å; L638-F755 HydrophobicContact CD2-CD1 4.38Å; L638-F755 HydrophobicContact CD2-CE1 4.28Å; L638-L756 HydrophobicContact CD1-CD2 3.95Å; L638-L756 HydrophobicContact CD2-CD2 3.87Å
639	T	97.1	Very high	97.4	Very high	67 Å²	67	32.1 Å²	32.1	41%	0.411	17%	0.166	S	C	.	.			trans	-83.1	158.3	172.6	63.8	0	0	0	0	111.2	L641 E642 I643	T639-L641 PolarHBondContact O-N 3.31Å; T639-E642 PolarHBondContact N-OE2 3.35Å; T639-E642 PolarHBondContact O-N 3.08Å; T639-E642 VanDerWaalsContact O-N 3.12Å; T639-E642 VanDerWaalsContact OG1-CG 3.24Å; T639-E642 WeakPolarHBondContact OG1-CG 3.39Å; T639-E642 PolarHBondContact OG1-N 3.04Å; T639-E642 PolarHBondContact OG1-OE2 3.46Å; T639-I643 WeakPolarHBondContact O-CG1 3.47Å; T639-I643 PolarHBondContact O-N 3.37Å
640	D	97.5	Very high	97.4	Very high	64 Å²	64	32.1 Å²	32.1	34%	0.342	17%	0.166	S	C	.	.	H	α-helix	trans	-59.5	-32.6	178.4	-67.6	-22.4	0	0	0	112.9	N587 F588 L644	N587-D640 PolarHBondContact ND2-OD2 2.61Å; F588-D640 HydrophobicContact CE2-CB 4.07Å; F588-D640 HydrophobicContact CZ-CB 3.87Å; D640-L644 VanDerWaalsContact O-CB 3.26Å; D640-L644 WeakPolarHBondContact O-CB 3.43Å; D640-L644 PolarHBondContact O-N 2.95Å
641	L	97.4	Very high	97.5	Very high	36 Å²	36	29.2 Å²	29.2	19%	0.188	15%	0.154	C	C	.	.	H	α-helix	trans	-69	-40.5	175.8	-72.8	171.9	0	0	0	112.3	F588 T639 L644 A645 L704 E708	F588-L641 HydrophobicContact CD1-CD2 4.4Å; F588-L641 HydrophobicContact CE1-CD2 3.41Å; F588-L641 VanDerWaalsContact CE1-CD2 3.41Å; F588-L641 HydrophobicContact CE1-CG 4.11Å; F588-L641 HydrophobicContact CZ-CD2 3.6Å; F588-L641 HydrophobicContact CZ-CG 4Å; T639-L641 PolarHBondContact O-N 3.31Å; L641-L644 PolarHBondContact O-N 3.32Å; L641-A645 WeakPolarHBondContact O-CB 3.26Å; L641-A645 PolarHBondContact O-N 3.02Å; L641-L704 HydrophobicContact CD2-CD2 4Å; L641-E708 HydrophobicContact CD1-CB 4.33Å; L641-E708 HydrophobicContact CD1-CG 3.98Å; L641-E708 HydrophobicContact CD2-CB 4.19Å; L641-E708 HydrophobicContact CD2-CG 4.47Å
642	E	98.3	Very high	97.6	Very high	23 Å²	23	27.2 Å²	27.2	11%	0.107	14%	0.137	C	C	.	.	H	α-helix	trans	-66	-42	175.5	-71.3	158.1	168.4	0	0	110.4	L638 T639 A645 L646 I715 K752 L756	L638-E642 HydrophobicContact CB-CB 4.4Å; T639-E642 PolarHBondContact N-OE2 3.35Å; T639-E642 PolarHBondContact O-N 3.08Å; T639-E642 VanDerWaalsContact O-N 3.12Å; T639-E642 VanDerWaalsContact OG1-CG 3.24Å; T639-E642 WeakPolarHBondContact OG1-CG 3.39Å; T639-E642 PolarHBondContact OG1-N 3.04Å; T639-E642 PolarHBondContact OG1-OE2 3.46Å; E642-A645 PolarHBondContact O-N 3.31Å; E642-L646 WeakPolarHBondContact O-CB 3.42Å; E642-L646 VanDerWaalsContact O-CG 3.32Å; E642-L646 WeakPolarHBondContact O-CG 3.14Å; E642-L646 PolarHBondContact O-N 3.32Å; E642-I715 HydrophobicContact CG-CD1 3.9Å; E642-K752 WeakPolarHBondContact OE1-CD 3.47Å; E642-K752 WeakPolarHBondContact OE1-CE 3.4Å; E642-K752 IonicContact OE1-NZ 2.76Å; E642-K752 PolarHBondContact OE1-NZ 3.44Å; E642-K752 IonicContact OE2-NZ 3.77Å; E642-K752 PolarHBondContact OE2-NZ 3.06Å; E642-L756 HydrophobicContact CG-CD1 4.44Å
643	I	98.6	Very high	97.6	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-45.7	175.9	-68.7	167	0	0	0	111.2	L582 L584 L629 Q635 L638 T639 A645 L646 L647	L582-I643 HydrophobicContact CB-CG2 4.44Å; L582-I643 HydrophobicContact CD1-CG2 3.86Å; L582-I643 HydrophobicContact CD2-CG2 4.1Å; L582-I643 HydrophobicContact CG-CG2 4.36Å; L584-I643 HydrophobicContact CD1-CG2 4.47Å; L584-I643 HydrophobicContact CD2-CG2 4.15Å; L629-I643 HydrophobicContact CD1-CG2 3.88Å; L629-I643 HydrophobicContact CD2-CG1 4.08Å; Q635-I643 HydrophobicContact CB-CD1 4.48Å; Q635-I643 HydrophobicContact CG-CD1 3.84Å; L638-I643 HydrophobicContact CB-CD1 4.27Å; L638-I643 HydrophobicContact CB-CG1 3.93Å; L638-I643 HydrophobicContact CD1-CG1 4.46Å; T639-I643 WeakPolarHBondContact O-CG1 3.47Å; T639-I643 PolarHBondContact O-N 3.37Å; I643-A645 VanDerWaalsContact C-N 3.34Å; I643-A645 PolarHBondContact O-N 3.1Å; I643-L646 PolarHBondContact O-N 3.01Å; I643-L647 PolarHBondContact O-N 3.05Å
644	L	98.5	Very high	97.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.4	-50	175	173.2	59.8	0	0	0	111.1	F579 L584 F588 M590 D640 L641 L647 I648 L701 L704 T712	F579-L644 HydrophobicContact CE1-CD1 4.08Å; L584-L644 HydrophobicContact CD1-CB 4.46Å; L584-L644 HydrophobicContact CD1-CD1 4.13Å; L584-L644 HydrophobicContact CD2-CB 4.16Å; F588-L644 HydrophobicContact CD2-CD2 3.76Å; F588-L644 HydrophobicContact CE2-CB 4.09Å; F588-L644 HydrophobicContact CE2-CD2 3.79Å; F588-L644 HydrophobicContact CE2-CG 4.48Å; F588-L644 HydrophobicContact CG-CD2 4.15Å; F588-L644 HydrophobicContact CZ-CD2 4.22Å; M590-L644 HydrophobicContact CE-CD1 3.39Å; M590-L644 HydrophobicContact CE-CD2 4.2Å; M590-L644 HydrophobicContact CE-CG 4.45Å; D640-L644 VanDerWaalsContact O-CB 3.26Å; D640-L644 WeakPolarHBondContact O-CB 3.43Å; D640-L644 PolarHBondContact O-N 2.95Å; L641-L644 PolarHBondContact O-N 3.32Å; L644-L647 PolarHBondContact O-N 3.35Å; L644-I648 HydrophobicContact CD1-CD1 3.62Å; L644-I648 HydrophobicContact CD1-CG1 4.24Å; L644-I648 HydrophobicContact CG-CD1 3.98Å; L644-I648 WeakPolarHBondContact O-CG1 3.34Å; L644-I648 PolarHBondContact O-N 3.49Å; L644-I648 VanDerWaalsContact O-N 3.08Å; L644-L701 HydrophobicContact CD1-CD2 4.46Å; L644-L701 HydrophobicContact CD2-CD2 3.76Å; L644-L701 HydrophobicContact CG-CD2 4.31Å; L644-L704 HydrophobicContact CD2-CD2 4.4Å; L644-T712 HydrophobicContact CD2-CG2 4.37Å; L644-T712 HydrophobicContact CG-CG2 4.47Å
645	A	98.6	Very high	97.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-43.4	-179.5	0	0	0	0	0	112.2	L641 E642 I643 I648 A649 T712 I715 I716	L641-A645 WeakPolarHBondContact O-CB 3.26Å; L641-A645 PolarHBondContact O-N 3.02Å; E642-A645 PolarHBondContact O-N 3.31Å; I643-A645 VanDerWaalsContact C-N 3.34Å; I643-A645 PolarHBondContact O-N 3.1Å; A645-I648 PolarHBondContact O-N 3.08Å; A645-A649 VanDerWaalsContact O-CB 3.22Å; A645-A649 WeakPolarHBondContact O-CB 3.43Å; A645-A649 PolarHBondContact O-N 3.29Å; A645-T712 HydrophobicContact CB-CG2 4.18Å; A645-I715 HydrophobicContact CB-CB 3.63Å; A645-I715 HydrophobicContact CB-CG2 3.43Å; A645-I715 VanDerWaalsContact CB-CG2 3.43Å; A645-I716 HydrophobicContact CB-CG1 3.9Å
646	L	98.7	Very high	97.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.1	-42.5	178	-76.7	175.3	0	0	0	112.5	M625 L638 E642 I643 A649 A650 A719 L756 L759 M760	M625-L646 HydrophobicContact CE-CB 4.15Å; M625-L646 HydrophobicContact CE-CD1 4.37Å; M625-L646 HydrophobicContact CE-CD2 3.96Å; M625-L646 HydrophobicContact CE-CG 4.4Å; M625-L646 HydrophobicContact CG-CB 4.3Å; M625-L646 HydrophobicContact SD-CB 4.1Å; M625-L646 HydrophobicContact SD-CD1 3.96Å; M625-L646 HydrophobicContact SD-CG 4.48Å; L638-L646 HydrophobicContact CD1-CD1 3.72Å; E642-L646 WeakPolarHBondContact O-CB 3.42Å; E642-L646 VanDerWaalsContact O-CG 3.32Å; E642-L646 WeakPolarHBondContact O-CG 3.14Å; E642-L646 PolarHBondContact O-N 3.32Å; I643-L646 PolarHBondContact O-N 3.01Å; L646-A649 PolarHBondContact O-N 2.91Å; L646-A650 VanDerWaalsContact O-CB 3.3Å; L646-A650 WeakPolarHBondContact O-CB 3.46Å; L646-A650 PolarHBondContact O-N 3Å; L646-A719 HydrophobicContact CD2-CB 4.42Å; L646-L756 HydrophobicContact CD1-CD2 3.66Å; L646-L756 HydrophobicContact CD2-CB 4.34Å; L646-L756 HydrophobicContact CD2-CD2 4.18Å; L646-L756 HydrophobicContact CG-CD2 4.12Å; L646-L759 HydrophobicContact CD1-CD2 4.07Å; L646-M760 HydrophobicContact CD2-CG 3.71Å; L646-M760 HydrophobicContact CD2-SD 3.81Å
647	L	98.6	Very high	97.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.8	-41.1	179.8	-169.8	66.2	0	0	0	111.4	M578 F579 L582 L584 A622 I643 L644 L651	M578-L647 HydrophobicContact CB-CD2 4.32Å; F579-L647 HydrophobicContact CD1-CD2 4.04Å; F579-L647 HydrophobicContact CD2-CD2 3.6Å; F579-L647 HydrophobicContact CE1-CD2 4.01Å; F579-L647 HydrophobicContact CE2-CD2 3.55Å; F579-L647 HydrophobicContact CE2-CG 4.01Å; F579-L647 HydrophobicContact CG-CD2 3.84Å; F579-L647 HydrophobicContact CZ-CD2 3.76Å; F579-L647 HydrophobicContact CZ-CG 4.09Å; L582-L647 HydrophobicContact CD1-CD2 4.04Å; L584-L647 HydrophobicContact CD1-CD2 3.95Å; A622-L647 HydrophobicContact CB-CD1 4.2Å; I643-L647 PolarHBondContact O-N 3.05Å; L644-L647 PolarHBondContact O-N 3.35Å; L647-L651 HydrophobicContact CG-CD1 4.5Å; L647-L651 WeakPolarHBondContact O-CG 3.36Å; L647-L651 PolarHBondContact O-N 3.11Å
648	I	98.7	Very high	97.8	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.2	-46.8	173.4	-70.2	170	0	0	0	110.6	F579 W598 L644 A645 A650 L651 S652 I700 L701 I716	F579-I648 HydrophobicContact CE1-CG1 4.36Å; F579-I648 HydrophobicContact CZ-CG1 4.18Å; W598-I648 HydrophobicContact CH2-CB 4.47Å; W598-I648 HydrophobicContact CH2-CG1 4.1Å; W598-I648 HydrophobicContact CH2-CG2 4.4Å; W598-I648 HydrophobicContact CZ2-CB 4.49Å; W598-I648 HydrophobicContact CZ2-CG1 4.25Å; W598-I648 HydrophobicContact CZ2-CG2 3.95Å; L644-I648 HydrophobicContact CD1-CD1 3.62Å; L644-I648 HydrophobicContact CD1-CG1 4.24Å; L644-I648 HydrophobicContact CG-CD1 3.98Å; L644-I648 WeakPolarHBondContact O-CG1 3.34Å; L644-I648 PolarHBondContact O-N 3.49Å; L644-I648 VanDerWaalsContact O-N 3.08Å; A645-I648 PolarHBondContact O-N 3.08Å; I648-A650 PolarHBondContact O-N 3.13Å; I648-L651 PolarHBondContact O-N 3.33Å; I648-S652 VanDerWaalsContact O-CB 3.29Å; I648-S652 WeakPolarHBondContact O-CB 3.47Å; I648-S652 PolarHBondContact O-N 3.11Å; I648-S652 VanDerWaalsContact O-N 3.08Å; I648-S652 PolarHBondContact O-OG 3.29Å; I648-I700 HydrophobicContact CD1-CD1 3.74Å; I648-I700 HydrophobicContact CG1-CD1 4.08Å; I648-L701 HydrophobicContact CD1-CD2 3.84Å; I648-I716 HydrophobicContact CB-CD1 4.09Å; I648-I716 HydrophobicContact CB-CG1 4.35Å; I648-I716 HydrophobicContact CD1-CD1 4.28Å; I648-I716 HydrophobicContact CG2-CD1 3.61Å; I648-I716 HydrophobicContact CG2-CG1 4.11Å
649	A	98.8	Very high	97.7	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.1	-46.6	178.7	0	0	0	0	0	111.5	A645 L646 L651 S652 H653 I716 A719 I720 M760	A645-A649 VanDerWaalsContact O-CB 3.22Å; A645-A649 WeakPolarHBondContact O-CB 3.43Å; A645-A649 PolarHBondContact O-N 3.29Å; L646-A649 PolarHBondContact O-N 2.91Å; A649-L651 VanDerWaalsContact C-N 3.31Å; A649-L651 PolarHBondContact O-N 3.21Å; A649-S652 CarbonylContact O-C 3.09Å; A649-S652 PolarHBondContact O-N 3.4Å; A649-H653 WeakPolarHBondContact O-CA 3.43Å; A649-H653 VanDerWaalsContact O-CB 3.31Å; A649-H653 WeakPolarHBondContact O-CB 3.38Å; A649-H653 PolarHBondContact O-N 2.83Å; A649-I716 HydrophobicContact CB-CG2 4.45Å; A649-A719 HydrophobicContact CB-CB 3.48Å; A649-A719 VanDerWaalsContact CB-CB 3.48Å; A649-I720 HydrophobicContact CB-CG1 3.97Å; A649-M760 HydrophobicContact CB-CE 4.03Å; A649-M760 HydrophobicContact CB-SD 4.25Å
650	A	98.8	Very high	97.4	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.2	-40.5	178.5	0	0	0	0	0	112.9	T621 A622 M625 L646 I648 S652 H653 M760	T621-A650 HydrophobicContact CG2-CB 4.1Å; A622-A650 HydrophobicContact CB-CB 4.01Å; M625-A650 HydrophobicContact CB-CB 4.4Å; L646-A650 VanDerWaalsContact O-CB 3.3Å; L646-A650 WeakPolarHBondContact O-CB 3.46Å; L646-A650 PolarHBondContact O-N 3Å; I648-A650 PolarHBondContact O-N 3.13Å; A650-S652 VanDerWaalsContact C-N 3.31Å; A650-S652 PolarHBondContact O-N 3.38Å; A650-H653 PolarHBondContact O-ND1 3.07Å; A650-M760 HydrophobicContact CB-CE 4.43Å; A650-M760 HydrophobicContact CB-SD 4.5Å
651	L	98.8	Very high	97.1	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-72.4	-23.4	176.7	-71.1	165.8	0	0	0	113.4	T575 F579 W598 V602 Y606 W615 A622 L647 I648 A649	T575-L651 HydrophobicContact CG2-CD1 3.61Å; T575-L651 HydrophobicContact CG2-CD2 4.09Å; F579-L651 HydrophobicContact CE2-CD1 3.72Å; F579-L651 HydrophobicContact CZ-CD1 4.19Å; W598-L651 HydrophobicContact CH2-CB 4.21Å; W598-L651 HydrophobicContact CH2-CD1 3.76Å; W598-L651 HydrophobicContact CZ3-CD1 3.82Å; V602-L651 HydrophobicContact CG1-CB 4.48Å; V602-L651 WeakPolarHBondContact CG1-O 3.45Å; Y606-L651 VanDerWaalsContact CE2-O 3.27Å; Y606-L651 WeakPolarHBondContact CE2-O 3.37Å; Y606-L651 PolarHBondContact OH-O 3.49Å; W615-L651 HydrophobicContact CH2-CD2 3.93Å; W615-L651 HydrophobicContact CZ3-CD2 4.04Å; A622-L651 HydrophobicContact CB-CD2 3.46Å; A622-L651 VanDerWaalsContact CB-CD2 3.46Å; A622-L651 HydrophobicContact CB-CG 3.61Å; L647-L651 HydrophobicContact CG-CD1 4.5Å; L647-L651 WeakPolarHBondContact O-CG 3.36Å; L647-L651 PolarHBondContact O-N 3.11Å; I648-L651 PolarHBondContact O-N 3.33Å; A649-L651 VanDerWaalsContact C-N 3.31Å; A649-L651 PolarHBondContact O-N 3.21Å
652	S	98.6	Very high	96.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-112.4	-7.3	-169.7	-65.5	0	0	0	0	115	I648 A649 A650 D654 L655 C689	I648-S652 VanDerWaalsContact O-CB 3.29Å; I648-S652 WeakPolarHBondContact O-CB 3.47Å; I648-S652 PolarHBondContact O-N 3.11Å; I648-S652 VanDerWaalsContact O-N 3.08Å; I648-S652 PolarHBondContact O-OG 3.29Å; A649-S652 CarbonylContact O-C 3.09Å; A649-S652 PolarHBondContact O-N 3.4Å; A650-S652 VanDerWaalsContact C-N 3.31Å; A650-S652 PolarHBondContact O-N 3.38Å; S652-D654 PolarHBondContact O-N 3.38Å; S652-D654 VanDerWaalsContact O-N 3.11Å; S652-L655 WeakPolarHBondContact O-CG 3.49Å; S652-L655 PolarHBondContact O-N 2.95Å; S652-C689 WeakPolarHBondContact CB-SG 3.48Å; S652-C689 PolarHBondContact OG-SG 2.85Å; S652-C689 VanDerWaalsContact OG-SG 3.38Å
653	H	98.4	Very high	96.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.6	-167.2	76.7	-73.9	0	0	0	115.1	H617 A649 A650 H685 I720 T723 D764	H617-H653 AromaticContact CD2-CE1 3.79Å; H617-H653 AromaticContact CD2-NE2 3.81Å; H617-H653 AromaticContact NE2-CE1 3.37Å; H617-H653 PolarHBondContact NE2-CE1 3.1Å; H617-H653 AromaticContact NE2-NE2 3.13Å; H617-H653 PolarHBondContact NE2-NE2 2.87Å; H617-H653 VanDerWaalsContact NE2-NE2 3.13Å; A649-H653 WeakPolarHBondContact O-CA 3.43Å; A649-H653 VanDerWaalsContact O-CB 3.31Å; A649-H653 WeakPolarHBondContact O-CB 3.38Å; A649-H653 PolarHBondContact O-N 2.83Å; A650-H653 PolarHBondContact O-ND1 3.07Å; H653-H685 WeakPolarHBondContact O-CB 3.41Å; H653-H685 PolarHBondContact O-CD2 3.45Å; H653-I720 HydrophobicContact CB-CG1 4.16Å; H653-I720 HydrophobicContact CB-CG2 4.42Å; H653-T723 HydrophobicContact CB-CG2 3.98Å; H653-D764 IonicContact NE2-OD1 2.87Å
654	D	98.4	Very high	96	Very high	12 Å²	12	13.5 Å²	13.5	6%	0.064	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	20.9	-178.6	-90	-18.1	0	0	0	112.7	Y606 H613 H617 S652 D656 H657 H685	Y606-D654 HydrophobicContact CE1-CB 3.66Å; Y606-D654 WeakPolarHBondContact CE1-O 3.31Å; Y606-D654 PolarHBondContact OH-N 2.68Å; H613-D654 IonicContact CD2-OD2 2.84Å; H613-D654 PolarHBondContact CD2-OD2 3.04Å; H613-D654 VanDerWaalsContact CD2-OD2 3.26Å; H613-D654 IonicContact CG-OD2 3.17Å; H617-D654 IonicContact CD2-OD2 2.79Å; H617-D654 PolarHBondContact CD2-OD2 2.88Å; H617-D654 IonicContact NE2-OD2 3.58Å; H617-D654 PolarHBondContact NE2-OD2 3.22Å; S652-D654 PolarHBondContact O-N 3.38Å; S652-D654 VanDerWaalsContact O-N 3.11Å; D654-D656 PolarHBondContact O-N 3.04Å; D654-H657 HydrophobicContact CB-CB 4.32Å; D654-H657 VanDerWaalsContact O-CB 3.26Å; D654-H657 WeakPolarHBondContact O-CB 3.23Å; D654-H657 PolarHBondContact O-N 3.37Å; D654-H657 IonicContact OD1-CD2 3.81Å; D654-H685 IonicContact OD1-NE2 3.65Å
655	L	97.8	Very high	95.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	130.5	179.8	-85.1	170.1	0	0	0	112	V602 N605 Y606 S652 H657 H685 Q688 C689 I692	V602-L655 HydrophobicContact CG1-CD2 4.06Å; V602-L655 WeakPolarHBondContact O-CD2 3.37Å; N605-L655 HydrophobicContact CB-CD2 3.81Å; Y606-L655 HydrophobicContact CD2-CD2 3.88Å; Y606-L655 HydrophobicContact CE2-CD2 3.59Å; Y606-L655 HydrophobicContact CE2-CG 4.03Å; S652-L655 WeakPolarHBondContact O-CG 3.49Å; S652-L655 PolarHBondContact O-N 2.95Å; L655-H657 PolarHBondContact O-N 3.45Å; L655-H685 PolarHBondContact O-CE1 2.96Å; L655-H685 PolarHBondContact O-ND1 3.07Å; L655-Q688 HydrophobicContact CB-CB 3.83Å; L655-Q688 HydrophobicContact CD1-CB 4.29Å; L655-C689 HydrophobicContact CD1-CB 4.03Å; L655-I692 HydrophobicContact CD1-CD1 4.05Å; L655-I692 HydrophobicContact CD2-CD1 4.2Å
656	D	96.1	Very high	95.1	Very high	19 Å²	19	20.1 Å²	20.1	10%	0.102	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	22.7	-175.3	-164.6	48.7	0	0	0	115	N605 R607 D654 R658 H684 Q688	N605-D656 PolarHBondContact O-N 2.88Å; N605-D656 VanDerWaalsContact O-N 3.1Å; R607-D656 IonicContact CZ-OD1 2.8Å; R607-D656 IonicContact NE-OD1 2.74Å; R607-D656 PolarHBondContact NE-OD1 3.44Å; R607-D656 IonicContact NH2-OD1 3.35Å; R607-D656 PolarHBondContact NH2-OD1 3.31Å; R607-D656 IonicContact NH2-OD2 3.76Å; D654-D656 PolarHBondContact O-N 3.04Å; D656-R658 WeakPolarHBondContact O-CG 3.45Å; D656-R658 PolarHBondContact O-N 3.25Å; D656-R658 IonicContact OD2-CZ 2.77Å; D656-R658 IonicContact OD2-NE 2.92Å; D656-R658 IonicContact OD2-NH2 3.67Å; D656-R658 PolarHBondContact OD2-NH2 3.2Å; D656-H684 IonicContact OD2-CD2 2.93Å; D656-H684 IonicContact OD2-CE1 3.91Å; D656-H684 PolarHBondContact OD2-CE1 3.23Å; D656-H684 IonicContact OD2-NE2 2.76Å; D656-H684 PolarHBondContact OD2-NE2 3.13Å; D656-Q688 HydrophobicContact CB-CG 3.98Å
657	H	96.4	Very high	94.6	Very high	17 Å²	17	26.8 Å²	26.8	8%	0.079	13%	0.128	C	C	.	.			trans	-57	136.2	173.6	-166.2	-85.2	0	0	0	111.4	R607 V610 H613 D654 L655 G659 H685 E785	R607-H657 VanDerWaalsContact CD-O 3.3Å; R607-H657 WeakPolarHBondContact CD-O 3.22Å; V610-H657 WeakPolarHBondContact CG2-O 3.26Å; H613-H657 HydrophobicContact CB-CB 3.97Å; H613-H657 WeakPolarHBondContact CB-ND1 3.37Å; H613-H657 AromaticContact CG-CE1 3.77Å; H613-H657 AromaticContact CG-ND1 3.73Å; H613-H657 AromaticContact ND1-CE1 3.58Å; H613-H657 AromaticContact ND1-ND1 3.87Å; D654-H657 HydrophobicContact CB-CB 4.32Å; D654-H657 VanDerWaalsContact O-CB 3.26Å; D654-H657 WeakPolarHBondContact O-CB 3.23Å; D654-H657 PolarHBondContact O-N 3.37Å; D654-H657 IonicContact OD1-CD2 3.81Å; L655-H657 PolarHBondContact O-N 3.45Å; H657-G659 PolarHBondContact ND1-N 3.23Å; H657-G659 VanDerWaalsContact ND1-N 3.12Å; H657-H685 AromaticContact CD2-CE1 4Å; H657-H685 AromaticContact CD2-NE2 3.71Å; H657-E785 IonicContact CE1-OE1 2.95Å
658	R	93.9	Very high	94	Very high	81 Å²	81	28.8 Å²	28.8	31%	0.306	14%	0.142	S	C	.	.			trans	-104.7	7.7	-167.1	-58.4	-173.2	-179.1	-159	-2.9	114.4	D656 V660 H670 M681	D656-R658 WeakPolarHBondContact O-CG 3.45Å; D656-R658 PolarHBondContact O-N 3.25Å; D656-R658 IonicContact OD2-CZ 2.77Å; D656-R658 IonicContact OD2-NE 2.92Å; D656-R658 IonicContact OD2-NH2 3.67Å; D656-R658 PolarHBondContact OD2-NH2 3.2Å; R658-V660 VanDerWaalsContact C-N 3.28Å; R658-V660 HydrophobicContact CB-CG2 4.2Å; R658-V660 PolarHBondContact O-N 3.41Å; R658-H670 PolarHBondContact NH1-CE1 3.12Å; R658-H670 PolarHBondContact NH1-NE2 2.92Å; R658-M681 HydrophobicContact CG-CE 4.25Å
659	G	93	Very high	93.3	Very high	12 Å²	12	36.4 Å²	36.4	12%	0.124	18%	0.178	C	C	.	.	S	Bend	trans	71.5	21.9	-176.9	0	0	0	0	0	113.7	H657 E785	H657-G659 PolarHBondContact ND1-N 3.23Å; H657-G659 VanDerWaalsContact ND1-N 3.12Å; G659-E785 WeakPolarHBondContact CA-OE1 3.37Å
660	V	92.3	Very high	92.8	Very high	7 Å²	7	39 Å²	39	4%	0.042	19%	0.19	C	C	.	.			trans	-139.2	146.6	178.2	-64.1	0	0	0	0	110.3	R658 Y664 I665 Q789	R658-V660 VanDerWaalsContact C-N 3.28Å; R658-V660 HydrophobicContact CB-CG2 4.2Å; R658-V660 PolarHBondContact O-N 3.41Å; V660-Y664 HydrophobicContact CB-CD1 3.94Å; V660-Y664 HydrophobicContact CB-CG 4.01Å; V660-Y664 HydrophobicContact CG1-CD1 4.02Å; V660-Y664 HydrophobicContact CG1-CE1 4.3Å; V660-Y664 HydrophobicContact CG1-CG 4.16Å; V660-Y664 HydrophobicContact CG2-CD1 4Å; V660-I665 HydrophobicContact CG2-CD1 4.26Å; V660-I665 HydrophobicContact CG2-CG1 3.98Å; V660-Q789 VanDerWaalsContact CA-OE1 3.28Å; V660-Q789 HydrophobicContact CG1-CG 4.16Å
661	N	91.4	Very high	92.2	Very high	48 Å²	48	43 Å²	43	26%	0.257	22%	0.216	S	C	.	.			trans	-83.3	167.8	-179.5	70.1	19.6	0	0	0	113.9	S663 Y664 I665 Q789 M805	N661-S663 PolarHBondContact ND2-OG 3.36Å; N661-S663 PolarHBondContact O-N 3.11Å; N661-S663 VanDerWaalsContact O-N 3.14Å; N661-S663 PolarHBondContact OD1-N 3.5Å; N661-S663 PolarHBondContact OD1-OG 2.8Å; N661-Y664 WeakPolarHBondContact O-CB 3.43Å; N661-Y664 PolarHBondContact O-N 2.96Å; N661-Y664 VanDerWaalsContact O-N 3.08Å; N661-Y664 PolarHBondContact OD1-N 3.09Å; N661-I665 PolarHBondContact O-N 3.48Å; N661-Q789 VanDerWaalsContact CG-NE2 3.26Å; N661-Q789 PolarHBondContact ND2-NE2 3.47Å; N661-Q789 PolarHBondContact OD1-NE2 3.32Å; N661-M805 VanDerWaalsContact ND2-CE 3.33Å; N661-M805 WeakPolarHBondContact ND2-CE 3.37Å
662	N	90.6	Very high	91.5	Very high	34 Å²	34	43.7 Å²	43.7	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-52.8	-35.4	178	-77.4	-32.2	0	0	0	113.6	Y664 I665 Q666 I680 M681 E682	N662-Y664 PolarHBondContact O-N 2.92Å; N662-I665 PolarHBondContact O-N 3.32Å; N662-Q666 PolarHBondContact O-N 2.84Å; N662-Q666 VanDerWaalsContact O-N 3.11Å; N662-I680 PolarHBondContact OD1-N 2.99Å; N662-M681 WeakPolarHBondContact OD1-CB 3.36Å; N662-M681 VanDerWaalsContact OD1-CG 3.3Å; N662-M681 WeakPolarHBondContact OD1-CG 3.5Å; N662-M681 PolarHBondContact OD1-N 3.12Å; N662-E682 PolarHBondContact ND2-OE1 3.2Å; N662-E682 PolarHBondContact ND2-OE2 3.41Å
663	S	89.4	Confident	90.8	Very high	48 Å²	48	45 Å²	45	34%	0.336	23%	0.231	S	C	.	.	H	α-helix	trans	-68.1	-35.2	-179.5	77.4	0	0	0	0	113	N661 R667	N661-S663 PolarHBondContact ND2-OG 3.36Å; N661-S663 PolarHBondContact O-N 3.11Å; N661-S663 VanDerWaalsContact O-N 3.14Å; N661-S663 PolarHBondContact OD1-N 3.5Å; N661-S663 PolarHBondContact OD1-OG 2.8Å; S663-R667 WeakPolarHBondContact O-CB 3.25Å; S663-R667 VanDerWaalsContact O-CG 3.26Å; S663-R667 WeakPolarHBondContact O-CG 3.39Å; S663-R667 PolarHBondContact O-N 3.25Å; S663-R667 VanDerWaalsContact O-N 3.16Å
664	Y	90.3	Very high	90	Very high	5 Å²	5	52.7 Å²	52.7	2%	0.02	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-45.8	174.4	-174.5	-84.7	0	0	0	111.4	V660 N661 N662 Q666 R667 S668 Q789 R792 E793 E796 L797	V660-Y664 HydrophobicContact CB-CD1 3.94Å; V660-Y664 HydrophobicContact CB-CG 4.01Å; V660-Y664 HydrophobicContact CG1-CD1 4.02Å; V660-Y664 HydrophobicContact CG1-CE1 4.3Å; V660-Y664 HydrophobicContact CG1-CG 4.16Å; V660-Y664 HydrophobicContact CG2-CD1 4Å; N661-Y664 WeakPolarHBondContact O-CB 3.43Å; N661-Y664 PolarHBondContact O-N 2.96Å; N661-Y664 VanDerWaalsContact O-N 3.08Å; N661-Y664 PolarHBondContact OD1-N 3.09Å; N662-Y664 PolarHBondContact O-N 2.92Å; Y664-Q666 VanDerWaalsContact C-N 3.31Å; Y664-Q666 PolarHBondContact O-N 3.48Å; Y664-R667 PolarHBondContact O-N 2.98Å; Y664-R667 VanDerWaalsContact O-N 3.16Å; Y664-S668 WeakPolarHBondContact O-CB 3.4Å; Y664-S668 PolarHBondContact O-N 3.4Å; Y664-S668 PolarHBondContact O-OG 3.36Å; Y664-Q789 HydrophobicContact CD2-CG 4.14Å; Y664-R792 HydrophobicContact CE2-CB 4.2Å; Y664-E793 HydrophobicContact CD2-CG 3.44Å; Y664-E793 VanDerWaalsContact CD2-CG 3.44Å; Y664-E793 HydrophobicContact CE2-CB 4.49Å; Y664-E793 HydrophobicContact CE2-CG 3.58Å; Y664-E796 PolarHBondContact OH-OE2 3.45Å; Y664-L797 HydrophobicContact CD2-CD1 4.25Å; Y664-L797 HydrophobicContact CE2-CD1 4.05Å
665	I	90.1	Very high	89	Confident	4 Å²	4	57 Å²	57	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-40.8	-177.4	-65.1	174.4	0	0	0	110.6	V660 N661 N662 S668 H670 L672 A673 I680 M681	V660-I665 HydrophobicContact CG2-CD1 4.26Å; V660-I665 HydrophobicContact CG2-CG1 3.98Å; N661-I665 PolarHBondContact O-N 3.48Å; N662-I665 PolarHBondContact O-N 3.32Å; I665-S668 WeakPolarHBondContact CA-OG 3.32Å; I665-S668 PolarHBondContact O-OG 2.91Å; I665-H670 HydrophobicContact CG2-CB 3.85Å; I665-H670 PolarHBondContact O-N 3.42Å; I665-L672 HydrophobicContact CG2-CB 4.27Å; I665-A673 HydrophobicContact CG2-CB 4.24Å; I665-I680 HydrophobicContact CG2-CG2 4.08Å; I665-M681 HydrophobicContact CD1-CE 4.39Å; I665-M681 HydrophobicContact CD1-CG 3.27Å; I665-M681 HydrophobicContact CD1-SD 3.21Å; I665-M681 WeakPolarHBondContact CD1-SD 3.31Å
666	Q	88.1	Confident	88.3	Confident	135 Å²	135	58.8 Å²	58.8	63%	0.631	30%	0.296	S	S	*	.	H	α-helix	trans	-65	-41	174.9	-168.7	177.7	20.5	0	0	112.3	N662 Y664	N662-Q666 PolarHBondContact O-N 2.84Å; N662-Q666 VanDerWaalsContact O-N 3.11Å; Y664-Q666 VanDerWaalsContact C-N 3.31Å; Y664-Q666 PolarHBondContact O-N 3.48Å
667	R	88.8	Confident	87.1	Confident	139 Å²	139	63.2 Å²	63.2	53%	0.525	33%	0.327	S	S	.	.	H	α-helix	trans	-74.9	-25.7	-179.1	-72.3	174.3	-179.4	-176.3	0.7	114.1	S663 Y664 E669 L797	S663-R667 WeakPolarHBondContact O-CB 3.25Å; S663-R667 VanDerWaalsContact O-CG 3.26Å; S663-R667 WeakPolarHBondContact O-CG 3.39Å; S663-R667 PolarHBondContact O-N 3.25Å; S663-R667 VanDerWaalsContact O-N 3.16Å; Y664-R667 PolarHBondContact O-N 2.98Å; Y664-R667 VanDerWaalsContact O-N 3.16Å; R667-E669 VanDerWaalsContact C-N 3.31Å; R667-L797 HydrophobicContact CB-CD1 3.98Å
668	S	85.6	Confident	86.3	Confident	42 Å²	42	67.5 Å²	67.5	29%	0.294	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	4	179.7	52.8	0	0	0	0	113.7	Y664 I665 H670	Y664-S668 WeakPolarHBondContact O-CB 3.4Å; Y664-S668 PolarHBondContact O-N 3.4Å; Y664-S668 PolarHBondContact O-OG 3.36Å; I665-S668 WeakPolarHBondContact CA-OG 3.32Å; I665-S668 PolarHBondContact O-OG 2.91Å; S668-H670 PolarHBondContact O-N 2.84Å; S668-H670 VanDerWaalsContact O-N 3.14Å
669	E	84.4	Confident	86.1	Confident	160 Å²	160	64 Å²	64	75%	0.748	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	32.1	-176.1	-61	-174.7	175.9	0	0	113.2	R667	R667-E669 VanDerWaalsContact C-N 3.31Å
670	H	87.2	Confident	86.1	Confident	54 Å²	54	63.9 Å²	63.9	25%	0.25	33%	0.331	C	S	.	.			trans	-64	143.7	-177.6	-173.6	-88.3	0	0	0	110.8	R658 I665 S668 L672 A673	R658-H670 PolarHBondContact NH1-CE1 3.12Å; R658-H670 PolarHBondContact NH1-NE2 2.92Å; I665-H670 HydrophobicContact CG2-CB 3.85Å; I665-H670 PolarHBondContact O-N 3.42Å; S668-H670 PolarHBondContact O-N 2.84Å; S668-H670 VanDerWaalsContact O-N 3.14Å; H670-L672 WeakPolarHBondContact ND1-CB 3.42Å; H670-L672 WeakPolarHBondContact ND1-CG 3.31Å; H670-L672 PolarHBondContact ND1-N 2.97Å; H670-L672 PolarHBondContact O-N 3.04Å; H670-A673 WeakPolarHBondContact O-CB 3.45Å; H670-A673 PolarHBondContact O-N 2.87Å
671	P	86	Confident	86.1	Confident	85 Å²	85	63.7 Å²	63.7	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-53.3	-31.3	-177.1	-30	35.5	0	0	0	115.1	A673 Q674 L675	P671-A673 VanDerWaalsContact C-N 3.26Å; P671-A673 PolarHBondContact O-N 3.41Å; P671-Q674 WeakPolarHBondContact O-CB 3.2Å; P671-Q674 PolarHBondContact O-N 2.96Å; P671-L675 PolarHBondContact O-N 3.12Å; P671-L675 VanDerWaalsContact O-N 3.14Å
672	L	83.8	Confident	86.4	Confident	16 Å²	16	62.4 Å²	62.4	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-60.1	-33.4	174.3	-66.8	172.7	0	0	0	112.9	I665 H670 Q674 L675 Y676 I680 M681 H684	I665-L672 HydrophobicContact CG2-CB 4.27Å; H670-L672 WeakPolarHBondContact ND1-CB 3.42Å; H670-L672 WeakPolarHBondContact ND1-CG 3.31Å; H670-L672 PolarHBondContact ND1-N 2.97Å; H670-L672 PolarHBondContact O-N 3.04Å; L672-Q674 VanDerWaalsContact C-N 3.29Å; L672-Q674 PolarHBondContact O-N 3.27Å; L672-L675 PolarHBondContact O-N 2.92Å; L672-Y676 HydrophobicContact CD2-CE2 4.09Å; L672-Y676 WeakPolarHBondContact O-CD2 3.48Å; L672-Y676 PolarHBondContact O-N 3.13Å; L672-I680 HydrophobicContact CB-CG2 3.81Å; L672-I680 WeakPolarHBondContact O-CG2 3.39Å; L672-M681 HydrophobicContact CD1-SD 4.15Å; L672-H684 HydrophobicContact CD2-CB 4.34Å
673	A	85.4	Confident	86.6	Confident	28 Å²	28	62.1 Å²	62.1	23%	0.231	32%	0.32	C	S	.	.	H	α-helix	trans	-73.2	-20.7	176	0	0	0	0	0	113.2	I665 H670 P671 Y676 I680	I665-A673 HydrophobicContact CG2-CB 4.24Å; H670-A673 WeakPolarHBondContact O-CB 3.45Å; H670-A673 PolarHBondContact O-N 2.87Å; P671-A673 VanDerWaalsContact C-N 3.26Å; P671-A673 PolarHBondContact O-N 3.41Å; A673-Y676 CarbonylContact C-O 3.56Å; A673-I680 HydrophobicContact CB-CD1 4.03Å
674	Q	80.5	Confident	86.8	Confident	160 Å²	160	60.5 Å²	60.5	75%	0.748	31%	0.307	S	S	*	.	H	α-helix	trans	-80.7	-30.3	171.1	-64.4	-177.7	-2.9	0	0	111.4	P671 L672	P671-Q674 WeakPolarHBondContact O-CB 3.2Å; P671-Q674 PolarHBondContact O-N 2.96Å; L672-Q674 VanDerWaalsContact C-N 3.29Å; L672-Q674 PolarHBondContact O-N 3.27Å
675	L	77.6	Confident	87.1	Confident	102 Å²	102	60.3 Å²	60.3	53%	0.534	31%	0.306	S	S	.	.	H	α-helix	trans	-78.2	-40.2	-179.4	-170.8	61.8	0	0	0	112.5	P671 L672	P671-L675 PolarHBondContact O-N 3.12Å; P671-L675 VanDerWaalsContact O-N 3.14Å; L672-L675 PolarHBondContact O-N 2.92Å
676	Y	83.6	Confident	87.5	Confident	38 Å²	38	60.9 Å²	60.9	15%	0.149	31%	0.309	C	S	.	.			trans	-123.2	144.9	-178.4	-46.4	-70	0	0	0	111.6	L672 A673 I680 H683 H684 D687	L672-Y676 HydrophobicContact CD2-CE2 4.09Å; L672-Y676 WeakPolarHBondContact O-CD2 3.48Å; L672-Y676 PolarHBondContact O-N 3.13Å; A673-Y676 CarbonylContact C-O 3.56Å; Y676-I680 HydrophobicContact CD2-CG2 4.13Å; Y676-I680 WeakPolarHBondContact CD2-O 3.49Å; Y676-H683 HydrophobicContact CD1-CB 3.66Å; Y676-H683 HydrophobicContact CD2-CB 4.15Å; Y676-H683 HydrophobicContact CE1-CB 3.77Å; Y676-H683 HydrophobicContact CE2-CB 4.26Å; Y676-H683 HydrophobicContact CG-CB 3.86Å; Y676-H684 HydrophobicContact CE2-CB 4.23Å; Y676-D687 PolarHBondContact OH-OD2 2.75Å
677	C	70.3	Confident	87.7	Confident	112 Å²	112	57.4 Å²	57.4	76%	0.757	30%	0.295	S	S	*	.	S	Bend	trans	-100.2	-24.4	-176.1	61.3	0	0	0	0	115
678	H	80.7	Confident	88	Confident	107 Å²	107	52.5 Å²	52.5	50%	0.495	28%	0.278	S	S	.	.	S	Bend	trans	-146.1	153.7	177.6	63.6	-75.4	0	0	0	109.4	I680 H683	H678-I680 PolarHBondContact O-N 3.42Å; H678-H683 AromaticContact NE2-CE1 3.94Å; H678-H683 PolarHBondContact O-CE1 2.64Å; H678-H683 PolarHBondContact O-ND1 3.47Å; H678-H683 VanDerWaalsContact O-ND1 3.16Å
679	S	89.8	Confident	88.5	Confident	8 Å²	8	50.6 Å²	50.6	6%	0.056	26%	0.264	C	S	.	.	S	Bend	trans	45.9	53.2	-177.9	-46.9	0	0	0	0	111	M681 E682 H683 D724	S679-M681 PolarHBondContact O-N 2.8Å; S679-E682 WeakPolarHBondContact CA-OE2 3.45Å; S679-E682 WeakPolarHBondContact CB-OE2 3.33Å; S679-E682 PolarHBondContact O-N 2.73Å; S679-H683 PolarHBondContact O-N 3.31Å; S679-H683 PolarHBondContact O-ND1 2.95Å; S679-D724 WeakPolarHBondContact CB-OD2 3.18Å; S679-D724 PolarHBondContact OG-OD2 2.82Å
680	I	91.5	Very high	89	Confident	10 Å²	10	45 Å²	45	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-47.8	-163.7	-64.1	168.1	0	0	0	110	N662 I665 L672 A673 Y676 H678 H684	N662-I680 PolarHBondContact OD1-N 2.99Å; I665-I680 HydrophobicContact CG2-CG2 4.08Å; L672-I680 HydrophobicContact CB-CG2 3.81Å; L672-I680 WeakPolarHBondContact O-CG2 3.39Å; A673-I680 HydrophobicContact CB-CD1 4.03Å; Y676-I680 HydrophobicContact CD2-CG2 4.13Å; Y676-I680 WeakPolarHBondContact CD2-O 3.49Å; H678-I680 PolarHBondContact O-N 3.42Å; I680-H684 PolarHBondContact O-N 3.23Å
681	M	93.6	Very high	89.3	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-69.9	-38.9	179	-74.5	-62.7	-75	0	0	111.9	R658 N662 I665 L672 S679 H683 H684 H685	R658-M681 HydrophobicContact CG-CE 4.25Å; N662-M681 WeakPolarHBondContact OD1-CB 3.36Å; N662-M681 VanDerWaalsContact OD1-CG 3.3Å; N662-M681 WeakPolarHBondContact OD1-CG 3.5Å; N662-M681 PolarHBondContact OD1-N 3.12Å; I665-M681 HydrophobicContact CD1-CE 4.39Å; I665-M681 HydrophobicContact CD1-CG 3.27Å; I665-M681 HydrophobicContact CD1-SD 3.21Å; I665-M681 WeakPolarHBondContact CD1-SD 3.31Å; L672-M681 HydrophobicContact CD1-SD 4.15Å; S679-M681 PolarHBondContact O-N 2.8Å; M681-H683 VanDerWaalsContact C-N 3.32Å; M681-H683 PolarHBondContact O-N 3.36Å; M681-H684 CarbonylContact O-C 3.59Å; M681-H684 WeakPolarHBondContact O-CA 3.18Å; M681-H684 WeakPolarHBondContact O-CB 3.42Å; M681-H684 PolarHBondContact O-N 2.73Å; M681-H685 VanDerWaalsContact C-CD2 3.45Å; M681-H685 PolarHBondContact O-CD2 3.22Å; M681-H685 PolarHBondContact O-N 3.07Å; M681-H685 PolarHBondContact O-ND1 3.16Å; M681-H685 PolarHBondContact O-NE2 3.31Å
682	E	96.6	Very high	89.7	Confident	22 Å²	22	40.3 Å²	40.3	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-34.5	-178.5	-61	75.6	-166.1	0	0	111.8	N662 S679 F686 I720 L721 D724	N662-E682 PolarHBondContact ND2-OE1 3.2Å; N662-E682 PolarHBondContact ND2-OE2 3.41Å; S679-E682 WeakPolarHBondContact CA-OE2 3.45Å; S679-E682 WeakPolarHBondContact CB-OE2 3.33Å; S679-E682 PolarHBondContact O-N 2.73Å; E682-F686 PolarHBondContact O-N 2.77Å; E682-F686 VanDerWaalsContact O-N 3.1Å; E682-I720 WeakPolarHBondContact O-CG2 3.3Å; E682-L721 HydrophobicContact CB-CD2 3.82Å; E682-D724 HydrophobicContact CG-CB 3.98Å
683	H	94.4	Very high	90.2	Very high	28 Å²	28	39.8 Å²	39.8	13%	0.13	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-43	168.8	-77.4	90.5	0	0	0	112	Y676 H678 S679 M681 F686 D687	Y676-H683 HydrophobicContact CD1-CB 3.66Å; Y676-H683 HydrophobicContact CD2-CB 4.15Å; Y676-H683 HydrophobicContact CE1-CB 3.77Å; Y676-H683 HydrophobicContact CE2-CB 4.26Å; Y676-H683 HydrophobicContact CG-CB 3.86Å; H678-H683 AromaticContact NE2-CE1 3.94Å; H678-H683 PolarHBondContact O-CE1 2.64Å; H678-H683 PolarHBondContact O-ND1 3.47Å; H678-H683 VanDerWaalsContact O-ND1 3.16Å; S679-H683 PolarHBondContact O-N 3.31Å; S679-H683 PolarHBondContact O-ND1 2.95Å; M681-H683 VanDerWaalsContact C-N 3.32Å; M681-H683 PolarHBondContact O-N 3.36Å; H683-F686 PolarHBondContact O-N 3.48Å; H683-D687 PolarHBondContact O-N 2.94Å
684	H	94.7	Very high	90.5	Very high	14 Å²	14	42.8 Å²	42.8	7%	0.065	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-42.7	176	175.8	69.9	0	0	0	112	D656 L672 Y676 I680 M681 F686 D687 Q688	D656-H684 IonicContact OD2-CD2 2.93Å; D656-H684 IonicContact OD2-CE1 3.91Å; D656-H684 PolarHBondContact OD2-CE1 3.23Å; D656-H684 IonicContact OD2-NE2 2.76Å; D656-H684 PolarHBondContact OD2-NE2 3.13Å; L672-H684 HydrophobicContact CD2-CB 4.34Å; Y676-H684 HydrophobicContact CE2-CB 4.23Å; I680-H684 PolarHBondContact O-N 3.23Å; M681-H684 CarbonylContact O-C 3.59Å; M681-H684 WeakPolarHBondContact O-CA 3.18Å; M681-H684 WeakPolarHBondContact O-CB 3.42Å; M681-H684 PolarHBondContact O-N 2.73Å; H684-F686 VanDerWaalsContact C-N 3.34Å; H684-F686 PolarHBondContact O-N 2.82Å; H684-D687 PolarHBondContact O-N 3.1Å; H684-Q688 PolarHBondContact CE1-NE2 3.46Å; H684-Q688 WeakPolarHBondContact O-CG 3.32Å; H684-Q688 PolarHBondContact O-N 2.93Å
685	H	96.8	Very high	90.9	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-41.9	176	-58.4	-35.5	0	0	0	111.9	H653 D654 L655 H657 M681 Q688 C689 I720	H653-H685 WeakPolarHBondContact O-CB 3.41Å; H653-H685 PolarHBondContact O-CD2 3.45Å; D654-H685 IonicContact OD1-NE2 3.65Å; L655-H685 PolarHBondContact O-CE1 2.96Å; L655-H685 PolarHBondContact O-ND1 3.07Å; H657-H685 AromaticContact CD2-CE1 4Å; H657-H685 AromaticContact CD2-NE2 3.71Å; M681-H685 VanDerWaalsContact C-CD2 3.45Å; M681-H685 PolarHBondContact O-CD2 3.22Å; M681-H685 PolarHBondContact O-N 3.07Å; M681-H685 PolarHBondContact O-ND1 3.16Å; M681-H685 PolarHBondContact O-NE2 3.31Å; H685-Q688 PolarHBondContact O-N 3.45Å; H685-C689 WeakPolarHBondContact O-CB 3.32Å; H685-C689 PolarHBondContact O-N 2.92Å; H685-I720 HydrophobicContact CB-CG2 4.01Å
686	F	97.3	Very high	91.5	Very high	16 Å²	16	34.8 Å²	34.8	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-43.4	173.7	174.6	-102.6	0	0	0	112.2	E682 H683 H684 Q688 C689 L690 I716 K717 I720	E682-F686 PolarHBondContact O-N 2.77Å; E682-F686 VanDerWaalsContact O-N 3.1Å; H683-F686 PolarHBondContact O-N 3.48Å; H684-F686 VanDerWaalsContact C-N 3.34Å; H684-F686 PolarHBondContact O-N 2.82Å; F686-Q688 PolarHBondContact O-N 2.95Å; F686-C689 WeakPolarHBondContact O-CB 3.14Å; F686-C689 PolarHBondContact O-N 2.69Å; F686-L690 HydrophobicContact CE1-CD2 4.32Å; F686-L690 HydrophobicContact CZ-CD2 4.49Å; F686-L690 WeakPolarHBondContact O-CB 3.4Å; F686-L690 PolarHBondContact O-N 3.33Å; F686-I716 HydrophobicContact CD2-CG2 4.14Å; F686-I716 HydrophobicContact CE2-CG2 4.15Å; F686-K717 HydrophobicContact CD1-CD 4.19Å; F686-K717 HydrophobicContact CD1-CG 4.1Å; F686-K717 HydrophobicContact CD2-CB 3.76Å; F686-K717 HydrophobicContact CD2-CG 4.06Å; F686-K717 HydrophobicContact CE1-CB 4.32Å; F686-K717 HydrophobicContact CE1-CD 3.88Å; F686-K717 HydrophobicContact CE1-CG 4.11Å; F686-K717 HydrophobicContact CE2-CB 3.48Å; F686-K717 VanDerWaalsContact CE2-CB 3.48Å; F686-K717 HydrophobicContact CE2-CG 4.08Å; F686-K717 HydrophobicContact CG-CB 4.29Å; F686-K717 HydrophobicContact CG-CG 4.07Å; F686-K717 HydrophobicContact CZ-CB 3.79Å; F686-K717 HydrophobicContact CZ-CD 4.07Å; F686-K717 HydrophobicContact CZ-CG 4.1Å; F686-I720 HydrophobicContact CB-CD1 4.41Å; F686-I720 HydrophobicContact CB-CG2 4.35Å; F686-I720 HydrophobicContact CD2-CD1 4.37Å
687	D	93.9	Very high	91.8	Very high	62 Å²	62	34 Å²	34	33%	0.332	19%	0.191	S	C	.	.	H	α-helix	trans	-67.3	-36.2	179.3	-73	-12	0	0	0	111.8	Y676 H683 H684 L690 M691	Y676-D687 PolarHBondContact OH-OD2 2.75Å; H683-D687 PolarHBondContact O-N 2.94Å; H684-D687 PolarHBondContact O-N 3.1Å; D687-L690 PolarHBondContact O-N 2.92Å; D687-M691 WeakPolarHBondContact O-CB 3.43Å; D687-M691 PolarHBondContact O-N 2.76Å
688	Q	94.3	Very high	92.9	Very high	36 Å²	36	28.7 Å²	28.7	17%	0.168	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-44.6	169.9	-69.8	-60.4	-51.7	0	0	112	L655 D656 H684 H685 F686 L690 M691 I692	L655-Q688 HydrophobicContact CB-CB 3.83Å; L655-Q688 HydrophobicContact CD1-CB 4.29Å; D656-Q688 HydrophobicContact CB-CG 3.98Å; H684-Q688 PolarHBondContact CE1-NE2 3.46Å; H684-Q688 WeakPolarHBondContact O-CG 3.32Å; H684-Q688 PolarHBondContact O-N 2.93Å; H685-Q688 PolarHBondContact O-N 3.45Å; F686-Q688 PolarHBondContact O-N 2.95Å; Q688-L690 VanDerWaalsContact C-N 3.34Å; Q688-L690 PolarHBondContact O-N 3.08Å; Q688-M691 PolarHBondContact O-N 3.42Å; Q688-I692 WeakPolarHBondContact O-CG1 3.31Å; Q688-I692 PolarHBondContact O-N 3.3Å
689	C	96.6	Very high	93.6	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-58	-47.3	175.4	-176.1	0	0	0	0	111.2	S652 L655 H685 F686 I692 L693 I720	S652-C689 WeakPolarHBondContact CB-SG 3.48Å; S652-C689 PolarHBondContact OG-SG 2.85Å; S652-C689 VanDerWaalsContact OG-SG 3.38Å; L655-C689 HydrophobicContact CD1-CB 4.03Å; H685-C689 WeakPolarHBondContact O-CB 3.32Å; H685-C689 PolarHBondContact O-N 2.92Å; F686-C689 WeakPolarHBondContact O-CB 3.14Å; F686-C689 PolarHBondContact O-N 2.69Å; C689-I692 PolarHBondContact O-N 3.35Å; C689-L693 WeakPolarHBondContact O-CG 3.26Å; C689-L693 PolarHBondContact O-N 3.4Å; C689-I720 HydrophobicContact CB-CD1 4.28Å
690	L	94.9	Very high	94	Very high	42 Å²	42	27.2 Å²	27.2	22%	0.22	15%	0.148	C	C	.	.	H	α-helix	trans	-66	-39.2	179.7	-175	61	0	0	0	112.2	F686 D687 Q688 L693 N694 L713	F686-L690 HydrophobicContact CE1-CD2 4.32Å; F686-L690 HydrophobicContact CZ-CD2 4.49Å; F686-L690 WeakPolarHBondContact O-CB 3.4Å; F686-L690 PolarHBondContact O-N 3.33Å; D687-L690 PolarHBondContact O-N 2.92Å; Q688-L690 VanDerWaalsContact C-N 3.34Å; Q688-L690 PolarHBondContact O-N 3.08Å; L690-L693 PolarHBondContact O-N 3.37Å; L690-N694 WeakPolarHBondContact CD1-ND2 3.34Å; L690-N694 WeakPolarHBondContact O-CB 3.4Å; L690-N694 PolarHBondContact O-N 3.06Å; L690-N694 PolarHBondContact O-ND2 3.25Å; L690-L713 HydrophobicContact CD1-CD1 3.86Å; L690-L713 HydrophobicContact CD1-CD2 3.9Å
691	M	92.6	Very high	94.2	Very high	41 Å²	41	27 Å²	27	20%	0.202	15%	0.147	C	C	.	.	H	α-helix	trans	-58	-48.6	173.7	-179.9	-164.1	68.4	0	0	110.9	A530 D687 Q688 N694 S695	A530-M691 HydrophobicContact CB-CE 3.59Å; D687-M691 WeakPolarHBondContact O-CB 3.43Å; D687-M691 PolarHBondContact O-N 2.76Å; Q688-M691 PolarHBondContact O-N 3.42Å; M691-N694 PolarHBondContact O-N 3.48Å; M691-S695 PolarHBondContact O-N 3.27Å; M691-S695 PolarHBondContact O-OG 2.86Å
692	I	94.8	Very high	94.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-42.3	179.2	-63.3	171.2	0	0	0	110.7	V602 N605 L655 Q688 C689 N694 S695 N698	V602-I692 HydrophobicContact CG2-CD1 4.31Å; V602-I692 HydrophobicContact CG2-CG2 4.31Å; N605-I692 HydrophobicContact CB-CD1 4.09Å; L655-I692 HydrophobicContact CD1-CD1 4.05Å; L655-I692 HydrophobicContact CD2-CD1 4.2Å; Q688-I692 WeakPolarHBondContact O-CG1 3.31Å; Q688-I692 PolarHBondContact O-N 3.3Å; C689-I692 PolarHBondContact O-N 3.35Å; I692-N694 VanDerWaalsContact C-N 3.26Å; I692-N694 PolarHBondContact O-N 3.31Å; I692-S695 WeakPolarHBondContact O-CB 3.06Å; I692-S695 PolarHBondContact O-N 3.39Å; I692-S695 VanDerWaalsContact O-N 3.1Å; I692-N698 HydrophobicContact CG2-CB 4.3Å; I692-N698 WeakPolarHBondContact O-CB 3.45Å
693	L	95.1	Very high	94.1	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-30.4	177.9	-75.6	170.4	0	0	0	113.4	C689 L690 Q699 I700 L701 L713 I716	C689-L693 WeakPolarHBondContact O-CG 3.26Å; C689-L693 PolarHBondContact O-N 3.4Å; L690-L693 PolarHBondContact O-N 3.37Å; L693-Q699 WeakPolarHBondContact O-CA 3.5Å; L693-Q699 WeakPolarHBondContact O-CB 3.45Å; L693-Q699 WeakPolarHBondContact O-CG 3.46Å; L693-I700 HydrophobicContact CD2-CD1 4.19Å; L693-I700 HydrophobicContact CD2-CG1 3.7Å; L693-L701 HydrophobicContact CD1-CD1 4.24Å; L693-L701 HydrophobicContact CD2-CD1 4.29Å; L693-L701 HydrophobicContact CD2-CG 4.25Å; L693-L713 HydrophobicContact CD1-CD2 4.16Å; L693-I716 HydrophobicContact CD1-CD1 4.48Å
694	N	90.9	Very high	94.2	Very high	91 Å²	91	32.2 Å²	32.2	49%	0.487	20%	0.195	S	C	.	.	H	α-helix	trans	-90.4	-6.6	175.9	-69.7	-44.8	0	0	0	113.5	L690 M691 I692 Y709	L690-N694 WeakPolarHBondContact CD1-ND2 3.34Å; L690-N694 WeakPolarHBondContact O-CB 3.4Å; L690-N694 PolarHBondContact O-N 3.06Å; L690-N694 PolarHBondContact O-ND2 3.25Å; M691-N694 PolarHBondContact O-N 3.48Å; I692-N694 VanDerWaalsContact C-N 3.26Å; I692-N694 PolarHBondContact O-N 3.31Å; N694-Y709 PolarHBondContact OD1-OH 2.87Å
695	S	90	Very high	94.3	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.021	21%	0.211	C	C	.	.	S	Bend	trans	-71.4	139.7	179.6	-63.3	0	0	0	0	110.4	S527 M691 I692 G697 N698	S527-S695 PolarHBondContact OG-OG 3.49Å; M691-S695 PolarHBondContact O-N 3.27Å; M691-S695 PolarHBondContact O-OG 2.86Å; I692-S695 WeakPolarHBondContact O-CB 3.06Å; I692-S695 PolarHBondContact O-N 3.39Å; I692-S695 VanDerWaalsContact O-N 3.1Å; S695-G697 PolarHBondContact O-N 2.8Å; S695-N698 PolarHBondContact O-N 3.49Å
696	P	88.9	Confident	94.2	Very high	92 Å²	92	39.4 Å²	39.4	60%	0.597	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	132.3	-177	25.4	-33.6	0	0	0	110.5	S527 N698	S527-P696 WeakPolarHBondContact OG-CD 3.49Å; P696-N698 VanDerWaalsContact C-N 3.28Å; P696-N698 PolarHBondContact O-N 3.14Å; P696-N698 PolarHBondContact O-ND2 3.33Å
697	G	89.9	Confident	94.2	Very high	21 Å²	21	43.9 Å²	43.9	22%	0.216	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-2	-179.6	0	0	0	0	0	115.8	V594 R597 S695	V594-G697 WeakPolarHBondContact CG1-O 3.32Å; R597-G697 WeakPolarHBondContact CD-O 3.25Å; R597-G697 PolarHBondContact NH1-O 3.44Å; S695-G697 PolarHBondContact O-N 2.8Å
698	N	94.1	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.259	C	S	.	.			trans	-109.7	-2.5	177	-68.3	-81.7	0	0	0	113.6	S531 R597 W598 S601 I692 S695 P696 I700	S531-N698 PolarHBondContact OG-ND2 3.06Å; R597-N698 VanDerWaalsContact C-OD1 3.32Å; R597-N698 PolarHBondContact O-OD1 3.3Å; W598-N698 WeakPolarHBondContact CA-OD1 3.06Å; W598-N698 HydrophobicContact CB-CB 4.44Å; W598-N698 PolarHBondContact N-OD1 3.03Å; S601-N698 VanDerWaalsContact CB-OD1 3.32Å; S601-N698 WeakPolarHBondContact CB-OD1 3.29Å; S601-N698 PolarHBondContact OG-OD1 2.95Å; I692-N698 HydrophobicContact CG2-CB 4.3Å; I692-N698 WeakPolarHBondContact O-CB 3.45Å; S695-N698 PolarHBondContact O-N 3.49Å; P696-N698 VanDerWaalsContact C-N 3.28Å; P696-N698 PolarHBondContact O-N 3.14Å; P696-N698 PolarHBondContact O-ND2 3.33Å; N698-I700 VanDerWaalsContact C-N 3.28Å; N698-I700 PolarHBondContact O-N 2.93Å
699	Q	95.5	Very high	94.4	Very high	81 Å²	81	45 Å²	45	38%	0.379	26%	0.26	S	S	.	.			trans	-73.3	71.4	-172.3	-53.4	129.1	130.2	0	0	112.7	L693 L701 S702	L693-Q699 WeakPolarHBondContact O-CA 3.5Å; L693-Q699 WeakPolarHBondContact O-CB 3.45Å; L693-Q699 WeakPolarHBondContact O-CG 3.46Å; Q699-L701 PolarHBondContact O-N 3.25Å; Q699-L701 VanDerWaalsContact O-N 3.14Å; Q699-S702 WeakPolarHBondContact O-CB 3.37Å; Q699-S702 PolarHBondContact O-N 2.89Å; Q699-S702 VanDerWaalsContact O-N 3.14Å; Q699-S702 PolarHBondContact O-OG 3.08Å
700	I	97.3	Very high	94.4	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.4	-179.8	56.4	164.5	0	0	0	113.6	V594 L595 W598 I648 L693 N698	V594-I700 HydrophobicContact CG1-CG2 3.93Å; L595-I700 HydrophobicContact CB-CG2 4.34Å; L595-I700 HydrophobicContact CD1-CG2 4.15Å; W598-I700 HydrophobicContact CB-CG2 3.62Å; W598-I700 HydrophobicContact CD2-CD1 3.63Å; W598-I700 HydrophobicContact CD2-CG1 4.26Å; W598-I700 HydrophobicContact CD2-CG2 4.35Å; W598-I700 HydrophobicContact CE3-CD1 3.82Å; W598-I700 HydrophobicContact CG-CD1 4.1Å; W598-I700 HydrophobicContact CG-CG1 4.21Å; W598-I700 HydrophobicContact CG-CG2 3.88Å; W598-I700 HydrophobicContact CH2-CD1 4.31Å; W598-I700 HydrophobicContact CZ2-CD1 4.12Å; W598-I700 HydrophobicContact CZ3-CD1 4.16Å; I648-I700 HydrophobicContact CD1-CD1 3.74Å; I648-I700 HydrophobicContact CG1-CD1 4.08Å; L693-I700 HydrophobicContact CD2-CD1 4.19Å; L693-I700 HydrophobicContact CD2-CG1 3.7Å; N698-I700 VanDerWaalsContact C-N 3.28Å; N698-I700 PolarHBondContact O-N 2.93Å
701	L	97.1	Very high	94.5	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.031	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	5.5	178.5	-56.1	-177.8	0	0	0	113.5	L644 I648 L693 Q699 G703 L704 Y709 T712	L644-L701 HydrophobicContact CD1-CD2 4.46Å; L644-L701 HydrophobicContact CD2-CD2 3.76Å; L644-L701 HydrophobicContact CG-CD2 4.31Å; I648-L701 HydrophobicContact CD1-CD2 3.84Å; L693-L701 HydrophobicContact CD1-CD1 4.24Å; L693-L701 HydrophobicContact CD2-CD1 4.29Å; L693-L701 HydrophobicContact CD2-CG 4.25Å; Q699-L701 PolarHBondContact O-N 3.25Å; Q699-L701 VanDerWaalsContact O-N 3.14Å; L701-G703 PolarHBondContact O-N 3.36Å; L701-G703 VanDerWaalsContact O-N 3.08Å; L701-L704 HydrophobicContact CD2-CD1 4.44Å; L701-L704 HydrophobicContact CD2-CD2 4.35Å; L701-L704 WeakPolarHBondContact O-CB 3.29Å; L701-L704 PolarHBondContact O-N 2.82Å; L701-L704 VanDerWaalsContact O-N 3.1Å; L701-Y709 HydrophobicContact CB-CD2 3.82Å; L701-Y709 HydrophobicContact CB-CE2 3.91Å; L701-Y709 HydrophobicContact CD1-CD2 4.04Å; L701-Y709 HydrophobicContact CD1-CE2 3.89Å; L701-T712 HydrophobicContact CD1-CG2 3.99Å; L701-T712 HydrophobicContact CD2-CG2 4.27Å
702	S	94.6	Very high	94.7	Very high	91 Å²	91	49.5 Å²	49.5	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16.2	-175.7	69.9	0	0	0	0	114.5	Q699	Q699-S702 WeakPolarHBondContact O-CB 3.37Å; Q699-S702 PolarHBondContact O-N 2.89Å; Q699-S702 VanDerWaalsContact O-N 3.14Å; Q699-S702 PolarHBondContact O-OG 3.08Å
703	G	92.9	Very high	94.9	Very high	49 Å²	49	50.7 Å²	50.7	51%	0.505	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.2	177.2	0	0	0	0	0	114.4	L701	L701-G703 PolarHBondContact O-N 3.36Å; L701-G703 VanDerWaalsContact O-N 3.08Å
704	L	96.3	Very high	95	Very high	20 Å²	20	56.6 Å²	56.6	11%	0.105	31%	0.314	C	S	.	.	S	Bend	trans	-80.1	152	-179.8	-82.9	63.4	0	0	0	111	F588 L641 L644 L701 E708	F588-L704 HydrophobicContact CB-CD1 3.91Å; F588-L704 HydrophobicContact CD1-CD1 3.66Å; F588-L704 HydrophobicContact CD1-CG 4.16Å; F588-L704 HydrophobicContact CG-CD1 3.99Å; L641-L704 HydrophobicContact CD2-CD2 4Å; L644-L704 HydrophobicContact CD2-CD2 4.4Å; L701-L704 HydrophobicContact CD2-CD1 4.44Å; L701-L704 HydrophobicContact CD2-CD2 4.35Å; L701-L704 WeakPolarHBondContact O-CB 3.29Å; L701-L704 PolarHBondContact O-N 2.82Å; L701-L704 VanDerWaalsContact O-N 3.1Å; L704-E708 HydrophobicContact CB-CB 4Å; L704-E708 HydrophobicContact CD2-CB 3.98Å; L704-E708 HydrophobicContact CG-CB 4.03Å
705	S	96.9	Very high	95.3	Very high	58 Å²	58	53.1 Å²	53.1	41%	0.406	30%	0.295	S	S	.	.			trans	-66.6	162.2	163.7	68.2	0	0	0	0	111.2	E707 E708 Y709	S705-E707 VanDerWaalsContact C-N 3.26Å; S705-E707 PolarHBondContact O-N 3.15Å; S705-E708 VanDerWaalsContact CB-OE2 3.3Å; S705-E708 WeakPolarHBondContact CB-OE2 3.5Å; S705-E708 PolarHBondContact N-OE2 2.9Å; S705-E708 PolarHBondContact O-N 3.31Å; S705-E708 VanDerWaalsContact OG-CD 3.27Å; S705-E708 VanDerWaalsContact OG-CG 3.23Å; S705-E708 WeakPolarHBondContact OG-CG 3.43Å; S705-E708 PolarHBondContact OG-N 3.03Å; S705-E708 PolarHBondContact OG-OE2 3.49Å; S705-Y709 WeakPolarHBondContact O-CB 3.46Å; S705-Y709 PolarHBondContact O-N 2.95Å
706	I	94.9	Very high	95.7	Very high	109 Å²	109	53 Å²	53	56%	0.559	29%	0.294	S	S	*	.	H	α-helix	trans	-60.3	-34.1	-179.4	-172.4	58.5	0	0	0	113.2	K710	I706-K710 VanDerWaalsContact O-CG 3.28Å; I706-K710 WeakPolarHBondContact O-CG 3.44Å; I706-K710 PolarHBondContact O-N 3.32Å
707	E	96.1	Very high	96.2	Very high	110 Å²	110	52.7 Å²	52.7	51%	0.514	28%	0.284	S	S	.	.	H	α-helix	trans	-75.9	-38.5	179.2	-66	-54.4	122.2	0	0	112	S705 K710 T711	S705-E707 VanDerWaalsContact C-N 3.26Å; S705-E707 PolarHBondContact O-N 3.15Å; E707-K710 IonicContact OE1-NZ 2.58Å; E707-K710 PolarHBondContact OE1-NZ 3.33Å; E707-T711 WeakPolarHBondContact O-CB 3.07Å; E707-T711 PolarHBondContact O-N 3.48Å; E707-T711 PolarHBondContact O-OG1 2.76Å
708	E	97.2	Very high	96.5	Very high	71 Å²	71	54.3 Å²	54.3	33%	0.332	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-44.8	171.4	-68	167.7	132.7	0	0	110.6	L641 L704 S705 K710 T711 T712	L641-E708 HydrophobicContact CD1-CB 4.33Å; L641-E708 HydrophobicContact CD1-CG 3.98Å; L641-E708 HydrophobicContact CD2-CB 4.19Å; L641-E708 HydrophobicContact CD2-CG 4.47Å; L704-E708 HydrophobicContact CB-CB 4Å; L704-E708 HydrophobicContact CD2-CB 3.98Å; L704-E708 HydrophobicContact CG-CB 4.03Å; S705-E708 VanDerWaalsContact CB-OE2 3.3Å; S705-E708 WeakPolarHBondContact CB-OE2 3.5Å; S705-E708 PolarHBondContact N-OE2 2.9Å; S705-E708 PolarHBondContact O-N 3.31Å; S705-E708 VanDerWaalsContact OG-CD 3.27Å; S705-E708 VanDerWaalsContact OG-CG 3.23Å; S705-E708 WeakPolarHBondContact OG-CG 3.43Å; S705-E708 PolarHBondContact OG-N 3.03Å; S705-E708 PolarHBondContact OG-OE2 3.49Å; E708-K710 PolarHBondContact O-N 3.21Å; E708-T711 PolarHBondContact O-N 3.17Å; E708-T711 VanDerWaalsContact O-N 3.13Å; E708-T712 WeakPolarHBondContact O-CB 3.3Å; E708-T712 PolarHBondContact O-N 3.14Å; E708-T712 PolarHBondContact O-OG1 3.12Å; E708-T712 VanDerWaalsContact O-OG1 3.08Å
709	Y	96.6	Very high	96.7	Very high	51 Å²	51	54.5 Å²	54.5	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-48.2	177.4	-178.2	-104.5	0	0	0	112.2	N694 L701 S705 T711 T712 L713	N694-Y709 PolarHBondContact OD1-OH 2.87Å; L701-Y709 HydrophobicContact CB-CD2 3.82Å; L701-Y709 HydrophobicContact CB-CE2 3.91Å; L701-Y709 HydrophobicContact CD1-CD2 4.04Å; L701-Y709 HydrophobicContact CD1-CE2 3.89Å; S705-Y709 WeakPolarHBondContact O-CB 3.46Å; S705-Y709 PolarHBondContact O-N 2.95Å; Y709-T711 VanDerWaalsContact C-N 3.32Å; Y709-T711 PolarHBondContact O-N 3.08Å; Y709-T712 PolarHBondContact O-N 3.04Å; Y709-L713 HydrophobicContact CD1-CD1 4.02Å; Y709-L713 HydrophobicContact CE1-CD1 3.38Å; Y709-L713 HydrophobicContact CE1-CG 4.16Å; Y709-L713 HydrophobicContact CE2-CD1 4.26Å; Y709-L713 HydrophobicContact CE2-CG 4.3Å; Y709-L713 WeakPolarHBondContact O-CB 3.22Å; Y709-L713 WeakPolarHBondContact O-CG 3.3Å; Y709-L713 PolarHBondContact O-N 3.2Å
710	K	95.3	Very high	96.9	Very high	111 Å²	111	50.6 Å²	50.6	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-59.4	-42.8	175.1	-74.1	171	-173.8	166.5	0	111.8	I706 E707 E708 K714	I706-K710 VanDerWaalsContact O-CG 3.28Å; I706-K710 WeakPolarHBondContact O-CG 3.44Å; I706-K710 PolarHBondContact O-N 3.32Å; E707-K710 IonicContact OE1-NZ 2.58Å; E707-K710 PolarHBondContact OE1-NZ 3.33Å; E708-K710 PolarHBondContact O-N 3.21Å; K710-K714 WeakPolarHBondContact O-CB 3.47Å; K710-K714 PolarHBondContact O-N 2.77Å
711	T	97.1	Very high	96.8	Very high	67 Å²	67	51.8 Å²	51.8	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-47.7	-180	-58	0	0	0	0	111.1	E707 E708 Y709 L713 K714 I715	E707-T711 WeakPolarHBondContact O-CB 3.07Å; E707-T711 PolarHBondContact O-N 3.48Å; E707-T711 PolarHBondContact O-OG1 2.76Å; E708-T711 PolarHBondContact O-N 3.17Å; E708-T711 VanDerWaalsContact O-N 3.13Å; Y709-T711 VanDerWaalsContact C-N 3.32Å; Y709-T711 PolarHBondContact O-N 3.08Å; T711-L713 PolarHBondContact O-N 3.25Å; T711-K714 WeakPolarHBondContact O-CB 3.47Å; T711-K714 PolarHBondContact O-N 2.95Å; T711-I715 HydrophobicContact CG2-CD1 4.03Å; T711-I715 WeakPolarHBondContact O-CG1 3.49Å; T711-I715 PolarHBondContact O-N 3.19Å
712	T	97.8	Very high	96.8	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-46.4	176.3	-62	0	0	0	0	111.3	L644 A645 L701 E708 Y709 K714 I715 I716	L644-T712 HydrophobicContact CD2-CG2 4.37Å; L644-T712 HydrophobicContact CG-CG2 4.47Å; A645-T712 HydrophobicContact CB-CG2 4.18Å; L701-T712 HydrophobicContact CD1-CG2 3.99Å; L701-T712 HydrophobicContact CD2-CG2 4.27Å; E708-T712 WeakPolarHBondContact O-CB 3.3Å; E708-T712 PolarHBondContact O-N 3.14Å; E708-T712 PolarHBondContact O-OG1 3.12Å; E708-T712 VanDerWaalsContact O-OG1 3.08Å; Y709-T712 PolarHBondContact O-N 3.04Å; T712-K714 VanDerWaalsContact C-N 3.34Å; T712-K714 PolarHBondContact O-N 2.69Å; T712-I715 PolarHBondContact O-N 3.13Å; T712-I716 HydrophobicContact CG2-CD1 3.82Å; T712-I716 HydrophobicContact CG2-CG1 4.44Å; T712-I716 VanDerWaalsContact O-CG1 3.3Å; T712-I716 WeakPolarHBondContact O-CG1 3.38Å; T712-I716 PolarHBondContact O-N 2.87Å
713	L	97.6	Very high	96.9	Very high	26 Å²	26	48.2 Å²	48.2	14%	0.136	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-39.1	176.6	-77.2	-172.3	0	0	0	112.8	L690 L693 Y709 T711 I715 I716 K717	L690-L713 HydrophobicContact CD1-CD1 3.86Å; L690-L713 HydrophobicContact CD1-CD2 3.9Å; L693-L713 HydrophobicContact CD1-CD2 4.16Å; Y709-L713 HydrophobicContact CD1-CD1 4.02Å; Y709-L713 HydrophobicContact CE1-CD1 3.38Å; Y709-L713 HydrophobicContact CE1-CG 4.16Å; Y709-L713 HydrophobicContact CE2-CD1 4.26Å; Y709-L713 HydrophobicContact CE2-CG 4.3Å; Y709-L713 WeakPolarHBondContact O-CB 3.22Å; Y709-L713 WeakPolarHBondContact O-CG 3.3Å; Y709-L713 PolarHBondContact O-N 3.2Å; T711-L713 PolarHBondContact O-N 3.25Å; L713-I715 VanDerWaalsContact C-N 3.34Å; L713-I716 HydrophobicContact CD2-CD1 4.39Å; L713-I716 PolarHBondContact O-N 3.02Å; L713-K717 WeakPolarHBondContact O-CB 3.21Å; L713-K717 PolarHBondContact O-N 2.83Å
714	K	97.7	Very high	97.1	Very high	128 Å²	128	46.9 Å²	46.9	56%	0.557	23%	0.232	S	C	*	.	H	α-helix	trans	-60.2	-45.9	175.1	-177.5	-176.5	174.1	-172.2	0	110.9	K710 T711 T712 K717 Q718	K710-K714 WeakPolarHBondContact O-CB 3.47Å; K710-K714 PolarHBondContact O-N 2.77Å; T711-K714 WeakPolarHBondContact O-CB 3.47Å; T711-K714 PolarHBondContact O-N 2.95Å; T712-K714 VanDerWaalsContact C-N 3.34Å; T712-K714 PolarHBondContact O-N 2.69Å; K714-K717 PolarHBondContact O-N 3.41Å; K714-Q718 VanDerWaalsContact O-CG 3.32Å; K714-Q718 WeakPolarHBondContact O-CG 3.28Å; K714-Q718 PolarHBondContact O-N 2.93Å
715	I	98.4	Very high	96.9	Very high	18 Å²	18	48.7 Å²	48.7	9%	0.092	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-43.1	179.4	-61.1	162.9	0	0	0	110.6	E642 A645 T711 T712 L713 K717 Q718 A719 L756	E642-I715 HydrophobicContact CG-CD1 3.9Å; A645-I715 HydrophobicContact CB-CB 3.63Å; A645-I715 HydrophobicContact CB-CG2 3.43Å; A645-I715 VanDerWaalsContact CB-CG2 3.43Å; T711-I715 HydrophobicContact CG2-CD1 4.03Å; T711-I715 WeakPolarHBondContact O-CG1 3.49Å; T711-I715 PolarHBondContact O-N 3.19Å; T712-I715 PolarHBondContact O-N 3.13Å; L713-I715 VanDerWaalsContact C-N 3.34Å; I715-K717 VanDerWaalsContact C-N 3.31Å; I715-K717 PolarHBondContact O-N 3.48Å; I715-Q718 PolarHBondContact O-N 3.43Å; I715-A719 VanDerWaalsContact O-CB 3.22Å; I715-A719 WeakPolarHBondContact O-CB 3.46Å; I715-A719 PolarHBondContact O-N 3.36Å; I715-L756 HydrophobicContact CG2-CD1 4.17Å
716	I	98.6	Very high	96.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-47.1	175	-69.3	164.9	0	0	0	110.2	A645 I648 A649 F686 L693 T712 L713 Q718 A719 I720	A645-I716 HydrophobicContact CB-CG1 3.9Å; I648-I716 HydrophobicContact CB-CD1 4.09Å; I648-I716 HydrophobicContact CB-CG1 4.35Å; I648-I716 HydrophobicContact CD1-CD1 4.28Å; I648-I716 HydrophobicContact CG2-CD1 3.61Å; I648-I716 HydrophobicContact CG2-CG1 4.11Å; A649-I716 HydrophobicContact CB-CG2 4.45Å; F686-I716 HydrophobicContact CD2-CG2 4.14Å; F686-I716 HydrophobicContact CE2-CG2 4.15Å; L693-I716 HydrophobicContact CD1-CD1 4.48Å; T712-I716 HydrophobicContact CG2-CD1 3.82Å; T712-I716 HydrophobicContact CG2-CG1 4.44Å; T712-I716 VanDerWaalsContact O-CG1 3.3Å; T712-I716 WeakPolarHBondContact O-CG1 3.38Å; T712-I716 PolarHBondContact O-N 2.87Å; L713-I716 HydrophobicContact CD2-CD1 4.39Å; L713-I716 PolarHBondContact O-N 3.02Å; I716-Q718 PolarHBondContact O-N 3.07Å; I716-A719 PolarHBondContact O-N 2.9Å; I716-I720 HydrophobicContact CG2-CD1 3.79Å; I716-I720 HydrophobicContact CG2-CG1 4.36Å; I716-I720 WeakPolarHBondContact O-CG1 3.41Å; I716-I720 PolarHBondContact O-N 3.16Å
717	K	98.1	Very high	96.5	Very high	86 Å²	86	45.5 Å²	45.5	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-59.3	-48.4	178	-171.5	172.3	-178.9	170.6	0	111.7	F686 L713 K714 I715 A719 L721	F686-K717 HydrophobicContact CD1-CD 4.19Å; F686-K717 HydrophobicContact CD1-CG 4.1Å; F686-K717 HydrophobicContact CD2-CB 3.76Å; F686-K717 HydrophobicContact CD2-CG 4.06Å; F686-K717 HydrophobicContact CE1-CB 4.32Å; F686-K717 HydrophobicContact CE1-CD 3.88Å; F686-K717 HydrophobicContact CE1-CG 4.11Å; F686-K717 HydrophobicContact CE2-CB 3.48Å; F686-K717 VanDerWaalsContact CE2-CB 3.48Å; F686-K717 HydrophobicContact CE2-CG 4.08Å; F686-K717 HydrophobicContact CG-CB 4.29Å; F686-K717 HydrophobicContact CG-CG 4.07Å; F686-K717 HydrophobicContact CZ-CB 3.79Å; F686-K717 HydrophobicContact CZ-CD 4.07Å; F686-K717 HydrophobicContact CZ-CG 4.1Å; L713-K717 WeakPolarHBondContact O-CB 3.21Å; L713-K717 PolarHBondContact O-N 2.83Å; K714-K717 PolarHBondContact O-N 3.41Å; I715-K717 VanDerWaalsContact C-N 3.31Å; I715-K717 PolarHBondContact O-N 3.48Å; K717-A719 VanDerWaalsContact C-N 3.34Å; K717-A719 PolarHBondContact O-N 3.33Å; K717-L721 HydrophobicContact CG-CD1 3.97Å; K717-L721 HydrophobicContact CG-CG 4.41Å; K717-L721 WeakPolarHBondContact O-CB 3.22Å; K717-L721 VanDerWaalsContact O-CG 3.24Å; K717-L721 WeakPolarHBondContact O-CG 3.47Å; K717-L721 PolarHBondContact O-N 3.43Å
718	Q	97.3	Very high	96.5	Very high	54 Å²	54	40.4 Å²	40.4	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-41	179.4	-72.1	174.5	-36	0	0	111.9	K714 I715 I716 A722 E753	K714-Q718 VanDerWaalsContact O-CG 3.32Å; K714-Q718 WeakPolarHBondContact O-CG 3.28Å; K714-Q718 PolarHBondContact O-N 2.93Å; I715-Q718 PolarHBondContact O-N 3.43Å; I716-Q718 PolarHBondContact O-N 3.07Å; Q718-A722 VanDerWaalsContact O-CB 3.25Å; Q718-A722 WeakPolarHBondContact O-CB 3.5Å; Q718-A722 PolarHBondContact O-N 3.41Å; Q718-E753 PolarHBondContact NE2-OE1 3.43Å; Q718-E753 PolarHBondContact NE2-OE2 3.43Å
719	A	98.2	Very high	96.3	Very high	4 Å²	4	41 Å²	41	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-43.8	179.2	0	0	0	0	0	112.7	L646 A649 I715 I716 K717 A722 M760	L646-A719 HydrophobicContact CD2-CB 4.42Å; A649-A719 HydrophobicContact CB-CB 3.48Å; A649-A719 VanDerWaalsContact CB-CB 3.48Å; I715-A719 VanDerWaalsContact O-CB 3.22Å; I715-A719 WeakPolarHBondContact O-CB 3.46Å; I715-A719 PolarHBondContact O-N 3.36Å; I716-A719 PolarHBondContact O-N 2.9Å; K717-A719 VanDerWaalsContact C-N 3.34Å; K717-A719 PolarHBondContact O-N 3.33Å; A719-A722 PolarHBondContact O-N 2.9Å; A719-M760 HydrophobicContact CB-CE 4.39Å; A719-M760 HydrophobicContact CB-CG 3.71Å; A719-M760 HydrophobicContact CB-SD 4.11Å
720	I	98.5	Very high	96.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-46.3	176.2	-66.3	178.6	0	0	0	110.4	A649 H653 E682 H685 F686 C689 I716 A722 T723	A649-I720 HydrophobicContact CB-CG1 3.97Å; H653-I720 HydrophobicContact CB-CG1 4.16Å; H653-I720 HydrophobicContact CB-CG2 4.42Å; E682-I720 WeakPolarHBondContact O-CG2 3.3Å; H685-I720 HydrophobicContact CB-CG2 4.01Å; F686-I720 HydrophobicContact CB-CD1 4.41Å; F686-I720 HydrophobicContact CB-CG2 4.35Å; F686-I720 HydrophobicContact CD2-CD1 4.37Å; C689-I720 HydrophobicContact CB-CD1 4.28Å; I716-I720 HydrophobicContact CG2-CD1 3.79Å; I716-I720 HydrophobicContact CG2-CG1 4.36Å; I716-I720 WeakPolarHBondContact O-CG1 3.41Å; I716-I720 PolarHBondContact O-N 3.16Å; I720-A722 PolarHBondContact O-N 3.39Å; I720-T723 PolarHBondContact O-N 2.77Å; I720-T723 VanDerWaalsContact O-N 3.09Å; I720-T723 PolarHBondContact O-OG1 3.34Å
721	L	96.7	Very high	96.2	Very high	29 Å²	29	46 Å²	46	15%	0.152	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-28.9	177.2	-66.8	178.2	0	0	0	112.5	E682 K717 T723 D724 L727	E682-L721 HydrophobicContact CB-CD2 3.82Å; K717-L721 HydrophobicContact CG-CD1 3.97Å; K717-L721 HydrophobicContact CG-CG 4.41Å; K717-L721 WeakPolarHBondContact O-CB 3.22Å; K717-L721 VanDerWaalsContact O-CG 3.24Å; K717-L721 WeakPolarHBondContact O-CG 3.47Å; K717-L721 PolarHBondContact O-N 3.43Å; L721-T723 PolarHBondContact O-N 3.19Å; L721-D724 WeakPolarHBondContact O-CB 3.42Å; L721-D724 PolarHBondContact O-N 3.3Å; L721-L727 WeakPolarHBondContact O-CD1 3.34Å
722	A	95.9	Very high	96.1	Very high	10 Å²	10	45.4 Å²	45.4	8%	0.083	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.6	177.4	0	0	0	0	0	114.6	Q718 A719 I720 A757 T761	Q718-A722 VanDerWaalsContact O-CB 3.25Å; Q718-A722 WeakPolarHBondContact O-CB 3.5Å; Q718-A722 PolarHBondContact O-N 3.41Å; A719-A722 PolarHBondContact O-N 2.9Å; I720-A722 PolarHBondContact O-N 3.39Å; A722-A757 HydrophobicContact CB-CB 3.53Å; A722-T761 PolarHBondContact O-OG1 3.04Å
723	T	96.8	Very high	96	Very high	11 Å²	11	47.4 Å²	47.4	7%	0.067	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.7	173.2	66.3	0	0	0	0	112.1	H653 I720 L721 L725 M760	H653-T723 HydrophobicContact CB-CG2 3.98Å; I720-T723 PolarHBondContact O-N 2.77Å; I720-T723 VanDerWaalsContact O-N 3.09Å; I720-T723 PolarHBondContact O-OG1 3.34Å; L721-T723 PolarHBondContact O-N 3.19Å; T723-L725 PolarHBondContact O-N 3.34Å; T723-L725 VanDerWaalsContact O-N 3.07Å; T723-M760 HydrophobicContact CG2-CE 4.03Å
724	D	96.3	Very high	96	Very high	22 Å²	22	50.3 Å²	50.3	12%	0.118	25%	0.254	C	S	.	.			trans	-64.4	112.3	168.6	-176.8	-8.3	0	0	0	110.2	S679 E682 L721 A726 L727 Y728	S679-D724 WeakPolarHBondContact CB-OD2 3.18Å; S679-D724 PolarHBondContact OG-OD2 2.82Å; E682-D724 HydrophobicContact CG-CB 3.98Å; L721-D724 WeakPolarHBondContact O-CB 3.42Å; L721-D724 PolarHBondContact O-N 3.3Å; D724-A726 PolarHBondContact O-N 3.47Å; D724-A726 VanDerWaalsContact O-N 3.1Å; D724-A726 VanDerWaalsContact OD1-CB 3.27Å; D724-A726 WeakPolarHBondContact OD1-CB 3.49Å; D724-A726 PolarHBondContact OD1-N 3.42Å; D724-L727 HydrophobicContact CB-CB 4.39Å; D724-L727 HydrophobicContact CB-CD1 4.27Å; D724-L727 HydrophobicContact CB-CG 4.26Å; D724-L727 WeakPolarHBondContact O-CB 3.46Å; D724-L727 PolarHBondContact O-N 2.93Å; D724-Y728 PolarHBondContact O-N 3.45Å; D724-Y728 VanDerWaalsContact O-N 3.08Å
725	L	92.1	Very high	95.9	Very high	57 Å²	57	44.3 Å²	44.3	30%	0.298	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-24.7	-177.8	-157.2	66.7	0	0	0	112.8	T723 Y728 I729 T761 L765 F820 I824	T723-L725 PolarHBondContact O-N 3.34Å; T723-L725 VanDerWaalsContact O-N 3.07Å; L725-Y728 HydrophobicContact CD1-CD1 3.59Å; L725-Y728 HydrophobicContact CD1-CE1 4.32Å; L725-Y728 HydrophobicContact CD1-CG 4.18Å; L725-Y728 HydrophobicContact CG-CD1 4.25Å; L725-Y728 PolarHBondContact O-N 3.15Å; L725-I729 VanDerWaalsContact O-CG1 3.27Å; L725-I729 WeakPolarHBondContact O-CG1 3.35Å; L725-I729 PolarHBondContact O-N 3.03Å; L725-T761 HydrophobicContact CD1-CG2 4.33Å; L725-L765 HydrophobicContact CD1-CD1 4.31Å; L725-F820 HydrophobicContact CD2-CE2 4.48Å; L725-I824 HydrophobicContact CD1-CG2 3.96Å; L725-I824 HydrophobicContact CD2-CD1 4.44Å
726	A	92.2	Very high	95.9	Very high	62 Å²	62	44.6 Å²	44.6	51%	0.512	23%	0.229	S	C	.	.	H	α-helix	trans	-66.8	-38.8	173.6	0	0	0	0	0	111.9	D724 K730	D724-A726 PolarHBondContact O-N 3.47Å; D724-A726 VanDerWaalsContact O-N 3.1Å; D724-A726 VanDerWaalsContact OD1-CB 3.27Å; D724-A726 WeakPolarHBondContact OD1-CB 3.49Å; D724-A726 PolarHBondContact OD1-N 3.42Å; A726-K730 PolarHBondContact O-N 3.05Å
727	L	92.6	Very high	95.8	Very high	39 Å²	39	47.9 Å²	47.9	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-71.3	-38.6	174.9	-69.1	-179.7	0	0	0	111.5	L721 D724 K730 R731	L721-L727 WeakPolarHBondContact O-CD1 3.34Å; D724-L727 HydrophobicContact CB-CB 4.39Å; D724-L727 HydrophobicContact CB-CD1 4.27Å; D724-L727 HydrophobicContact CB-CG 4.26Å; D724-L727 WeakPolarHBondContact O-CB 3.46Å; D724-L727 PolarHBondContact O-N 2.93Å; L727-K730 WeakPolarHBondContact O-CB 3.29Å; L727-K730 PolarHBondContact O-N 3.32Å; L727-R731 WeakPolarHBondContact O-CG 3.5Å; L727-R731 PolarHBondContact O-N 2.93Å
728	Y	94.9	Very high	95.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-56.3	-51.1	170.9	161.2	-100.8	0	0	0	111.4	D724 L725 K730 R731 R732 M758 T761 I824 L828	D724-Y728 PolarHBondContact O-N 3.45Å; D724-Y728 VanDerWaalsContact O-N 3.08Å; L725-Y728 HydrophobicContact CD1-CD1 3.59Å; L725-Y728 HydrophobicContact CD1-CE1 4.32Å; L725-Y728 HydrophobicContact CD1-CG 4.18Å; L725-Y728 HydrophobicContact CG-CD1 4.25Å; L725-Y728 PolarHBondContact O-N 3.15Å; Y728-K730 PolarHBondContact O-N 3.31Å; Y728-R731 PolarHBondContact O-N 3.46Å; Y728-R731 VanDerWaalsContact O-N 3.09Å; Y728-R732 HydrophobicContact CD2-CB 4.18Å; Y728-R732 HydrophobicContact CE2-CB 3.72Å; Y728-R732 VanDerWaalsContact CZ-CD 3.49Å; Y728-R732 VanDerWaalsContact O-CB 3.31Å; Y728-R732 WeakPolarHBondContact O-CB 3.44Å; Y728-R732 PolarHBondContact O-N 3.09Å; Y728-R732 WeakPolarHBondContact OH-CD 3.33Å; Y728-M758 HydrophobicContact CD2-CE 3.74Å; Y728-M758 HydrophobicContact CD2-SD 3.79Å; Y728-M758 HydrophobicContact CE2-CE 4.38Å; Y728-M758 HydrophobicContact CE2-SD 3.82Å; Y728-T761 HydrophobicContact CD2-CG2 3.85Å; Y728-T761 HydrophobicContact CE2-CG2 4.42Å; Y728-T761 HydrophobicContact CG-CG2 3.94Å; Y728-I824 HydrophobicContact CE1-CD1 4.29Å; Y728-I824 HydrophobicContact CE1-CG2 3.88Å; Y728-I824 PolarHBondContact OH-O 3.47Å; Y728-I824 VanDerWaalsContact OH-O 3.13Å; Y728-L828 HydrophobicContact CE2-CD1 4.22Å; Y728-L828 HydrophobicContact CE2-CD2 4.19Å
729	I	94.6	Very high	95.6	Very high	85 Å²	85	43.3 Å²	43.3	44%	0.436	23%	0.225	S	C	.	.	H	α-helix	trans	-58.8	-36.5	-180	-70.5	165.4	0	0	0	111.4	L725 I824	L725-I729 VanDerWaalsContact O-CG1 3.27Å; L725-I729 WeakPolarHBondContact O-CG1 3.35Å; L725-I729 PolarHBondContact O-N 3.03Å; I729-I824 HydrophobicContact CD1-CD1 4.34Å; I729-I824 HydrophobicContact CG1-CD1 4.35Å
730	K	94.6	Very high	95.5	Very high	174 Å²	174	51.2 Å²	51.2	76%	0.757	25%	0.254	S	S	*	.	H	α-helix	trans	-68.5	-38.2	177.6	-172	179.3	179.1	-179	0	112.8	A726 L727 Y728	A726-K730 PolarHBondContact O-N 3.05Å; L727-K730 WeakPolarHBondContact O-CB 3.29Å; L727-K730 PolarHBondContact O-N 3.32Å; Y728-K730 PolarHBondContact O-N 3.31Å
731	R	94.5	Very high	95.3	Very high	93 Å²	93	56.6 Å²	56.6	35%	0.351	28%	0.277	S	S	.	.	H	α-helix	trans	-95.4	-24.4	-173	-65.8	-174.3	-176.4	-156.1	0.3	114.3	L727 Y728 G733 E734 E753 L754 M758	L727-R731 WeakPolarHBondContact O-CG 3.5Å; L727-R731 PolarHBondContact O-N 2.93Å; Y728-R731 PolarHBondContact O-N 3.46Å; Y728-R731 VanDerWaalsContact O-N 3.09Å; R731-G733 VanDerWaalsContact C-N 3.25Å; R731-G733 PolarHBondContact O-N 3.18Å; R731-G733 VanDerWaalsContact O-N 3.16Å; R731-E734 PolarHBondContact O-N 3.25Å; R731-E753 IonicContact NH1-OE1 2.79Å; R731-E753 PolarHBondContact NH1-OE1 3.26Å; R731-E753 VanDerWaalsContact NH1-OE1 3.07Å; R731-L754 HydrophobicContact CB-CD1 3.84Å; R731-M758 HydrophobicContact CB-CE 4.23Å
732	R	94.8	Very high	95.2	Very high	53 Å²	53	62.5 Å²	62.5	20%	0.2	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-31.8	-173.9	71.1	-175.5	-176.1	162	2.1	114.4	Y728 E734 F735 F736 M758 A823	Y728-R732 HydrophobicContact CD2-CB 4.18Å; Y728-R732 HydrophobicContact CE2-CB 3.72Å; Y728-R732 VanDerWaalsContact CZ-CD 3.49Å; Y728-R732 VanDerWaalsContact O-CB 3.31Å; Y728-R732 WeakPolarHBondContact O-CB 3.44Å; Y728-R732 PolarHBondContact O-N 3.09Å; Y728-R732 WeakPolarHBondContact OH-CD 3.33Å; R732-E734 VanDerWaalsContact C-N 3.33Å; R732-E734 PolarHBondContact O-N 3.02Å; R732-F735 PolarHBondContact O-N 3.32Å; R732-F736 HydrophobicContact CB-CD2 4.34Å; R732-F736 HydrophobicContact CB-CE2 3.82Å; R732-F736 HydrophobicContact CB-CZ 4Å; R732-F736 HydrophobicContact CG-CD2 4.46Å; R732-F736 HydrophobicContact CG-CE2 3.98Å; R732-F736 VanDerWaalsContact O-CD2 3.3Å; R732-F736 WeakPolarHBondContact O-CD2 3.22Å; R732-F736 WeakPolarHBondContact O-CG 3.44Å; R732-F736 PolarHBondContact O-N 2.97Å; R732-M758 HydrophobicContact CB-SD 4.31Å; R732-A823 PolarHBondContact NH1-O 3.47Å
733	G	95.6	Very high	95.1	Very high	42 Å²	42	67.6 Å²	67.6	43%	0.433	33%	0.331	S	S	.	.	H	α-helix	trans	-61.5	-42	-179.5	0	0	0	0	0	112.4	R731 E737	R731-G733 VanDerWaalsContact C-N 3.25Å; R731-G733 PolarHBondContact O-N 3.18Å; R731-G733 VanDerWaalsContact O-N 3.16Å; G733-E737 WeakPolarHBondContact O-CB 3.29Å; G733-E737 WeakPolarHBondContact O-CG 3.49Å; G733-E737 PolarHBondContact O-N 2.88Å
734	E	96.8	Very high	95.1	Very high	88 Å²	88	69.1 Å²	69.1	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-48.4	175.7	-177.5	179.6	-175.3	0	0	111	R731 R732 F736 E737 L738 H750 L754	R731-E734 PolarHBondContact O-N 3.25Å; R732-E734 VanDerWaalsContact C-N 3.33Å; R732-E734 PolarHBondContact O-N 3.02Å; E734-F736 PolarHBondContact O-N 3.11Å; E734-E737 PolarHBondContact O-N 3.44Å; E734-L738 HydrophobicContact CG-CD1 4.21Å; E734-L738 WeakPolarHBondContact O-CG 3.35Å; E734-L738 PolarHBondContact O-N 3.23Å; E734-H750 IonicContact OE1-CD2 2.62Å; E734-H750 PolarHBondContact OE1-CD2 2.98Å; E734-H750 IonicContact OE1-CE1 3.32Å; E734-H750 IonicContact OE1-NE2 3.79Å; E734-H750 PolarHBondContact OE1-NE2 3.13Å; E734-H750 IonicContact OE2-NE2 3.97Å; E734-L754 HydrophobicContact CB-CD2 4.18Å; E734-L754 HydrophobicContact CG-CD2 3.83Å
735	F	97.1	Very high	95	Very high	2 Å²	2	71.3 Å²	71.3	1%	0.009	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-46.7	-179.9	-177.8	-118.3	0	0	0	111.9	R732 E737 L738 I739 F744 L754 F755 M758 A831 V835	R732-F735 PolarHBondContact O-N 3.32Å; F735-E737 VanDerWaalsContact C-N 3.34Å; F735-E737 PolarHBondContact O-N 3.03Å; F735-L738 PolarHBondContact O-N 2.8Å; F735-I739 HydrophobicContact CD2-CG1 4.45Å; F735-I739 HydrophobicContact CE1-CG1 4.39Å; F735-I739 HydrophobicContact CE2-CD1 4.21Å; F735-I739 HydrophobicContact CE2-CG1 4.12Å; F735-I739 HydrophobicContact CZ-CD1 4.24Å; F735-I739 HydrophobicContact CZ-CG1 4.09Å; F735-I739 WeakPolarHBondContact O-CG1 3.35Å; F735-I739 PolarHBondContact O-N 3.1Å; F735-F744 HydrophobicContact CD2-CD2 4.36Å; F735-F744 HydrophobicContact CD2-CE2 4.12Å; F735-F744 HydrophobicContact CE2-CD2 4.07Å; F735-F744 AromaticContact CE2-CE2 3.65Å; F735-F744 HydrophobicContact CE2-CE2 3.65Å; F735-F744 AromaticContact CE2-CZ 3.98Å; F735-F744 HydrophobicContact CE2-CZ 3.98Å; F735-L754 HydrophobicContact CB-CD1 4.34Å; F735-L754 HydrophobicContact CB-CD2 3.9Å; F735-L754 HydrophobicContact CB-CG 4.06Å; F735-L754 HydrophobicContact CD2-CD2 4.41Å; F735-L754 HydrophobicContact CD2-CG 4.32Å; F735-F755 HydrophobicContact CE2-CD2 4.17Å; F735-F755 HydrophobicContact CZ-CD2 4.21Å; F735-M758 HydrophobicContact CB-CG 4.05Å; F735-M758 HydrophobicContact CB-SD 4.3Å; F735-M758 HydrophobicContact CD1-CB 4.21Å; F735-M758 HydrophobicContact CD1-CG 3.58Å; F735-M758 HydrophobicContact CD1-SD 4.12Å; F735-M758 HydrophobicContact CD2-CG 4.18Å; F735-M758 HydrophobicContact CE1-CB 4.12Å; F735-M758 HydrophobicContact CE1-CG 4.01Å; F735-M758 HydrophobicContact CG-CG 3.68Å; F735-M758 HydrophobicContact CG-SD 4.39Å; F735-M758 HydrophobicContact CZ-CB 4.45Å; F735-M758 HydrophobicContact CZ-CG 4.49Å; F735-A831 HydrophobicContact CD1-CB 4.11Å; F735-A831 HydrophobicContact CE1-CB 3.58Å; F735-A831 HydrophobicContact CZ-CB 4.44Å; F735-V835 HydrophobicContact CZ-CG2 4.08Å
736	F	97.1	Very high	95	Very high	24 Å²	24	70 Å²	70	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-34.4	179.6	-60.2	-23.5	0	0	0	112.9	R732 E734 R740 Q827 A831	R732-F736 HydrophobicContact CB-CD2 4.34Å; R732-F736 HydrophobicContact CB-CE2 3.82Å; R732-F736 HydrophobicContact CB-CZ 4Å; R732-F736 HydrophobicContact CG-CD2 4.46Å; R732-F736 HydrophobicContact CG-CE2 3.98Å; R732-F736 VanDerWaalsContact O-CD2 3.3Å; R732-F736 WeakPolarHBondContact O-CD2 3.22Å; R732-F736 WeakPolarHBondContact O-CG 3.44Å; R732-F736 PolarHBondContact O-N 2.97Å; E734-F736 PolarHBondContact O-N 3.11Å; F736-R740 VanDerWaalsContact O-CB 3.22Å; F736-R740 WeakPolarHBondContact O-CB 3.44Å; F736-R740 PolarHBondContact O-N 3.22Å; F736-Q827 HydrophobicContact CD2-CB 4.37Å; F736-Q827 HydrophobicContact CE1-CB 4.33Å; F736-Q827 WeakPolarHBondContact CE1-O 3.47Å; F736-Q827 HydrophobicContact CE2-CB 3.58Å; F736-Q827 HydrophobicContact CE2-CG 4.47Å; F736-Q827 HydrophobicContact CZ-CB 3.56Å; F736-A831 HydrophobicContact CD1-CB 3.69Å; F736-A831 HydrophobicContact CE1-CB 3.71Å
737	E	96.7	Very high	95	Very high	68 Å²	68	75 Å²	75	32%	0.318	36%	0.355	S	S	.	.	H	α-helix	trans	-66	-43.2	173.6	-79	-66.1	128.2	0	0	112	G733 E734 F735 I739 R740 K741	G733-E737 WeakPolarHBondContact O-CB 3.29Å; G733-E737 WeakPolarHBondContact O-CG 3.49Å; G733-E737 PolarHBondContact O-N 2.88Å; E734-E737 PolarHBondContact O-N 3.44Å; F735-E737 VanDerWaalsContact C-N 3.34Å; F735-E737 PolarHBondContact O-N 3.03Å; E737-I739 VanDerWaalsContact C-N 3.35Å; E737-I739 PolarHBondContact O-N 3.42Å; E737-R740 PolarHBondContact O-N 3.44Å; E737-R740 IonicContact OE1-CZ 3.39Å; E737-R740 IonicContact OE1-NH1 2.72Å; E737-R740 PolarHBondContact OE1-NH1 3.01Å; E737-R740 IonicContact OE1-NH2 3.65Å; E737-K741 WeakPolarHBondContact O-CB 3.26Å; E737-K741 WeakPolarHBondContact O-CG 3.35Å; E737-K741 PolarHBondContact O-N 3.26Å; E737-K741 VanDerWaalsContact OE2-CE 3.26Å; E737-K741 WeakPolarHBondContact OE2-CE 3.42Å; E737-K741 IonicContact OE2-NZ 3.82Å; E737-K741 PolarHBondContact OE2-NZ 3.43Å
738	L	96.7	Very high	95.2	Very high	24 Å²	24	75.9 Å²	75.9	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-44	177.1	-70.8	170	0	0	0	111.6	E734 F735 N742 Q743 F744 Q751 L754	E734-L738 HydrophobicContact CG-CD1 4.21Å; E734-L738 WeakPolarHBondContact O-CG 3.35Å; E734-L738 PolarHBondContact O-N 3.23Å; F735-L738 PolarHBondContact O-N 2.8Å; L738-N742 PolarHBondContact O-N 3.39Å; L738-Q743 HydrophobicContact CD2-CB 4.19Å; L738-Q743 PolarHBondContact O-N 3.39Å; L738-F744 HydrophobicContact CB-CB 4.21Å; L738-F744 HydrophobicContact CB-CD2 4.49Å; L738-F744 PolarHBondContact O-N 2.82Å; L738-Q751 HydrophobicContact CD1-CG 3.98Å; L738-L754 HydrophobicContact CD1-CD2 4.05Å
739	I	95.4	Very high	95.2	Very high	20 Å²	20	80.8 Å²	80.8	10%	0.103	39%	0.391	C	S	.	.	H	α-helix	trans	-66.1	-48	176.2	-63.1	-66.8	0	0	0	110.8	F735 E737 K741 N742 F744 A831 H834 V835	F735-I739 HydrophobicContact CD2-CG1 4.45Å; F735-I739 HydrophobicContact CE1-CG1 4.39Å; F735-I739 HydrophobicContact CE2-CD1 4.21Å; F735-I739 HydrophobicContact CE2-CG1 4.12Å; F735-I739 HydrophobicContact CZ-CD1 4.24Å; F735-I739 HydrophobicContact CZ-CG1 4.09Å; F735-I739 WeakPolarHBondContact O-CG1 3.35Å; F735-I739 PolarHBondContact O-N 3.1Å; E737-I739 VanDerWaalsContact C-N 3.35Å; E737-I739 PolarHBondContact O-N 3.42Å; I739-K741 VanDerWaalsContact C-N 3.28Å; I739-K741 PolarHBondContact O-N 3.21Å; I739-N742 PolarHBondContact O-N 3Å; I739-F744 HydrophobicContact CD1-CB 3.69Å; I739-F744 HydrophobicContact CD1-CD1 3.73Å; I739-F744 HydrophobicContact CD1-CD2 4.28Å; I739-F744 HydrophobicContact CD1-CE1 4.44Å; I739-F744 HydrophobicContact CD1-CG 3.63Å; I739-A831 HydrophobicContact CG1-CB 4.46Å; I739-H834 HydrophobicContact CG2-CB 3.59Å; I739-V835 HydrophobicContact CD1-CG2 3.51Å
740	R	95.2	Very high	95.3	Very high	171 Å²	171	81.4 Å²	81.4	65%	0.645	39%	0.392	S	S	*	.	H	α-helix	trans	-61.1	-36.5	-178.9	-170	-172.9	-57.9	147.1	12	112.6	F736 E737 N742	F736-R740 VanDerWaalsContact O-CB 3.22Å; F736-R740 WeakPolarHBondContact O-CB 3.44Å; F736-R740 PolarHBondContact O-N 3.22Å; E737-R740 PolarHBondContact O-N 3.44Å; E737-R740 IonicContact OE1-CZ 3.39Å; E737-R740 IonicContact OE1-NH1 2.72Å; E737-R740 PolarHBondContact OE1-NH1 3.01Å; E737-R740 IonicContact OE1-NH2 3.65Å; R740-N742 VanDerWaalsContact C-N 3.31Å
741	K	95.3	Very high	95.4	Very high	113 Å²	113	74.1 Å²	74.1	49%	0.491	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.7	178.9	-70.4	171.8	171.7	147.5	0	113.5	E737 I739 Q743	E737-K741 WeakPolarHBondContact O-CB 3.26Å; E737-K741 WeakPolarHBondContact O-CG 3.35Å; E737-K741 PolarHBondContact O-N 3.26Å; E737-K741 VanDerWaalsContact OE2-CE 3.26Å; E737-K741 WeakPolarHBondContact OE2-CE 3.42Å; E737-K741 IonicContact OE2-NZ 3.82Å; E737-K741 PolarHBondContact OE2-NZ 3.43Å; I739-K741 VanDerWaalsContact C-N 3.28Å; I739-K741 PolarHBondContact O-N 3.21Å; K741-Q743 HydrophobicContact CB-CB 4.37Å; K741-Q743 HydrophobicContact CB-CG 3.89Å; K741-Q743 PolarHBondContact O-N 3.28Å
742	N	94.1	Very high	95.5	Very high	152 Å²	152	71.6 Å²	71.6	81%	0.813	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	37	-171.7	-59.8	-53.5	0	0	0	112.8	L738 I739 R740	L738-N742 PolarHBondContact O-N 3.39Å; I739-N742 PolarHBondContact O-N 3Å; R740-N742 VanDerWaalsContact C-N 3.31Å
743	Q	94.4	Very high	95.6	Very high	117 Å²	117	71.3 Å²	71.3	55%	0.547	35%	0.354	S	S	.	.			trans	-105.1	0.2	-179.9	-71.5	177	-15.2	0	0	112.8	L738 K741 N745 Q751	L738-Q743 HydrophobicContact CD2-CB 4.19Å; L738-Q743 PolarHBondContact O-N 3.39Å; K741-Q743 HydrophobicContact CB-CB 4.37Å; K741-Q743 HydrophobicContact CB-CG 3.89Å; K741-Q743 PolarHBondContact O-N 3.28Å; Q743-N745 PolarHBondContact O-N 3.42Å; Q743-Q751 PolarHBondContact O-OE1 3.4Å
744	F	95.6	Very high	95.7	Very high	43 Å²	43	69.5 Å²	69.5	19%	0.189	33%	0.334	C	S	.	.			trans	-69	119.4	-178.5	-179.4	-110.5	0	0	0	111.6	F735 L738 I739 L746 Q751 F755 V835	F735-F744 HydrophobicContact CD2-CD2 4.36Å; F735-F744 HydrophobicContact CD2-CE2 4.12Å; F735-F744 HydrophobicContact CE2-CD2 4.07Å; F735-F744 AromaticContact CE2-CE2 3.65Å; F735-F744 HydrophobicContact CE2-CE2 3.65Å; F735-F744 AromaticContact CE2-CZ 3.98Å; F735-F744 HydrophobicContact CE2-CZ 3.98Å; L738-F744 HydrophobicContact CB-CB 4.21Å; L738-F744 HydrophobicContact CB-CD2 4.49Å; L738-F744 PolarHBondContact O-N 2.82Å; I739-F744 HydrophobicContact CD1-CB 3.69Å; I739-F744 HydrophobicContact CD1-CD1 3.73Å; I739-F744 HydrophobicContact CD1-CD2 4.28Å; I739-F744 HydrophobicContact CD1-CE1 4.44Å; I739-F744 HydrophobicContact CD1-CG 3.63Å; F744-L746 HydrophobicContact CE1-CD1 4.26Å; F744-L746 HydrophobicContact CE1-CD2 3.99Å; F744-L746 HydrophobicContact CE1-CG 3.8Å; F744-L746 HydrophobicContact CE2-CD2 4.34Å; F744-L746 HydrophobicContact CZ-CD2 3.48Å; F744-L746 VanDerWaalsContact CZ-CD2 3.48Å; F744-L746 HydrophobicContact CZ-CG 3.82Å; F744-Q751 HydrophobicContact CE2-CB 4.45Å; F744-F755 HydrophobicContact CE1-CD2 4.46Å; F744-F755 HydrophobicContact CE2-CB 4.04Å; F744-F755 HydrophobicContact CZ-CB 3.73Å; F744-F755 AromaticContact CZ-CD2 3.78Å; F744-F755 HydrophobicContact CZ-CD2 3.78Å; F744-F755 AromaticContact CZ-CG 3.84Å; F744-F755 HydrophobicContact CZ-CG 3.84Å; F744-V835 HydrophobicContact CD1-CG2 3.99Å; F744-V835 HydrophobicContact CE1-CB 4.43Å; F744-V835 HydrophobicContact CE1-CG1 3.89Å; F744-V835 HydrophobicContact CE1-CG2 3.65Å; F744-V835 HydrophobicContact CZ-CG2 4.32Å
745	N	94.2	Very high	95.7	Very high	68 Å²	68	65.4 Å²	65.4	36%	0.364	32%	0.315	S	S	.	.			trans	-131.9	122.2	179.1	-174.4	7.2	0	0	0	111.1	Q743 E747 D748 Q751	Q743-N745 PolarHBondContact O-N 3.42Å; N745-E747 VanDerWaalsContact C-N 3.3Å; N745-E747 PolarHBondContact ND2-OE2 3.01Å; N745-E747 PolarHBondContact O-N 2.89Å; N745-E747 WeakPolarHBondContact OD1-CB 3.34Å; N745-E747 WeakPolarHBondContact OD1-CG 3.48Å; N745-E747 PolarHBondContact OD1-N 3.27Å; N745-D748 PolarHBondContact O-N 2.9Å; N745-Q751 WeakPolarHBondContact O-CB 3.34Å
746	L	92.8	Very high	95.8	Very high	29 Å²	29	65.8 Å²	65.8	15%	0.152	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.9	178.9	-73.8	172.3	0	0	0	114.2	K637 F744 D748 K752 F755	K637-L746 HydrophobicContact CB-CD1 3.67Å; K637-L746 HydrophobicContact CD-CD1 3.85Å; K637-L746 HydrophobicContact CG-CD1 4.2Å; F744-L746 HydrophobicContact CE1-CD1 4.26Å; F744-L746 HydrophobicContact CE1-CD2 3.99Å; F744-L746 HydrophobicContact CE1-CG 3.8Å; F744-L746 HydrophobicContact CE2-CD2 4.34Å; F744-L746 HydrophobicContact CZ-CD2 3.48Å; F744-L746 VanDerWaalsContact CZ-CD2 3.48Å; F744-L746 HydrophobicContact CZ-CG 3.82Å; L746-D748 VanDerWaalsContact C-N 3.27Å; L746-K752 HydrophobicContact CD2-CG 4.24Å; L746-K752 WeakPolarHBondContact O-CE 3.46Å; L746-F755 HydrophobicContact CD2-CB 3.83Å; L746-F755 HydrophobicContact CD2-CD1 3.58Å; L746-F755 HydrophobicContact CD2-CE1 4.31Å; L746-F755 HydrophobicContact CD2-CG 3.75Å
747	E	93.2	Very high	95.8	Very high	169 Å²	169	64.9 Å²	64.9	79%	0.79	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-21.6	171.2	-59.7	175.2	160.5	0	0	111.9	N745	N745-E747 VanDerWaalsContact C-N 3.3Å; N745-E747 PolarHBondContact ND2-OE2 3.01Å; N745-E747 PolarHBondContact O-N 2.89Å; N745-E747 WeakPolarHBondContact OD1-CB 3.34Å; N745-E747 WeakPolarHBondContact OD1-CG 3.48Å; N745-E747 PolarHBondContact OD1-N 3.27Å
748	D	96.4	Very high	95.9	Very high	56 Å²	56	61.9 Å²	61.9	30%	0.299	30%	0.3	S	S	.	.	S	Bend	trans	-77	121.8	174.2	-179	-32.6	0	0	0	109.6	N745 L746 H750 Q751 K752	N745-D748 PolarHBondContact O-N 2.9Å; L746-D748 VanDerWaalsContact C-N 3.27Å; D748-H750 VanDerWaalsContact C-N 3.28Å; D748-H750 PolarHBondContact O-N 2.95Å; D748-H750 WeakPolarHBondContact OD1-CB 3.34Å; D748-H750 PolarHBondContact OD1-N 3.34Å; D748-Q751 HydrophobicContact CB-CB 4.03Å; D748-Q751 HydrophobicContact CB-CG 3.96Å; D748-Q751 PolarHBondContact O-N 3.27Å; D748-Q751 PolarHBondContact OD1-N 3.02Å; D748-Q751 PolarHBondContact OD2-NE2 3.1Å; D748-Q751 VanDerWaalsContact OD2-NE2 3.11Å; D748-K752 WeakPolarHBondContact O-CB 3.25Å; D748-K752 PolarHBondContact O-N 3.43Å
749	P	94.2	Very high	96	Very high	105 Å²	105	60.8 Å²	60.8	68%	0.682	29%	0.294	S	S	*	.	H	α-helix	trans	-62.7	-33.2	-175.6	25.7	-34.5	0	0	0	113.2	E753	P749-E753 PolarHBondContact O-N 3.06Å
750	H	95.8	Very high	96.1	Very high	98 Å²	98	59.8 Å²	59.8	45%	0.454	29%	0.289	S	S	.	.	H	α-helix	trans	-72.7	-45.3	178.9	174.2	72.8	0	0	0	111	E734 D748 K752 E753 L754	E734-H750 IonicContact OE1-CD2 2.62Å; E734-H750 PolarHBondContact OE1-CD2 2.98Å; E734-H750 IonicContact OE1-CE1 3.32Å; E734-H750 IonicContact OE1-NE2 3.79Å; E734-H750 PolarHBondContact OE1-NE2 3.13Å; E734-H750 IonicContact OE2-NE2 3.97Å; D748-H750 VanDerWaalsContact C-N 3.28Å; D748-H750 PolarHBondContact O-N 2.95Å; D748-H750 WeakPolarHBondContact OD1-CB 3.34Å; D748-H750 PolarHBondContact OD1-N 3.34Å; H750-K752 VanDerWaalsContact C-N 3.26Å; H750-K752 PolarHBondContact O-N 3.48Å; H750-E753 PolarHBondContact O-N 3.29Å; H750-L754 WeakPolarHBondContact O-CB 3.38Å; H750-L754 PolarHBondContact O-N 3.38Å
751	Q	96.9	Very high	96.3	Very high	22 Å²	22	51.7 Å²	51.7	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-32	176.7	-61.8	-173.6	46	0	0	112	L738 Q743 F744 N745 D748 L754 F755	L738-Q751 HydrophobicContact CD1-CG 3.98Å; Q743-Q751 PolarHBondContact O-OE1 3.4Å; F744-Q751 HydrophobicContact CE2-CB 4.45Å; N745-Q751 WeakPolarHBondContact O-CB 3.34Å; D748-Q751 HydrophobicContact CB-CB 4.03Å; D748-Q751 HydrophobicContact CB-CG 3.96Å; D748-Q751 PolarHBondContact O-N 3.27Å; D748-Q751 PolarHBondContact OD1-N 3.02Å; D748-Q751 PolarHBondContact OD2-NE2 3.1Å; D748-Q751 VanDerWaalsContact OD2-NE2 3.11Å; Q751-L754 PolarHBondContact O-N 3.32Å; Q751-F755 WeakPolarHBondContact O-CB 3.45Å; Q751-F755 PolarHBondContact O-N 3.3Å
752	K	96.7	Very high	96.4	Very high	39 Å²	39	46.4 Å²	46.4	17%	0.17	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-48.2	171.9	-164	-169.9	-66.2	-168.6	0	111.5	E642 L746 D748 H750 L754 F755 L756	E642-K752 WeakPolarHBondContact OE1-CD 3.47Å; E642-K752 WeakPolarHBondContact OE1-CE 3.4Å; E642-K752 IonicContact OE1-NZ 2.76Å; E642-K752 PolarHBondContact OE1-NZ 3.44Å; E642-K752 IonicContact OE2-NZ 3.77Å; E642-K752 PolarHBondContact OE2-NZ 3.06Å; L746-K752 HydrophobicContact CD2-CG 4.24Å; L746-K752 WeakPolarHBondContact O-CE 3.46Å; D748-K752 WeakPolarHBondContact O-CB 3.25Å; D748-K752 PolarHBondContact O-N 3.43Å; H750-K752 VanDerWaalsContact C-N 3.26Å; H750-K752 PolarHBondContact O-N 3.48Å; K752-L754 VanDerWaalsContact C-N 3.27Å; K752-L754 PolarHBondContact O-N 2.89Å; K752-F755 WeakPolarHBondContact O-CB 3.29Å; K752-F755 PolarHBondContact O-N 2.63Å; K752-F755 VanDerWaalsContact O-N 3.1Å; K752-L756 VanDerWaalsContact O-CG 3.3Å; K752-L756 WeakPolarHBondContact O-CG 3.46Å; K752-L756 PolarHBondContact O-N 2.91Å
753	E	97	Very high	96.6	Very high	48 Å²	48	39.2 Å²	39.2	22%	0.224	20%	0.198	C	C	.	.	H	α-helix	trans	-54.5	-46.6	173.9	-179.1	-174.2	143	0	0	111.1	Q718 R731 P749 H750 F755 L756 A757	Q718-E753 PolarHBondContact NE2-OE1 3.43Å; Q718-E753 PolarHBondContact NE2-OE2 3.43Å; R731-E753 IonicContact NH1-OE1 2.79Å; R731-E753 PolarHBondContact NH1-OE1 3.26Å; R731-E753 VanDerWaalsContact NH1-OE1 3.07Å; P749-E753 PolarHBondContact O-N 3.06Å; H750-E753 PolarHBondContact O-N 3.29Å; E753-F755 VanDerWaalsContact C-N 3.32Å; E753-F755 PolarHBondContact O-N 3.43Å; E753-L756 PolarHBondContact O-N 2.99Å; E753-A757 PolarHBondContact O-N 2.75Å
754	L	97.8	Very high	96.8	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-43.4	177.3	-179.8	60.3	0	0	0	111.7	R731 E734 F735 L738 H750 Q751 K752 A757 M758	R731-L754 HydrophobicContact CB-CD1 3.84Å; E734-L754 HydrophobicContact CB-CD2 4.18Å; E734-L754 HydrophobicContact CG-CD2 3.83Å; F735-L754 HydrophobicContact CB-CD1 4.34Å; F735-L754 HydrophobicContact CB-CD2 3.9Å; F735-L754 HydrophobicContact CB-CG 4.06Å; F735-L754 HydrophobicContact CD2-CD2 4.41Å; F735-L754 HydrophobicContact CD2-CG 4.32Å; L738-L754 HydrophobicContact CD1-CD2 4.05Å; H750-L754 WeakPolarHBondContact O-CB 3.38Å; H750-L754 PolarHBondContact O-N 3.38Å; Q751-L754 PolarHBondContact O-N 3.32Å; K752-L754 VanDerWaalsContact C-N 3.27Å; K752-L754 PolarHBondContact O-N 2.89Å; L754-A757 WeakPolarHBondContact O-CB 3.49Å; L754-A757 PolarHBondContact O-N 2.94Å; L754-M758 HydrophobicContact CD1-CE 4.31Å; L754-M758 VanDerWaalsContact O-CG 3.29Å; L754-M758 WeakPolarHBondContact O-CG 3.3Å; L754-M758 PolarHBondContact O-N 3.17Å
755	F	98.2	Very high	97	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-44.4	176.2	175.2	-110.5	0	0	0	112.9	I634 L638 F735 F744 L746 Q751 K752 E753 A757 M758 L759 L832 V835	I634-F755 HydrophobicContact CD1-CZ 4.23Å; I634-F755 HydrophobicContact CG2-CE1 3.9Å; I634-F755 HydrophobicContact CG2-CZ 3.91Å; L638-F755 HydrophobicContact CD2-CD1 4.38Å; L638-F755 HydrophobicContact CD2-CE1 4.28Å; F735-F755 HydrophobicContact CE2-CD2 4.17Å; F735-F755 HydrophobicContact CZ-CD2 4.21Å; F744-F755 HydrophobicContact CE1-CD2 4.46Å; F744-F755 HydrophobicContact CE2-CB 4.04Å; F744-F755 HydrophobicContact CZ-CB 3.73Å; F744-F755 AromaticContact CZ-CD2 3.78Å; F744-F755 HydrophobicContact CZ-CD2 3.78Å; F744-F755 AromaticContact CZ-CG 3.84Å; F744-F755 HydrophobicContact CZ-CG 3.84Å; L746-F755 HydrophobicContact CD2-CB 3.83Å; L746-F755 HydrophobicContact CD2-CD1 3.58Å; L746-F755 HydrophobicContact CD2-CE1 4.31Å; L746-F755 HydrophobicContact CD2-CG 3.75Å; Q751-F755 WeakPolarHBondContact O-CB 3.45Å; Q751-F755 PolarHBondContact O-N 3.3Å; K752-F755 WeakPolarHBondContact O-CB 3.29Å; K752-F755 PolarHBondContact O-N 2.63Å; K752-F755 VanDerWaalsContact O-N 3.1Å; E753-F755 VanDerWaalsContact C-N 3.32Å; E753-F755 PolarHBondContact O-N 3.43Å; F755-A757 VanDerWaalsContact C-N 3.27Å; F755-A757 PolarHBondContact O-N 3.36Å; F755-M758 PolarHBondContact O-N 2.92Å; F755-L759 HydrophobicContact CE1-CD2 4.23Å; F755-L759 HydrophobicContact CZ-CD2 4.31Å; F755-L759 WeakPolarHBondContact O-CB 3.33Å; F755-L759 PolarHBondContact O-N 3.42Å; F755-L832 HydrophobicContact CE2-CD1 4.16Å; F755-V835 HydrophobicContact CD2-CG1 4.43Å; F755-V835 HydrophobicContact CE2-CB 4.26Å; F755-V835 HydrophobicContact CE2-CG1 3.72Å; F755-V835 HydrophobicContact CE2-CG2 4.26Å; F755-V835 HydrophobicContact CZ-CG1 4.04Å
756	L	98.3	Very high	97.1	Very high	11 Å²	11	30.7 Å²	30.7	6%	0.058	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-41.9	176.7	-64	176	0	0	0	110.9	L638 E642 L646 I715 K752 E753 L759 M760	L638-L756 HydrophobicContact CD1-CD2 3.95Å; L638-L756 HydrophobicContact CD2-CD2 3.87Å; E642-L756 HydrophobicContact CG-CD1 4.44Å; L646-L756 HydrophobicContact CD1-CD2 3.66Å; L646-L756 HydrophobicContact CD2-CB 4.34Å; L646-L756 HydrophobicContact CD2-CD2 4.18Å; L646-L756 HydrophobicContact CG-CD2 4.12Å; I715-L756 HydrophobicContact CG2-CD1 4.17Å; K752-L756 VanDerWaalsContact O-CG 3.3Å; K752-L756 WeakPolarHBondContact O-CG 3.46Å; K752-L756 PolarHBondContact O-N 2.91Å; E753-L756 PolarHBondContact O-N 2.99Å; L756-L759 PolarHBondContact O-N 2.96Å; L756-M760 WeakPolarHBondContact O-CG 3.26Å; L756-M760 PolarHBondContact O-N 2.95Å
757	A	98	Very high	97.4	Very high	5 Å²	5	30 Å²	30	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-48.1	174.5	0	0	0	0	0	112.1	A722 E753 L754 F755 L759 M760 T761	A722-A757 HydrophobicContact CB-CB 3.53Å; E753-A757 PolarHBondContact O-N 2.75Å; L754-A757 WeakPolarHBondContact O-CB 3.49Å; L754-A757 PolarHBondContact O-N 2.94Å; F755-A757 VanDerWaalsContact C-N 3.27Å; F755-A757 PolarHBondContact O-N 3.36Å; A757-L759 VanDerWaalsContact C-N 3.32Å; A757-L759 PolarHBondContact O-N 3.34Å; A757-M760 PolarHBondContact O-N 2.71Å; A757-T761 PolarHBondContact O-N 3.28Å; A757-T761 VanDerWaalsContact O-N 3.09Å; A757-T761 PolarHBondContact O-OG1 2.9Å; A757-T761 VanDerWaalsContact O-OG1 3.12Å
758	M	98.1	Very high	97.6	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.02	12%	0.121	C	C	.	.	H	α-helix	trans	-64.3	-37	178	-64.7	-62.6	102.5	0	0	112.4	Y728 R731 R732 F735 L754 F755 T761 A762 L828	Y728-M758 HydrophobicContact CD2-CE 3.74Å; Y728-M758 HydrophobicContact CD2-SD 3.79Å; Y728-M758 HydrophobicContact CE2-CE 4.38Å; Y728-M758 HydrophobicContact CE2-SD 3.82Å; R731-M758 HydrophobicContact CB-CE 4.23Å; R732-M758 HydrophobicContact CB-SD 4.31Å; F735-M758 HydrophobicContact CB-CG 4.05Å; F735-M758 HydrophobicContact CB-SD 4.3Å; F735-M758 HydrophobicContact CD1-CB 4.21Å; F735-M758 HydrophobicContact CD1-CG 3.58Å; F735-M758 HydrophobicContact CD1-SD 4.12Å; F735-M758 HydrophobicContact CD2-CG 4.18Å; F735-M758 HydrophobicContact CE1-CB 4.12Å; F735-M758 HydrophobicContact CE1-CG 4.01Å; F735-M758 HydrophobicContact CG-CG 3.68Å; F735-M758 HydrophobicContact CG-SD 4.39Å; F735-M758 HydrophobicContact CZ-CB 4.45Å; F735-M758 HydrophobicContact CZ-CG 4.49Å; L754-M758 HydrophobicContact CD1-CE 4.31Å; L754-M758 VanDerWaalsContact O-CG 3.29Å; L754-M758 WeakPolarHBondContact O-CG 3.3Å; L754-M758 PolarHBondContact O-N 3.17Å; F755-M758 PolarHBondContact O-N 2.92Å; M758-T761 PolarHBondContact O-N 3.23Å; M758-A762 WeakPolarHBondContact O-CB 3.37Å; M758-A762 PolarHBondContact O-N 3.5Å; M758-L828 HydrophobicContact CB-CD1 4.08Å; M758-L828 HydrophobicContact SD-CD1 4.33Å
759	L	98.5	Very high	97.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-66.7	-40.4	177	-176.5	61.5	0	0	0	111.6	M625 A628 I634 L646 F755 L756 A757 A762 C763 L832	M625-L759 HydrophobicContact CE-CD2 4.34Å; M625-L759 HydrophobicContact CE-CG 3.98Å; M625-L759 HydrophobicContact SD-CD2 3.77Å; M625-L759 HydrophobicContact SD-CG 3.9Å; A628-L759 HydrophobicContact CB-CD1 4.32Å; I634-L759 HydrophobicContact CD1-CD1 3.81Å; I634-L759 HydrophobicContact CD1-CD2 4.42Å; I634-L759 HydrophobicContact CG2-CD2 4.16Å; L646-L759 HydrophobicContact CD1-CD2 4.07Å; F755-L759 HydrophobicContact CE1-CD2 4.23Å; F755-L759 HydrophobicContact CZ-CD2 4.31Å; F755-L759 WeakPolarHBondContact O-CB 3.33Å; F755-L759 PolarHBondContact O-N 3.42Å; L756-L759 PolarHBondContact O-N 2.96Å; A757-L759 VanDerWaalsContact C-N 3.32Å; A757-L759 PolarHBondContact O-N 3.34Å; L759-A762 PolarHBondContact O-N 2.73Å; L759-C763 PolarHBondContact O-N 2.97Å; L759-C763 PolarHBondContact O-SG 3.32Å; L759-L832 HydrophobicContact CD1-CD1 4.09Å
760	M	98.5	Very high	97.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.5	-50.9	172.7	-79.6	-63.8	-57.5	0	0	111.5	M625 L646 A649 A650 A719 T723 L756 A757 A762 C763 D764	M625-M760 HydrophobicContact CE-CG 4.22Å; M625-M760 HydrophobicContact CE-SD 3.46Å; M625-M760 WeakPolarHBondContact CE-SD 3.4Å; L646-M760 HydrophobicContact CD2-CG 3.71Å; L646-M760 HydrophobicContact CD2-SD 3.81Å; A649-M760 HydrophobicContact CB-CE 4.03Å; A649-M760 HydrophobicContact CB-SD 4.25Å; A650-M760 HydrophobicContact CB-CE 4.43Å; A650-M760 HydrophobicContact CB-SD 4.5Å; A719-M760 HydrophobicContact CB-CE 4.39Å; A719-M760 HydrophobicContact CB-CG 3.71Å; A719-M760 HydrophobicContact CB-SD 4.11Å; T723-M760 HydrophobicContact CG2-CE 4.03Å; L756-M760 WeakPolarHBondContact O-CG 3.26Å; L756-M760 PolarHBondContact O-N 2.95Å; A757-M760 PolarHBondContact O-N 2.71Å; M760-A762 VanDerWaalsContact C-N 3.27Å; M760-A762 PolarHBondContact O-N 3.04Å; M760-C763 PolarHBondContact O-N 2.91Å; M760-C763 VanDerWaalsContact O-N 3.15Å; M760-D764 WeakPolarHBondContact O-CB 3.4Å; M760-D764 PolarHBondContact O-N 3.01Å
761	T	98.3	Very high	98	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.006	7%	0.072	C	C	.	.	H	α-helix	trans	-59.9	-37.5	176.6	-46.5	0	0	0	0	112	A722 L725 Y728 A757 M758 C763 D764 L765 L828	A722-T761 PolarHBondContact O-OG1 3.04Å; L725-T761 HydrophobicContact CD1-CG2 4.33Å; Y728-T761 HydrophobicContact CD2-CG2 3.85Å; Y728-T761 HydrophobicContact CE2-CG2 4.42Å; Y728-T761 HydrophobicContact CG-CG2 3.94Å; A757-T761 PolarHBondContact O-N 3.28Å; A757-T761 VanDerWaalsContact O-N 3.09Å; A757-T761 PolarHBondContact O-OG1 2.9Å; A757-T761 VanDerWaalsContact O-OG1 3.12Å; M758-T761 PolarHBondContact O-N 3.23Å; T761-C763 VanDerWaalsContact C-N 3.32Å; T761-C763 PolarHBondContact O-N 3.11Å; T761-D764 PolarHBondContact O-N 3.04Å; T761-L765 HydrophobicContact CG2-CD1 4.06Å; T761-L765 HydrophobicContact CG2-CG 4.38Å; T761-L765 WeakPolarHBondContact O-CB 3.41Å; T761-L765 WeakPolarHBondContact O-CG 3.41Å; T761-L765 PolarHBondContact O-N 3.42Å; T761-L828 HydrophobicContact CG2-CD2 4.04Å
762	A	98.3	Very high	98	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.008	8%	0.077	C	C	.	.	H	α-helix	trans	-66	-35.3	178.7	0	0	0	0	0	112.5	M758 L759 M760 S766 L828 Y829 L832	M758-A762 WeakPolarHBondContact O-CB 3.37Å; M758-A762 PolarHBondContact O-N 3.5Å; L759-A762 PolarHBondContact O-N 2.73Å; M760-A762 VanDerWaalsContact C-N 3.27Å; M760-A762 PolarHBondContact O-N 3.04Å; A762-S766 PolarHBondContact O-N 3.16Å; A762-L828 HydrophobicContact CB-CD1 4.48Å; A762-L828 HydrophobicContact CB-CD2 3.92Å; A762-L828 HydrophobicContact CB-CG 4.1Å; A762-Y829 HydrophobicContact CB-CE1 4.02Å; A762-Y829 PolarHBondContact O-OH 2.88Å; A762-L832 HydrophobicContact CB-CD2 4.05Å
763	C	98.6	Very high	98	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.014	10%	0.095	C	C	.	.	H	α-helix	trans	-75.5	-40.9	176.7	-64.2	0	0	0	0	111.9	T621 C624 M625 L759 M760 T761 S766	T621-C763 HydrophobicContact CG2-CB 4.03Å; C624-C763 HydrophobicContact CB-CB 4.26Å; M625-C763 VanDerWaalsContact CA-SG 3.58Å; M625-C763 HydrophobicContact CE-CB 4.28Å; L759-C763 PolarHBondContact O-N 2.97Å; L759-C763 PolarHBondContact O-SG 3.32Å; M760-C763 PolarHBondContact O-N 2.91Å; M760-C763 VanDerWaalsContact O-N 3.15Å; T761-C763 VanDerWaalsContact C-N 3.32Å; T761-C763 PolarHBondContact O-N 3.11Å; C763-S766 WeakPolarHBondContact O-CB 3.48Å; C763-S766 PolarHBondContact O-N 2.87Å; C763-S766 VanDerWaalsContact O-N 3.13Å; C763-S766 PolarHBondContact O-OG 3.45Å
764	D	98.6	Very high	98.1	Very high	20 Å²	20	16 Å²	16	11%	0.107	9%	0.091	C	C	.	.	H	α-helix	trans	-58.9	-47.6	176.1	174.9	16.8	0	0	0	111	H617 T621 H653 M760 T761 S766	H617-D764 IonicContact CE1-OD1 3.53Å; H617-D764 PolarHBondContact CE1-OD1 2.75Å; H617-D764 VanDerWaalsContact CE1-OD1 3.23Å; H617-D764 IonicContact NE2-OD1 2.73Å; H617-D764 PolarHBondContact NE2-OD1 3.19Å; T621-D764 HydrophobicContact CG2-CB 4.4Å; H653-D764 IonicContact NE2-OD1 2.87Å; M760-D764 WeakPolarHBondContact O-CB 3.4Å; M760-D764 PolarHBondContact O-N 3.01Å; T761-D764 PolarHBondContact O-N 3.04Å; D764-S766 PolarHBondContact O-N 3.14Å
765	L	97.9	Very high	98	Very high	26 Å²	26	16 Å²	16	14%	0.136	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-79.9	3.8	177.8	-57.4	-176.1	0	0	0	114.2	L725 T761 A767 I768 F820 I824 Y829	L725-L765 HydrophobicContact CD1-CD1 4.31Å; T761-L765 HydrophobicContact CG2-CD1 4.06Å; T761-L765 HydrophobicContact CG2-CG 4.38Å; T761-L765 WeakPolarHBondContact O-CB 3.41Å; T761-L765 WeakPolarHBondContact O-CG 3.41Å; T761-L765 PolarHBondContact O-N 3.42Å; L765-A767 PolarHBondContact O-N 3.45Å; L765-I768 WeakPolarHBondContact O-CG2 3.46Å; L765-I768 PolarHBondContact O-N 3.48Å; L765-I768 VanDerWaalsContact O-N 3.12Å; L765-F820 HydrophobicContact CD1-CZ 4.19Å; L765-F820 HydrophobicContact CD2-CZ 4.02Å; L765-I824 HydrophobicContact CD1-CG2 3.65Å; L765-Y829 VanDerWaalsContact C-OH 3.32Å; L765-Y829 PolarHBondContact O-OH 2.69Å
766	S	98.1	Very high	97.9	Very high	3 Å²	3	19.2 Å²	19.2	2%	0.021	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-62.2	-19.8	-169	67.7	0	0	0	0	114.8	C624 A762 C763 D764 I768 T769 Y829	C624-S766 WeakPolarHBondContact CB-OG 3.4Å; C624-S766 WeakPolarHBondContact SG-CB 3.38Å; A762-S766 PolarHBondContact O-N 3.16Å; C763-S766 WeakPolarHBondContact O-CB 3.48Å; C763-S766 PolarHBondContact O-N 2.87Å; C763-S766 VanDerWaalsContact O-N 3.13Å; C763-S766 PolarHBondContact O-OG 3.45Å; D764-S766 PolarHBondContact O-N 3.14Å; S766-I768 PolarHBondContact O-N 3.33Å; S766-I768 VanDerWaalsContact O-N 3.14Å; S766-T769 WeakPolarHBondContact O-CB 3.49Å; S766-T769 PolarHBondContact O-N 2.68Å; S766-T769 PolarHBondContact O-OG1 2.85Å; S766-Y829 WeakPolarHBondContact CA-OH 3.34Å; S766-Y829 PolarHBondContact N-OH 2.87Å
767	A	97.6	Very high	97.8	Very high	15 Å²	15	25.8 Å²	25.8	12%	0.124	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-55.3	-31.8	175.1	0	0	0	0	0	112.6	L765 T769 K770 Q775 I778	L765-A767 PolarHBondContact O-N 3.45Å; A767-T769 PolarHBondContact O-N 3.4Å; A767-K770 WeakPolarHBondContact O-CB 3.33Å; A767-K770 WeakPolarHBondContact O-CG 3.43Å; A767-K770 PolarHBondContact O-N 2.99Å; A767-Q775 VanDerWaalsContact C-NE2 3.29Å; A767-Q775 PolarHBondContact O-NE2 3.01Å; A767-I778 HydrophobicContact CB-CB 4.45Å; A767-I778 HydrophobicContact CB-CG1 4.47Å; A767-I778 HydrophobicContact CB-CG2 3.74Å
768	I	97.9	Very high	97.7	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.036	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-66.1	-16	177.9	-155.7	53.9	0	0	0	113.7	L765 S766 Q775 I821 C825 Y829 N849	L765-I768 WeakPolarHBondContact O-CG2 3.46Å; L765-I768 PolarHBondContact O-N 3.48Å; L765-I768 VanDerWaalsContact O-N 3.12Å; S766-I768 PolarHBondContact O-N 3.33Å; S766-I768 VanDerWaalsContact O-N 3.14Å; I768-Q775 HydrophobicContact CD1-CG 4.41Å; I768-I821 HydrophobicContact CD1-CD1 3.9Å; I768-I821 HydrophobicContact CD1-CG1 3.86Å; I768-I821 HydrophobicContact CG1-CD1 4.13Å; I768-I821 HydrophobicContact CG1-CG1 3.7Å; I768-C825 HydrophobicContact CG2-CB 4.21Å; I768-Y829 HydrophobicContact CG2-CE2 3.8Å; I768-N849 PolarHBondContact O-ND2 3.08Å
769	T	98.2	Very high	97.5	Very high	9 Å²	9	26.7 Å²	26.7	6%	0.055	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-95.8	-11.1	-178.7	75.6	0	0	0	0	112.8	S766 A767 Y829 L842 G845 C846	S766-T769 WeakPolarHBondContact O-CB 3.49Å; S766-T769 PolarHBondContact O-N 2.68Å; S766-T769 PolarHBondContact O-OG1 2.85Å; A767-T769 PolarHBondContact O-N 3.4Å; T769-Y829 HydrophobicContact CG2-CD2 4.13Å; T769-Y829 HydrophobicContact CG2-CE1 3.97Å; T769-Y829 HydrophobicContact CG2-CE2 3.5Å; T769-Y829 VanDerWaalsContact CG2-CE2 3.5Å; T769-Y829 VanDerWaalsContact CG2-CZ 3.42Å; T769-L842 WeakPolarHBondContact CB-O 3.46Å; T769-L842 HydrophobicContact CG2-CB 4.15Å; T769-L842 HydrophobicContact CG2-CD2 4.06Å; T769-L842 VanDerWaalsContact CG2-O 3.31Å; T769-L842 WeakPolarHBondContact CG2-O 3.44Å; T769-L842 VanDerWaalsContact OG1-CD2 3.3Å; T769-L842 WeakPolarHBondContact OG1-CD2 3.1Å; T769-G845 WeakPolarHBondContact O-CA 3.5Å; T769-C846 HydrophobicContact CG2-CB 4.32Å
770	K	98.1	Very high	97.3	Very high	8 Å²	8	32.7 Å²	32.7	4%	0.035	16%	0.163	C	C	.	.	S	Bend	trans	-67.2	156	-176.7	-59.3	-63.1	-177	170.2	0	111.9	F559 F561 A767 I774 N849	F559-K770 WeakPolarHBondContact O-CD 3.38Å; F559-K770 PolarHBondContact O-NZ 3.49Å; F561-K770 PolarHBondContact O-NZ 3.5Å; A767-K770 WeakPolarHBondContact O-CB 3.33Å; A767-K770 WeakPolarHBondContact O-CG 3.43Å; A767-K770 PolarHBondContact O-N 2.99Å; K770-I774 HydrophobicContact CB-CB 4.1Å; K770-I774 HydrophobicContact CB-CG2 3.76Å; K770-I774 HydrophobicContact CG-CG2 4.19Å; K770-N849 PolarHBondContact O-ND2 2.9Å
771	P	98.3	Very high	97.1	Very high	50 Å²	50	35.9 Å²	35.9	33%	0.325	18%	0.18	S	C	.	.			trans	-51	146	174.9	-27.3	33.4	0	0	0	113.1	P773 I774 Q775	P771-P773 WeakPolarHBondContact O-CD 3.34Å; P771-P773 VanDerWaalsContact O-N 3.12Å; P771-I774 HydrophobicContact CB-CD1 4.21Å; P771-I774 HydrophobicContact CG-CD1 4.11Å; P771-I774 WeakPolarHBondContact O-CA 3.49Å; P771-I774 WeakPolarHBondContact O-CB 3.43Å; P771-I774 PolarHBondContact O-N 3.48Å; P771-Q775 PolarHBondContact O-N 2.98Å
772	W	97.8	Very high	97	Very high	56 Å²	56	37.3 Å²	37.3	21%	0.212	19%	0.188	C	C	.	.	H	α-helix	trans	-45.1	-46.6	-172.2	178.6	-112.6	0	0	0	116	I774 Q775 Q776 K852 W853 L856	W772-I774 VanDerWaalsContact C-N 3.25Å; W772-I774 PolarHBondContact O-N 2.94Å; W772-Q775 PolarHBondContact O-N 3.35Å; W772-Q776 HydrophobicContact CD2-CG 3.82Å; W772-Q776 VanDerWaalsContact CE2-CG 3.4Å; W772-Q776 HydrophobicContact CE3-CG 4.12Å; W772-Q776 HydrophobicContact CG-CG 4.47Å; W772-Q776 HydrophobicContact CH2-CG 3.7Å; W772-Q776 HydrophobicContact CZ2-CG 3.35Å; W772-Q776 VanDerWaalsContact CZ2-NE2 3.27Å; W772-Q776 HydrophobicContact CZ3-CG 4.07Å; W772-Q776 WeakPolarHBondContact O-CG 3.4Å; W772-Q776 PolarHBondContact O-N 3.39Å; W772-K852 HydrophobicContact CD2-CB 3.88Å; W772-K852 HydrophobicContact CD2-CG 4.02Å; W772-K852 HydrophobicContact CE3-CB 3.62Å; W772-K852 HydrophobicContact CE3-CG 4.09Å; W772-K852 HydrophobicContact CG-CG 4.35Å; W772-K852 HydrophobicContact CH2-CB 3.92Å; W772-K852 HydrophobicContact CZ2-CB 4.15Å; W772-K852 HydrophobicContact CZ3-CB 3.64Å; W772-W853 AromaticContact CH2-CD2 3.76Å; W772-W853 HydrophobicContact CH2-CD2 3.76Å; W772-W853 AromaticContact CH2-CE2 3.76Å; W772-W853 AromaticContact CH2-CE3 3.97Å; W772-W853 HydrophobicContact CH2-CE3 3.97Å; W772-W853 HydrophobicContact CH2-CG 4.28Å; W772-W853 HydrophobicContact CH2-CH2 4.19Å; W772-W853 AromaticContact CH2-CZ2 3.99Å; W772-W853 HydrophobicContact CH2-CZ2 3.99Å; W772-W853 HydrophobicContact CH2-CZ3 4.18Å; W772-W853 AromaticContact CZ3-CD1 3.92Å; W772-W853 AromaticContact CZ3-CD2 3.87Å; W772-W853 HydrophobicContact CZ3-CD2 3.87Å; W772-W853 AromaticContact CZ3-CE2 3.6Å; W772-W853 HydrophobicContact CZ3-CG 4.08Å; W772-W853 HydrophobicContact CZ3-CZ2 4.05Å; W772-W853 AromaticContact CZ3-NE1 3.65Å; W772-L856 HydrophobicContact CH2-CD1 3.74Å; W772-L856 HydrophobicContact CZ2-CD1 3.7Å
773	P	97.1	Very high	96.7	Very high	82 Å²	82	37.8 Å²	37.8	53%	0.532	19%	0.193	S	C	.	.	H	α-helix	trans	-62.5	-33	-179.8	-18.6	30.8	0	0	0	113.3	P771	P771-P773 WeakPolarHBondContact O-CD 3.34Å; P771-P773 VanDerWaalsContact O-N 3.12Å
774	I	97.4	Very high	96.5	Very high	29 Å²	29	39.8 Å²	39.8	15%	0.149	21%	0.206	C	C	.	.	H	α-helix	trans	-75.1	-48.2	177.9	-64.1	154.9	0	0	0	108.8	F564 K770 P771 W772 Q776 R777 I778	F564-I774 HydrophobicContact CD2-CG1 4.49Å; F564-I774 HydrophobicContact CE2-CB 4.29Å; F564-I774 HydrophobicContact CE2-CG1 4.36Å; F564-I774 HydrophobicContact CE2-CG2 3.86Å; K770-I774 HydrophobicContact CB-CB 4.1Å; K770-I774 HydrophobicContact CB-CG2 3.76Å; K770-I774 HydrophobicContact CG-CG2 4.19Å; P771-I774 HydrophobicContact CB-CD1 4.21Å; P771-I774 HydrophobicContact CG-CD1 4.11Å; P771-I774 WeakPolarHBondContact O-CA 3.49Å; P771-I774 WeakPolarHBondContact O-CB 3.43Å; P771-I774 PolarHBondContact O-N 3.48Å; W772-I774 VanDerWaalsContact C-N 3.25Å; W772-I774 PolarHBondContact O-N 2.94Å; I774-Q776 VanDerWaalsContact C-N 3.3Å; I774-Q776 PolarHBondContact O-N 2.8Å; I774-R777 PolarHBondContact O-N 3.29Å; I774-R777 VanDerWaalsContact O-N 3.14Å; I774-I778 HydrophobicContact CG2-CG1 4.33Å; I774-I778 WeakPolarHBondContact O-CG1 3.3Å; I774-I778 PolarHBondContact O-N 3.14Å
775	Q	97.4	Very high	96.3	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.019	20%	0.203	C	C	.	.	H	α-helix	trans	-59.2	-39.4	-179.6	171.2	44.5	-148.5	0	0	112.6	A767 I768 P771 W772 R777 I778 A779 N849	A767-Q775 VanDerWaalsContact C-NE2 3.29Å; A767-Q775 PolarHBondContact O-NE2 3.01Å; I768-Q775 HydrophobicContact CD1-CG 4.41Å; P771-Q775 PolarHBondContact O-N 2.98Å; W772-Q775 PolarHBondContact O-N 3.35Å; Q775-R777 PolarHBondContact O-N 3.14Å; Q775-I778 PolarHBondContact O-N 2.91Å; Q775-A779 WeakPolarHBondContact O-CB 3.42Å; Q775-A779 PolarHBondContact O-N 3.27Å; Q775-N849 HydrophobicContact CG-CB 4.36Å
776	Q	94.9	Very high	96.1	Very high	70 Å²	70	40.4 Å²	40.4	33%	0.327	21%	0.207	S	C	.	.	H	α-helix	trans	-58.8	-47.7	174.5	-73.3	-176.1	-73.7	0	0	112.4	W772 I774 I778 A779 E780	W772-Q776 HydrophobicContact CD2-CG 3.82Å; W772-Q776 VanDerWaalsContact CE2-CG 3.4Å; W772-Q776 HydrophobicContact CE3-CG 4.12Å; W772-Q776 HydrophobicContact CG-CG 4.47Å; W772-Q776 HydrophobicContact CH2-CG 3.7Å; W772-Q776 HydrophobicContact CZ2-CG 3.35Å; W772-Q776 VanDerWaalsContact CZ2-NE2 3.27Å; W772-Q776 HydrophobicContact CZ3-CG 4.07Å; W772-Q776 WeakPolarHBondContact O-CG 3.4Å; W772-Q776 PolarHBondContact O-N 3.39Å; I774-Q776 VanDerWaalsContact C-N 3.3Å; I774-Q776 PolarHBondContact O-N 2.8Å; Q776-I778 PolarHBondContact O-N 3.05Å; Q776-A779 PolarHBondContact O-N 2.95Å; Q776-E780 WeakPolarHBondContact O-CG 3.46Å; Q776-E780 PolarHBondContact O-N 3.32Å
777	R	95.5	Very high	95.9	Very high	148 Å²	148	40.8 Å²	40.8	56%	0.558	21%	0.209	S	C	*	.	H	α-helix	trans	-63.1	-42.4	178.9	-70.6	-178.5	178	-173	0.3	111.9	F564 I774 Q775 E780 L781	F564-R777 HydrophobicContact CE2-CB 3.96Å; F564-R777 HydrophobicContact CE2-CG 4.48Å; F564-R777 HydrophobicContact CZ-CB 3.75Å; I774-R777 PolarHBondContact O-N 3.29Å; I774-R777 VanDerWaalsContact O-N 3.14Å; Q775-R777 PolarHBondContact O-N 3.14Å; R777-E780 WeakPolarHBondContact O-CB 3.32Å; R777-E780 PolarHBondContact O-N 3.02Å; R777-L781 WeakPolarHBondContact O-CG 3.36Å; R777-L781 PolarHBondContact O-N 3.3Å; R777-L781 VanDerWaalsContact O-N 3.13Å
778	I	96.1	Very high	95.7	Very high	20 Å²	20	43.6 Å²	43.6	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-64.5	-44.3	177.5	-62.3	-61.1	0	0	0	111.1	F564 Y612 A767 I774 Q775 Q776 E780 L781 V782	F564-I778 HydrophobicContact CE1-CD1 4.19Å; F564-I778 HydrophobicContact CZ-CD1 3.71Å; F564-I778 HydrophobicContact CZ-CG1 4.19Å; Y612-I778 HydrophobicContact CD2-CG2 4Å; Y612-I778 HydrophobicContact CE2-CG2 3.4Å; A767-I778 HydrophobicContact CB-CB 4.45Å; A767-I778 HydrophobicContact CB-CG1 4.47Å; A767-I778 HydrophobicContact CB-CG2 3.74Å; I774-I778 HydrophobicContact CG2-CG1 4.33Å; I774-I778 WeakPolarHBondContact O-CG1 3.3Å; I774-I778 PolarHBondContact O-N 3.14Å; Q775-I778 PolarHBondContact O-N 2.91Å; Q776-I778 PolarHBondContact O-N 3.05Å; I778-E780 PolarHBondContact O-N 2.82Å; I778-L781 HydrophobicContact CD1-CD1 4.34Å; I778-L781 PolarHBondContact O-N 3.34Å; I778-L781 VanDerWaalsContact O-N 3.08Å; I778-V782 HydrophobicContact CG2-CG2 4.26Å; I778-V782 WeakPolarHBondContact O-CG2 3.31Å; I778-V782 PolarHBondContact O-N 3.1Å
779	A	94.8	Very high	95.5	Very high	8 Å²	8	43.4 Å²	43.4	7%	0.066	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-34.3	177	0	0	0	0	0	112.2	Q775 Q776 A783 W853	Q775-A779 WeakPolarHBondContact O-CB 3.42Å; Q775-A779 PolarHBondContact O-N 3.27Å; Q776-A779 PolarHBondContact O-N 2.95Å; A779-A783 WeakPolarHBondContact O-CB 3.4Å; A779-A783 PolarHBondContact O-N 3.08Å; A779-W853 HydrophobicContact CB-CH2 4.02Å; A779-W853 HydrophobicContact CB-CZ2 3.63Å
780	E	93.8	Very high	95.3	Very high	128 Å²	128	43 Å²	43	60%	0.598	22%	0.218	S	C	*	.	H	α-helix	trans	-65.8	-41.3	173	-72.9	173.3	178.9	0	0	112.7	Q776 R777 I778 A783 S784	Q776-E780 WeakPolarHBondContact O-CG 3.46Å; Q776-E780 PolarHBondContact O-N 3.32Å; R777-E780 WeakPolarHBondContact O-CB 3.32Å; R777-E780 PolarHBondContact O-N 3.02Å; I778-E780 PolarHBondContact O-N 2.82Å; E780-A783 PolarHBondContact O-N 2.77Å; E780-S784 WeakPolarHBondContact O-CB 3.4Å; E780-S784 PolarHBondContact O-N 3.32Å
781	L	95.3	Very high	95.1	Very high	66 Å²	66	45 Å²	45	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-64.6	-46.9	176.3	-66.2	174.6	0	0	0	111.7	Y612 R777 I778 A783 S784 E785	Y612-L781 HydrophobicContact CD2-CB 4.46Å; R777-L781 WeakPolarHBondContact O-CG 3.36Å; R777-L781 PolarHBondContact O-N 3.3Å; R777-L781 VanDerWaalsContact O-N 3.13Å; I778-L781 HydrophobicContact CD1-CD1 4.34Å; I778-L781 PolarHBondContact O-N 3.34Å; I778-L781 VanDerWaalsContact O-N 3.08Å; L781-A783 PolarHBondContact O-N 2.89Å; L781-S784 WeakPolarHBondContact O-CB 3.48Å; L781-S784 PolarHBondContact O-N 2.96Å; L781-E785 PolarHBondContact O-N 3.42Å
782	V	94.9	Very high	94.8	Very high	31 Å²	31	47.1 Å²	47.1	19%	0.188	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-46.1	176.6	175.7	0	0	0	0	110.6	Y612 I778 S784 E785 F786	Y612-V782 HydrophobicContact CD1-CG2 3.72Å; Y612-V782 HydrophobicContact CD2-CG2 3.52Å; Y612-V782 HydrophobicContact CE1-CG2 3.93Å; Y612-V782 HydrophobicContact CE2-CG2 3.75Å; Y612-V782 HydrophobicContact CG-CG2 3.5Å; Y612-V782 VanDerWaalsContact CG-CG2 3.5Å; I778-V782 HydrophobicContact CG2-CG2 4.26Å; I778-V782 WeakPolarHBondContact O-CG2 3.31Å; I778-V782 PolarHBondContact O-N 3.1Å; V782-S784 VanDerWaalsContact C-N 3.34Å; V782-S784 PolarHBondContact O-N 2.88Å; V782-E785 PolarHBondContact O-N 3.04Å; V782-F786 HydrophobicContact CG1-CD2 4.32Å; V782-F786 HydrophobicContact CG1-CE2 4.08Å; V782-F786 HydrophobicContact CG1-CZ 4.3Å; V782-F786 PolarHBondContact O-N 3.49Å
783	A	92.9	Very high	94.5	Very high	12 Å²	12	44.7 Å²	44.7	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-41.8	177.6	0	0	0	0	0	111.6	A779 E780 L781 E785 F786 F787 I813	A779-A783 WeakPolarHBondContact O-CB 3.4Å; A779-A783 PolarHBondContact O-N 3.08Å; E780-A783 PolarHBondContact O-N 2.77Å; L781-A783 PolarHBondContact O-N 2.89Å; A783-E785 VanDerWaalsContact C-N 3.31Å; A783-E785 PolarHBondContact O-N 2.84Å; A783-F786 PolarHBondContact O-N 3.38Å; A783-F787 HydrophobicContact CB-CD2 4.45Å; A783-F787 HydrophobicContact CB-CE2 3.92Å; A783-F787 HydrophobicContact CB-CZ 4.24Å; A783-F787 WeakPolarHBondContact O-CB 3.4Å; A783-F787 WeakPolarHBondContact O-CD2 3.3Å; A783-F787 WeakPolarHBondContact O-CG 3.32Å; A783-F787 PolarHBondContact O-N 3.35Å; A783-I813 HydrophobicContact CB-CD1 3.78Å
784	S	93.5	Very high	94.3	Very high	43 Å²	43	45.1 Å²	45.1	30%	0.301	21%	0.213	S	C	.	.	H	α-helix	trans	-58.2	-45.2	175.5	-166	0	0	0	0	111.4	E780 L781 V782 F787 D788	E780-S784 WeakPolarHBondContact O-CB 3.4Å; E780-S784 PolarHBondContact O-N 3.32Å; L781-S784 WeakPolarHBondContact O-CB 3.48Å; L781-S784 PolarHBondContact O-N 2.96Å; V782-S784 VanDerWaalsContact C-N 3.34Å; V782-S784 PolarHBondContact O-N 2.88Å; S784-F787 PolarHBondContact O-N 2.98Å; S784-D788 PolarHBondContact O-N 3.26Å
785	E	95.3	Very high	94.1	Very high	8 Å²	8	52.1 Å²	52.1	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-44.6	179.4	-162.9	174.7	130.3	0	0	112.3	V610 A611 Y612 H613 H657 G659 L781 V782 A783 F787 D788 Q789	V610-E785 WeakPolarHBondContact CG1-OE2 3.37Å; A611-E785 HydrophobicContact CB-CB 4.26Å; Y612-E785 WeakPolarHBondContact CA-OE2 3.39Å; Y612-E785 WeakPolarHBondContact CB-OE2 3.19Å; Y612-E785 PolarHBondContact N-OE2 3.41Å; H613-E785 IonicContact CE1-OE1 3.9Å; H613-E785 PolarHBondContact CE1-OE1 3.08Å; H613-E785 IonicContact CG-OE1 2.75Å; H613-E785 PolarHBondContact N-OE2 3.4Å; H613-E785 VanDerWaalsContact N-OE2 3.13Å; H613-E785 VanDerWaalsContact ND1-CD 3.35Å; H613-E785 IonicContact ND1-OE1 2.63Å; H613-E785 PolarHBondContact ND1-OE1 3.46Å; H613-E785 IonicContact ND1-OE2 3.75Å; H613-E785 PolarHBondContact ND1-OE2 2.91Å; H657-E785 IonicContact CE1-OE1 2.95Å; G659-E785 WeakPolarHBondContact CA-OE1 3.37Å; L781-E785 PolarHBondContact O-N 3.42Å; V782-E785 PolarHBondContact O-N 3.04Å; A783-E785 VanDerWaalsContact C-N 3.31Å; A783-E785 PolarHBondContact O-N 2.84Å; E785-F787 VanDerWaalsContact C-N 3.31Å; E785-F787 PolarHBondContact O-N 3.08Å; E785-D788 PolarHBondContact O-N 3.33Å; E785-Q789 PolarHBondContact O-N 2.99Å
786	F	93.9	Very high	93.8	Very high	51 Å²	51	56.9 Å²	56.9	22%	0.224	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-35.6	175.4	-76.4	-5.2	0	0	0	113	V782 A783 Q789 G790 L804 M805	V782-F786 HydrophobicContact CG1-CD2 4.32Å; V782-F786 HydrophobicContact CG1-CE2 4.08Å; V782-F786 HydrophobicContact CG1-CZ 4.3Å; V782-F786 PolarHBondContact O-N 3.49Å; A783-F786 PolarHBondContact O-N 3.38Å; F786-Q789 PolarHBondContact O-N 3.31Å; F786-G790 PolarHBondContact O-N 3.01Å; F786-L804 HydrophobicContact CD2-CD1 3.93Å; F786-L804 HydrophobicContact CD2-CD2 3.86Å; F786-L804 HydrophobicContact CD2-CG 3.62Å; F786-L804 HydrophobicContact CE2-CD1 4.16Å; F786-L804 HydrophobicContact CE2-CD2 3.65Å; F786-L804 HydrophobicContact CE2-CG 3.93Å; F786-M805 HydrophobicContact CB-CG 4.06Å; F786-M805 HydrophobicContact CG-CG 4.48Å; F786-M805 WeakPolarHBondContact O-CB 3.47Å
787	F	94.1	Very high	93.5	Very high	11 Å²	11	55.7 Å²	55.7	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-40.3	174.4	-62.1	-29.5	0	0	0	112.2	A783 S784 E785 Q789 G790 D791 N806 R807 K810 I813	A783-F787 HydrophobicContact CB-CD2 4.45Å; A783-F787 HydrophobicContact CB-CE2 3.92Å; A783-F787 HydrophobicContact CB-CZ 4.24Å; A783-F787 WeakPolarHBondContact O-CB 3.4Å; A783-F787 WeakPolarHBondContact O-CD2 3.3Å; A783-F787 WeakPolarHBondContact O-CG 3.32Å; A783-F787 PolarHBondContact O-N 3.35Å; S784-F787 PolarHBondContact O-N 2.98Å; E785-F787 VanDerWaalsContact C-N 3.31Å; E785-F787 PolarHBondContact O-N 3.08Å; F787-Q789 VanDerWaalsContact C-N 3.33Å; F787-G790 PolarHBondContact O-N 2.86Å; F787-D791 VanDerWaalsContact O-CG 3.27Å; F787-D791 PolarHBondContact O-N 3.27Å; F787-N806 WeakPolarHBondContact CE1-O 3.22Å; F787-R807 HydrophobicContact CB-CB 4.06Å; F787-R807 HydrophobicContact CB-CG 4.11Å; F787-R807 HydrophobicContact CD1-CB 4.13Å; F787-R807 HydrophobicContact CD2-CB 4.26Å; F787-R807 HydrophobicContact CD2-CG 3.79Å; F787-R807 HydrophobicContact CE2-CG 4.32Å; F787-R807 HydrophobicContact CG-CB 3.9Å; F787-R807 HydrophobicContact CG-CG 3.91Å; F787-K810 HydrophobicContact CE2-CG 4.36Å; F787-K810 HydrophobicContact CZ-CB 4.32Å; F787-K810 HydrophobicContact CZ-CG 4.42Å; F787-I813 HydrophobicContact CE2-CD1 4.22Å; F787-I813 HydrophobicContact CZ-CD1 3.88Å; F787-I813 HydrophobicContact CZ-CG1 4.39Å
788	D	93.3	Very high	93.3	Very high	74 Å²	74	55.5 Å²	55.5	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-40.6	176	-65	-20.5	0	0	0	110.7	S784 E785 D791 R792 R807	S784-D788 PolarHBondContact O-N 3.26Å; E785-D788 PolarHBondContact O-N 3.33Å; D788-D791 PolarHBondContact O-N 3.49Å; D788-R792 WeakPolarHBondContact O-CG 2.94Å; D788-R792 PolarHBondContact O-N 2.97Å; D788-R792 VanDerWaalsContact O-N 3.11Å; D788-R807 IonicContact OD1-CZ 2.78Å; D788-R807 IonicContact OD1-NH1 2.67Å; D788-R807 IonicContact OD1-NH2 3.49Å; D788-R807 PolarHBondContact OD1-NH2 3.46Å
789	Q	93.6	Very high	92.9	Very high	3 Å²	3	57.5 Å²	57.5	1%	0.014	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-46.8	170.9	179.9	178.3	-32.1	0	0	111.8	V660 N661 Y664 E785 F786 F787 D791 R792 E793	V660-Q789 VanDerWaalsContact CA-OE1 3.28Å; V660-Q789 HydrophobicContact CG1-CG 4.16Å; N661-Q789 VanDerWaalsContact CG-NE2 3.26Å; N661-Q789 PolarHBondContact ND2-NE2 3.47Å; N661-Q789 PolarHBondContact OD1-NE2 3.32Å; Y664-Q789 HydrophobicContact CD2-CG 4.14Å; E785-Q789 PolarHBondContact O-N 2.99Å; F786-Q789 PolarHBondContact O-N 3.31Å; F787-Q789 VanDerWaalsContact C-N 3.33Å; Q789-D791 VanDerWaalsContact C-N 3.28Å; Q789-D791 PolarHBondContact O-N 3.37Å; Q789-R792 CarbonylContact O-C 3.53Å; Q789-R792 WeakPolarHBondContact O-CA 3.24Å; Q789-R792 WeakPolarHBondContact O-CB 3.49Å; Q789-R792 PolarHBondContact O-N 2.79Å; Q789-R792 VanDerWaalsContact O-N 3.08Å; Q789-E793 HydrophobicContact CG-CG 4.42Å; Q789-E793 PolarHBondContact NE2-OE1 3.03Å; Q789-E793 PolarHBondContact O-N 2.79Å
790	G	93.7	Very high	92.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-36.1	-179.8	0	0	0	0	0	113.3	F786 F787 E793 R794	F786-G790 PolarHBondContact O-N 3.01Å; F787-G790 PolarHBondContact O-N 2.86Å; G790-E793 PolarHBondContact O-N 2.95Å; G790-R794 PolarHBondContact O-N 2.89Å
791	D	92.7	Very high	92.3	Very high	51 Å²	51	58.8 Å²	58.8	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-68.4	-35.5	174.4	-69.2	-27.3	0	0	0	111.7	F787 D788 Q789 R794 K795 R807	F787-D791 VanDerWaalsContact O-CG 3.27Å; F787-D791 PolarHBondContact O-N 3.27Å; D788-D791 PolarHBondContact O-N 3.49Å; Q789-D791 VanDerWaalsContact C-N 3.28Å; Q789-D791 PolarHBondContact O-N 3.37Å; D791-R794 IonicContact OD1-NH1 3.86Å; D791-R794 PolarHBondContact OD1-NH1 2.79Å; D791-K795 WeakPolarHBondContact O-CB 3.45Å; D791-K795 PolarHBondContact O-N 2.72Å; D791-K795 VanDerWaalsContact O-N 3.09Å; D791-R807 IonicContact OD2-CZ 3.64Å; D791-R807 IonicContact OD2-NE 3.97Å; D791-R807 PolarHBondContact OD2-NE 3.39Å; D791-R807 IonicContact OD2-NH2 2.69Å; D791-R807 PolarHBondContact OD2-NH2 3.05Å
792	R	91.7	Very high	92	Very high	94 Å²	94	59.6 Å²	59.6	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-67.7	-44.4	171.7	-69.3	-179.4	71.3	-165.6	-2.4	112.4	Y664 D788 Q789 R794 K795 E796	Y664-R792 HydrophobicContact CE2-CB 4.2Å; D788-R792 WeakPolarHBondContact O-CG 2.94Å; D788-R792 PolarHBondContact O-N 2.97Å; D788-R792 VanDerWaalsContact O-N 3.11Å; Q789-R792 CarbonylContact O-C 3.53Å; Q789-R792 WeakPolarHBondContact O-CA 3.24Å; Q789-R792 WeakPolarHBondContact O-CB 3.49Å; Q789-R792 PolarHBondContact O-N 2.79Å; Q789-R792 VanDerWaalsContact O-N 3.08Å; R792-R794 VanDerWaalsContact C-N 3.28Å; R792-R794 PolarHBondContact O-N 2.82Å; R792-K795 PolarHBondContact O-N 3Å; R792-K795 VanDerWaalsContact O-N 3.14Å; R792-E796 IonicContact CZ-OE1 3.48Å; R792-E796 IonicContact NE-OE1 3.27Å; R792-E796 PolarHBondContact NE-OE1 3.21Å; R792-E796 IonicContact NH2-OE1 3.91Å; R792-E796 PolarHBondContact NH2-OE1 3.19Å; R792-E796 IonicContact NH2-OE2 2.77Å; R792-E796 PolarHBondContact NH2-OE2 3.37Å; R792-E796 WeakPolarHBondContact O-CB 3.38Å; R792-E796 PolarHBondContact O-N 2.88Å
793	E	93.3	Very high	91.6	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.023	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-42.7	175.6	-73.3	-176.5	-175.5	0	0	111.7	Y664 Q789 G790 K795 L797 N798 I799	Y664-E793 HydrophobicContact CD2-CG 3.44Å; Y664-E793 VanDerWaalsContact CD2-CG 3.44Å; Y664-E793 HydrophobicContact CE2-CB 4.49Å; Y664-E793 HydrophobicContact CE2-CG 3.58Å; Q789-E793 HydrophobicContact CG-CG 4.42Å; Q789-E793 PolarHBondContact NE2-OE1 3.03Å; Q789-E793 PolarHBondContact O-N 2.79Å; G790-E793 PolarHBondContact O-N 2.95Å; E793-K795 PolarHBondContact O-N 3.45Å; E793-L797 HydrophobicContact CG-CD1 4.41Å; E793-L797 CarbonylContact O-C 3.31Å; E793-L797 WeakPolarHBondContact O-CA 3.41Å; E793-L797 WeakPolarHBondContact O-CB 3.42Å; E793-L797 PolarHBondContact O-N 3.32Å; E793-L797 VanDerWaalsContact O-N 3.09Å; E793-N798 PolarHBondContact O-N 3.09Å; E793-I799 PolarHBondContact O-N 2.94Å
794	R	92.1	Very high	91.3	Very high	92 Å²	92	63.3 Å²	63.3	35%	0.347	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-41.4	176.6	-167.7	-176.3	-65.9	121.1	-5.7	112.1	G790 D791 R792 N798 I799	G790-R794 PolarHBondContact O-N 2.89Å; D791-R794 IonicContact OD1-NH1 3.86Å; D791-R794 PolarHBondContact OD1-NH1 2.79Å; R792-R794 VanDerWaalsContact C-N 3.28Å; R792-R794 PolarHBondContact O-N 2.82Å; R794-N798 WeakPolarHBondContact O-CA 3.35Å; R794-I799 WeakPolarHBondContact CA-O 3.4Å
795	K	92.3	Very high	91	Very high	175 Å²	175	62 Å²	62	76%	0.761	30%	0.299	S	S	*	.	H	α-helix	trans	-83.3	-43.6	-174	-175.2	-177.5	177.2	-173.7	0	114	D791 R792 E793	D791-K795 WeakPolarHBondContact O-CB 3.45Å; D791-K795 PolarHBondContact O-N 2.72Å; D791-K795 VanDerWaalsContact O-N 3.09Å; R792-K795 PolarHBondContact O-N 3Å; R792-K795 VanDerWaalsContact O-N 3.14Å; E793-K795 PolarHBondContact O-N 3.45Å
796	E	91.8	Very high	90.7	Very high	104 Å²	104	61.9 Å²	61.9	49%	0.486	30%	0.299	S	S	.	.	H	α-helix	trans	-90.1	-36.9	-172.7	-63	177.8	-149.5	0	0	111.4	Y664 R792	Y664-E796 PolarHBondContact OH-OE2 3.45Å; R792-E796 IonicContact CZ-OE1 3.48Å; R792-E796 IonicContact NE-OE1 3.27Å; R792-E796 PolarHBondContact NE-OE1 3.21Å; R792-E796 IonicContact NH2-OE1 3.91Å; R792-E796 PolarHBondContact NH2-OE1 3.19Å; R792-E796 IonicContact NH2-OE2 2.77Å; R792-E796 PolarHBondContact NH2-OE2 3.37Å; R792-E796 WeakPolarHBondContact O-CB 3.38Å; R792-E796 PolarHBondContact O-N 2.88Å
797	L	89.3	Confident	90.5	Very high	45 Å²	45	64.2 Å²	64.2	24%	0.236	31%	0.306	C	S	.	.	S	Bend	trans	-108.4	-7.3	-174.1	-53.8	177.9	0	0	0	113.8	Y664 R667 E793 I799	Y664-L797 HydrophobicContact CD2-CD1 4.25Å; Y664-L797 HydrophobicContact CE2-CD1 4.05Å; R667-L797 HydrophobicContact CB-CD1 3.98Å; E793-L797 HydrophobicContact CG-CD1 4.41Å; E793-L797 CarbonylContact O-C 3.31Å; E793-L797 WeakPolarHBondContact O-CA 3.41Å; E793-L797 WeakPolarHBondContact O-CB 3.42Å; E793-L797 PolarHBondContact O-N 3.32Å; E793-L797 VanDerWaalsContact O-N 3.09Å; L797-I799 HydrophobicContact CB-CD1 3.9Å; L797-I799 HydrophobicContact CB-CG1 4.1Å; L797-I799 HydrophobicContact CD1-CD1 4.38Å; L797-I799 PolarHBondContact O-N 3.24Å
798	N	89.9	Confident	90.1	Very high	145 Å²	145	71.1 Å²	71.1	78%	0.775	34%	0.339	S	S	*	.			trans	53.5	36.3	-173.8	-66.7	-32.2	0	0	0	113.4	E793 R794	E793-N798 PolarHBondContact O-N 3.09Å; R794-N798 WeakPolarHBondContact O-CA 3.35Å
799	I	88.9	Confident	89.7	Confident	62 Å²	62	70.6 Å²	70.6	32%	0.318	33%	0.333	S	S	.	.			trans	-106.9	142.1	178.1	-64.1	169.4	0	0	0	109.5	E793 R794 L797 P801	E793-I799 PolarHBondContact O-N 2.94Å; R794-I799 WeakPolarHBondContact CA-O 3.4Å; L797-I799 HydrophobicContact CB-CD1 3.9Å; L797-I799 HydrophobicContact CB-CG1 4.1Å; L797-I799 HydrophobicContact CD1-CD1 4.38Å; L797-I799 PolarHBondContact O-N 3.24Å; I799-P801 WeakPolarHBondContact O-CD 3.48Å
800	E	87.8	Confident	89.4	Confident	158 Å²	158	76.5 Å²	76.5	74%	0.738	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-75	119.7	170.4	-167.9	176.6	174	0	0	109.9
801	P	88.9	Confident	89	Confident	5 Å²	5	80.1 Å²	80.1	3%	0.032	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-69.8	152.4	-177.7	28.7	-34.8	0	0	0	111.2	I799 M805 N806	I799-P801 WeakPolarHBondContact O-CD 3.48Å; P801-M805 HydrophobicContact CB-CB 4.07Å; P801-N806 HydrophobicContact CG-CB 4.47Å
802	T	87.6	Confident	88.8	Confident	83 Å²	83	81.9 Å²	81.9	51%	0.509	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-61.7	160.6	175.7	65.4	0	0	0	0	112	L804 M805 N806	T802-L804 PolarHBondContact O-N 3.18Å; T802-M805 CarbonylContact O-C 3.19Å; T802-M805 PolarHBondContact O-N 2.88Å; T802-N806 PolarHBondContact O-N 3.38Å
803	D	86.8	Confident	88.6	Confident	57 Å²	57	78.9 Å²	78.9	31%	0.305	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.3	178.9	-77.8	25.7	0	0	0	113.2	M805 K809 K812	D803-M805 VanDerWaalsContact C-N 3.33Å; D803-M805 PolarHBondContact O-N 3.48Å; D803-K809 HydrophobicContact CB-CD 3.96Å; D803-K809 VanDerWaalsContact CG-NZ 3.26Å; D803-K809 WeakPolarHBondContact OD1-CD 3.4Å; D803-K809 IonicContact OD1-NZ 3.42Å; D803-K809 PolarHBondContact OD1-NZ 3.24Å; D803-K809 WeakPolarHBondContact OD2-CD 3.41Å; D803-K809 IonicContact OD2-NZ 3.75Å; D803-K809 PolarHBondContact OD2-NZ 3.34Å; D803-K812 IonicContact OD2-NZ 3.56Å; D803-K812 PolarHBondContact OD2-NZ 3.24Å
804	L	86	Confident	88.6	Confident	64 Å²	64	78.9 Å²	78.9	34%	0.335	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-34.1	179	-176.5	60.9	0	0	0	112.6	F786 T802 M816	F786-L804 HydrophobicContact CD2-CD1 3.93Å; F786-L804 HydrophobicContact CD2-CD2 3.86Å; F786-L804 HydrophobicContact CD2-CG 3.62Å; F786-L804 HydrophobicContact CE2-CD1 4.16Å; F786-L804 HydrophobicContact CE2-CD2 3.65Å; F786-L804 HydrophobicContact CE2-CG 3.93Å; T802-L804 PolarHBondContact O-N 3.18Å; L804-M816 VanDerWaalsContact CA-CE 3.43Å; L804-M816 HydrophobicContact CB-CE 3.44Å; L804-M816 VanDerWaalsContact CB-CE 3.44Å; L804-M816 HydrophobicContact CD1-CE 3.64Å; L804-M816 HydrophobicContact CD1-SD 4.23Å; L804-M816 HydrophobicContact CG-CE 4.08Å
805	M	88.8	Confident	88.6	Confident	15 Å²	15	77.4 Å²	77.4	7%	0.074	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	2.2	-175.6	-65.8	167.8	-179.6	0	0	111.9	N661 F786 P801 T802 D803	N661-M805 VanDerWaalsContact ND2-CE 3.33Å; N661-M805 WeakPolarHBondContact ND2-CE 3.37Å; F786-M805 HydrophobicContact CB-CG 4.06Å; F786-M805 HydrophobicContact CG-CG 4.48Å; F786-M805 WeakPolarHBondContact O-CB 3.47Å; P801-M805 HydrophobicContact CB-CB 4.07Å; T802-M805 CarbonylContact O-C 3.19Å; T802-M805 PolarHBondContact O-N 2.88Å; D803-M805 VanDerWaalsContact C-N 3.33Å; D803-M805 PolarHBondContact O-N 3.48Å
806	N	88.4	Confident	88.5	Confident	5 Å²	5	71.8 Å²	71.8	3%	0.027	36%	0.355	C	S	.	.			trans	-94	109.3	179.8	-170.8	-16.4	0	0	0	111.1	F787 P801 T802 E808 K809	F787-N806 WeakPolarHBondContact CE1-O 3.22Å; P801-N806 HydrophobicContact CG-CB 4.47Å; T802-N806 PolarHBondContact O-N 3.38Å; N806-E808 PolarHBondContact O-N 3.29Å; N806-E808 VanDerWaalsContact O-N 3.11Å; N806-E808 WeakPolarHBondContact OD1-CB 3.43Å; N806-E808 PolarHBondContact OD1-N 2.88Å; N806-K809 HydrophobicContact CB-CG 4.45Å; N806-K809 PolarHBondContact O-N 3.32Å
807	R	89.1	Confident	88.5	Confident	100 Å²	100	68.4 Å²	68.4	38%	0.377	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-57	-27.1	179.8	-157.3	-177.6	-58.6	-99.1	2.5	113.6	F787 D788 D791 K809 K810	F787-R807 HydrophobicContact CB-CB 4.06Å; F787-R807 HydrophobicContact CB-CG 4.11Å; F787-R807 HydrophobicContact CD1-CB 4.13Å; F787-R807 HydrophobicContact CD2-CB 4.26Å; F787-R807 HydrophobicContact CD2-CG 3.79Å; F787-R807 HydrophobicContact CE2-CG 4.32Å; F787-R807 HydrophobicContact CG-CB 3.9Å; F787-R807 HydrophobicContact CG-CG 3.91Å; D788-R807 IonicContact OD1-CZ 2.78Å; D788-R807 IonicContact OD1-NH1 2.67Å; D788-R807 IonicContact OD1-NH2 3.49Å; D788-R807 PolarHBondContact OD1-NH2 3.46Å; D791-R807 IonicContact OD2-CZ 3.64Å; D791-R807 IonicContact OD2-NE 3.97Å; D791-R807 PolarHBondContact OD2-NE 3.39Å; D791-R807 IonicContact OD2-NH2 2.69Å; D791-R807 PolarHBondContact OD2-NH2 3.05Å; R807-K809 VanDerWaalsContact C-N 3.27Å; R807-K809 PolarHBondContact O-N 3.34Å; R807-K810 PolarHBondContact O-N 3.11Å
808	E	85.6	Confident	88.9	Confident	157 Å²	157	66.8 Å²	66.8	73%	0.734	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-71.1	-23.5	177.6	-59.9	177.6	168.2	0	0	112.6	N806 K810	N806-E808 PolarHBondContact O-N 3.29Å; N806-E808 VanDerWaalsContact O-N 3.11Å; N806-E808 WeakPolarHBondContact OD1-CB 3.43Å; N806-E808 PolarHBondContact OD1-N 2.88Å; E808-K810 VanDerWaalsContact C-N 3.34Å
809	K	85.8	Confident	89.1	Confident	62 Å²	62	61.8 Å²	61.8	27%	0.27	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-98	25.1	-179.8	-61.7	-175.1	-176	176.6	0	112.4	D803 N806 R807 N811 K812	D803-K809 HydrophobicContact CB-CD 3.96Å; D803-K809 VanDerWaalsContact CG-NZ 3.26Å; D803-K809 WeakPolarHBondContact OD1-CD 3.4Å; D803-K809 IonicContact OD1-NZ 3.42Å; D803-K809 PolarHBondContact OD1-NZ 3.24Å; D803-K809 WeakPolarHBondContact OD2-CD 3.41Å; D803-K809 IonicContact OD2-NZ 3.75Å; D803-K809 PolarHBondContact OD2-NZ 3.34Å; N806-K809 HydrophobicContact CB-CG 4.45Å; N806-K809 PolarHBondContact O-N 3.32Å; R807-K809 VanDerWaalsContact C-N 3.27Å; R807-K809 PolarHBondContact O-N 3.34Å; K809-N811 PolarHBondContact O-N 2.99Å; K809-N811 VanDerWaalsContact O-N 3.1Å; K809-N811 PolarHBondContact O-OD1 3.45Å; K809-K812 WeakPolarHBondContact O-CB 3.44Å; K809-K812 PolarHBondContact O-N 2.88Å
810	K	86.5	Confident	89.3	Confident	127 Å²	127	61.9 Å²	61.9	55%	0.552	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-53.3	-32.7	178.8	-173	179.2	-178.9	177.3	0	113.3	F787 R807 E808 K812 I813	F787-K810 HydrophobicContact CE2-CG 4.36Å; F787-K810 HydrophobicContact CZ-CB 4.32Å; F787-K810 HydrophobicContact CZ-CG 4.42Å; R807-K810 PolarHBondContact O-N 3.11Å; E808-K810 VanDerWaalsContact C-N 3.34Å; K810-K812 PolarHBondContact O-N 3.43Å; K810-I813 HydrophobicContact CB-CD1 4.49Å; K810-I813 HydrophobicContact CG-CD1 3.68Å; K810-I813 WeakPolarHBondContact O-CB 3.32Å; K810-I813 VanDerWaalsContact O-CG1 3.27Å; K810-I813 WeakPolarHBondContact O-CG1 3.37Å; K810-I813 PolarHBondContact O-N 3.06Å
811	N	86.8	Confident	89.8	Confident	77 Å²	77	54.4 Å²	54.4	41%	0.412	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.2	175.5	61.5	-36.1	0	0	0	113.6	K809 Q860	K809-N811 PolarHBondContact O-N 2.99Å; K809-N811 VanDerWaalsContact O-N 3.1Å; K809-N811 PolarHBondContact O-OD1 3.45Å; N811-Q860 VanDerWaalsContact O-CD 3.26Å; N811-Q860 PolarHBondContact O-NE2 3.27Å; N811-Q860 PolarHBondContact O-OE1 3.41Å
812	K	86.8	Confident	90.1	Very high	88 Å²	88	57 Å²	57	38%	0.383	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-84.7	-12.3	176	-65.4	-168.6	178.7	-176.8	0	114.1	D803 K809 K810 P814 S815 M816	D803-K812 IonicContact OD2-NZ 3.56Å; D803-K812 PolarHBondContact OD2-NZ 3.24Å; K809-K812 WeakPolarHBondContact O-CB 3.44Å; K809-K812 PolarHBondContact O-N 2.88Å; K810-K812 PolarHBondContact O-N 3.43Å; K812-P814 VanDerWaalsContact C-N 3.33Å; K812-P814 VanDerWaalsContact O-N 3.17Å; K812-S815 PolarHBondContact O-N 2.81Å; K812-S815 PolarHBondContact O-OG 3.19Å; K812-M816 HydrophobicContact CB-CG 4.45Å; K812-M816 HydrophobicContact CB-SD 4.31Å; K812-M816 WeakPolarHBondContact O-CG 3.43Å; K812-M816 PolarHBondContact O-N 3.33Å; K812-M816 VanDerWaalsContact O-N 3.17Å
813	I	88.3	Confident	90.3	Very high	30 Å²	30	55.4 Å²	55.4	15%	0.154	29%	0.286	C	S	.	.	H	α-helix	trans	-47	-48.3	-176.4	-69.4	172	0	0	0	112.5	A783 F787 K810 S815 M816 Q817	A783-I813 HydrophobicContact CB-CD1 3.78Å; F787-I813 HydrophobicContact CE2-CD1 4.22Å; F787-I813 HydrophobicContact CZ-CD1 3.88Å; F787-I813 HydrophobicContact CZ-CG1 4.39Å; K810-I813 HydrophobicContact CB-CD1 4.49Å; K810-I813 HydrophobicContact CG-CD1 3.68Å; K810-I813 WeakPolarHBondContact O-CB 3.32Å; K810-I813 VanDerWaalsContact O-CG1 3.27Å; K810-I813 WeakPolarHBondContact O-CG1 3.37Å; K810-I813 PolarHBondContact O-N 3.06Å; I813-S815 VanDerWaalsContact C-N 3.34Å; I813-S815 PolarHBondContact O-N 3.29Å; I813-M816 PolarHBondContact O-N 3.06Å; I813-M816 VanDerWaalsContact O-N 3.09Å; I813-Q817 HydrophobicContact CG2-CG 3.99Å; I813-Q817 WeakPolarHBondContact O-CG 3.42Å; I813-Q817 PolarHBondContact O-N 2.91Å
814	P	92.9	Very high	90.7	Very high	6 Å²	6	53.4 Å²	53.4	4%	0.039	28%	0.275	C	S	.	.	H	α-helix	trans	-57.8	-43.5	-178.4	-30.6	41.4	0	0	0	113.7	K812 M816 Q817 V818 W853 L856 A857	K812-P814 VanDerWaalsContact C-N 3.33Å; K812-P814 VanDerWaalsContact O-N 3.17Å; P814-M816 VanDerWaalsContact C-N 3.33Å; P814-M816 PolarHBondContact O-N 3.26Å; P814-Q817 PolarHBondContact O-N 3.2Å; P814-V818 WeakPolarHBondContact O-CG2 3.19Å; P814-V818 PolarHBondContact O-N 2.9Å; P814-V818 VanDerWaalsContact O-N 3.1Å; P814-W853 HydrophobicContact CB-CE3 3.86Å; P814-W853 HydrophobicContact CB-CZ3 4.32Å; P814-W853 HydrophobicContact CG-CE3 4.08Å; P814-W853 HydrophobicContact CG-CZ3 4.03Å; P814-L856 HydrophobicContact CB-CB 3.97Å; P814-L856 HydrophobicContact CG-CB 4.12Å; P814-A857 HydrophobicContact CB-CB 4.01Å
815	S	91.8	Very high	91.2	Very high	61 Å²	61	50.4 Å²	50.4	43%	0.427	26%	0.259	S	S	.	.	H	α-helix	trans	-65.2	-37	177.2	68.3	0	0	0	0	112.5	K812 I813 V818 G819	K812-S815 PolarHBondContact O-N 2.81Å; K812-S815 PolarHBondContact O-OG 3.19Å; I813-S815 VanDerWaalsContact C-N 3.34Å; I813-S815 PolarHBondContact O-N 3.29Å; S815-V818 PolarHBondContact O-N 2.99Å; S815-G819 PolarHBondContact O-N 3.21Å; S815-G819 VanDerWaalsContact O-N 3.07Å
816	M	90.3	Very high	91.5	Very high	56 Å²	56	50.8 Å²	50.8	28%	0.276	26%	0.262	S	S	.	.	H	α-helix	trans	-70.2	-39.5	178.3	-58.5	-175.9	79.2	0	0	111.6	L804 K812 I813 P814 G819 F820	L804-M816 VanDerWaalsContact CA-CE 3.43Å; L804-M816 HydrophobicContact CB-CE 3.44Å; L804-M816 VanDerWaalsContact CB-CE 3.44Å; L804-M816 HydrophobicContact CD1-CE 3.64Å; L804-M816 HydrophobicContact CD1-SD 4.23Å; L804-M816 HydrophobicContact CG-CE 4.08Å; K812-M816 HydrophobicContact CB-CG 4.45Å; K812-M816 HydrophobicContact CB-SD 4.31Å; K812-M816 WeakPolarHBondContact O-CG 3.43Å; K812-M816 PolarHBondContact O-N 3.33Å; K812-M816 VanDerWaalsContact O-N 3.17Å; I813-M816 PolarHBondContact O-N 3.06Å; I813-M816 VanDerWaalsContact O-N 3.09Å; P814-M816 VanDerWaalsContact C-N 3.33Å; P814-M816 PolarHBondContact O-N 3.26Å; M816-G819 PolarHBondContact O-N 3.32Å; M816-F820 WeakPolarHBondContact O-CB 3.44Å; M816-F820 PolarHBondContact O-N 3.45Å
817	Q	93.2	Very high	91.9	Very high	33 Å²	33	54.7 Å²	54.7	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-41.5	173.7	-71.2	-58	104.9	0	0	111.6	I813 P814 F820 I821 W853	I813-Q817 HydrophobicContact CG2-CG 3.99Å; I813-Q817 WeakPolarHBondContact O-CG 3.42Å; I813-Q817 PolarHBondContact O-N 2.91Å; P814-Q817 PolarHBondContact O-N 3.2Å; Q817-F820 PolarHBondContact O-N 3.28Å; Q817-I821 WeakPolarHBondContact O-CB 3.3Å; Q817-I821 WeakPolarHBondContact O-CD1 3.3Å; Q817-I821 WeakPolarHBondContact O-CG1 3.26Å; Q817-I821 PolarHBondContact O-N 3.07Å; Q817-W853 HydrophobicContact CB-CD2 3.97Å; Q817-W853 HydrophobicContact CB-CE3 4.47Å; Q817-W853 HydrophobicContact CB-CG 3.99Å; Q817-W853 HydrophobicContact CG-CD2 4.25Å; Q817-W853 HydrophobicContact CG-CZ2 4.24Å
818	V	96	Very high	92.3	Very high	12 Å²	12	50 Å²	50	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-60.1	-47.8	173.8	174.1	0	0	0	0	110.7	P814 S815 F820 I821 D822 W853 Q854	P814-V818 WeakPolarHBondContact O-CG2 3.19Å; P814-V818 PolarHBondContact O-N 2.9Å; P814-V818 VanDerWaalsContact O-N 3.1Å; S815-V818 PolarHBondContact O-N 2.99Å; V818-F820 VanDerWaalsContact C-N 3.33Å; V818-F820 PolarHBondContact O-N 3.29Å; V818-I821 PolarHBondContact O-N 3.37Å; V818-D822 WeakPolarHBondContact O-CB 3.44Å; V818-D822 PolarHBondContact O-N 3.39Å; V818-W853 HydrophobicContact CG2-CB 3.78Å; V818-Q854 HydrophobicContact CG2-CB 4.18Å
819	G	94.4	Very high	93	Very high	39 Å²	39	42.5 Å²	42.5	40%	0.402	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-42.2	177.2	0	0	0	0	0	113	S815 M816 A823	S815-G819 PolarHBondContact O-N 3.21Å; S815-G819 VanDerWaalsContact O-N 3.07Å; M816-G819 PolarHBondContact O-N 3.32Å; G819-A823 WeakPolarHBondContact O-CB 3.24Å; G819-A823 PolarHBondContact O-N 2.95Å
820	F	94.3	Very high	93.5	Very high	65 Å²	65	42.8 Å²	42.8	29%	0.285	23%	0.23	S	C	.	.	H	α-helix	trans	-63.6	-46.8	175.7	174.7	-108.8	0	0	0	112.3	L725 L765 M816 Q817 V818 D822 A823 I824 C825	L725-F820 HydrophobicContact CD2-CE2 4.48Å; L765-F820 HydrophobicContact CD1-CZ 4.19Å; L765-F820 HydrophobicContact CD2-CZ 4.02Å; M816-F820 WeakPolarHBondContact O-CB 3.44Å; M816-F820 PolarHBondContact O-N 3.45Å; Q817-F820 PolarHBondContact O-N 3.28Å; V818-F820 VanDerWaalsContact C-N 3.33Å; V818-F820 PolarHBondContact O-N 3.29Å; F820-D822 VanDerWaalsContact C-N 3.32Å; F820-D822 PolarHBondContact O-N 3.12Å; F820-A823 PolarHBondContact O-N 3.16Å; F820-I824 HydrophobicContact CD2-CB 4.19Å; F820-I824 HydrophobicContact CD2-CG1 3.91Å; F820-I824 HydrophobicContact CE2-CB 3.97Å; F820-I824 HydrophobicContact CE2-CG1 3.92Å; F820-I824 HydrophobicContact CE2-CG2 4.05Å; F820-I824 HydrophobicContact CZ-CG2 4.37Å; F820-I824 WeakPolarHBondContact O-CB 3.43Å; F820-I824 PolarHBondContact O-N 3.22Å; F820-C825 WeakPolarHBondContact CE1-SG 3.49Å
821	I	96.8	Very high	94	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-59.3	-45	178.4	-69.3	163.9	0	0	0	110.9	I768 Q817 V818 C825 L826 R850	I768-I821 HydrophobicContact CD1-CD1 3.9Å; I768-I821 HydrophobicContact CD1-CG1 3.86Å; I768-I821 HydrophobicContact CG1-CD1 4.13Å; I768-I821 HydrophobicContact CG1-CG1 3.7Å; Q817-I821 WeakPolarHBondContact O-CB 3.3Å; Q817-I821 WeakPolarHBondContact O-CD1 3.3Å; Q817-I821 WeakPolarHBondContact O-CG1 3.26Å; Q817-I821 PolarHBondContact O-N 3.07Å; V818-I821 PolarHBondContact O-N 3.37Å; I821-C825 PolarHBondContact O-N 3.01Å; I821-C825 VanDerWaalsContact O-N 3.12Å; I821-L826 HydrophobicContact CG2-CD1 4.37Å; I821-L826 HydrophobicContact CG2-CD2 4.32Å; I821-L826 HydrophobicContact CG2-CG 3.86Å; I821-L826 PolarHBondContact O-N 3.22Å; I821-R850 HydrophobicContact CD1-CB 4.22Å; I821-R850 HydrophobicContact CG2-CB 3.94Å; I821-R850 HydrophobicContact CG2-CG 4.01Å
822	D	95.6	Very high	94.5	Very high	60 Å²	60	33.8 Å²	33.8	32%	0.321	19%	0.188	S	C	.	.	I	π-helix	trans	-69.2	-43.8	-179.4	-76.2	-20.4	0	0	0	112.7	V818 F820 L826 R850	V818-D822 WeakPolarHBondContact O-CB 3.44Å; V818-D822 PolarHBondContact O-N 3.39Å; F820-D822 VanDerWaalsContact C-N 3.32Å; F820-D822 PolarHBondContact O-N 3.12Å; D822-L826 WeakPolarHBondContact OD1-CD1 3.23Å; D822-R850 IonicContact OD1-CZ 2.59Å; D822-R850 IonicContact OD1-NE 3.79Å; D822-R850 PolarHBondContact OD1-NE 2.81Å; D822-R850 IonicContact OD1-NH2 3.6Å; D822-R850 PolarHBondContact OD1-NH2 3.02Å; D822-R850 IonicContact OD2-CZ 2.62Å; D822-R850 IonicContact OD2-NE 2.82Å; D822-R850 PolarHBondContact OD2-NE 3.07Å; D822-R850 IonicContact OD2-NH2 3.46Å; D822-R850 PolarHBondContact OD2-NH2 3.38Å
823	A	93.1	Very high	95	Very high	50 Å²	50	30.5 Å²	30.5	41%	0.413	18%	0.175	S	C	.	.	I	π-helix	trans	-77	-31	-174.2	0	0	0	0	0	113.1	R732 G819 F820	R732-A823 PolarHBondContact NH1-O 3.47Å; G819-A823 WeakPolarHBondContact O-CB 3.24Å; G819-A823 PolarHBondContact O-N 2.95Å; F820-A823 PolarHBondContact O-N 3.16Å
824	I	93.9	Very high	95.3	Very high	15 Å²	15	36 Å²	36	8%	0.077	20%	0.2	C	C	.	.	I	π-helix	trans	-121	-55.6	-169	-55.4	-61.1	0	0	0	111.8	L725 Y728 I729 L765 F820	L725-I824 HydrophobicContact CD1-CG2 3.96Å; L725-I824 HydrophobicContact CD2-CD1 4.44Å; Y728-I824 HydrophobicContact CE1-CD1 4.29Å; Y728-I824 HydrophobicContact CE1-CG2 3.88Å; Y728-I824 PolarHBondContact OH-O 3.47Å; Y728-I824 VanDerWaalsContact OH-O 3.13Å; I729-I824 HydrophobicContact CD1-CD1 4.34Å; I729-I824 HydrophobicContact CG1-CD1 4.35Å; L765-I824 HydrophobicContact CD1-CG2 3.65Å; F820-I824 HydrophobicContact CD2-CB 4.19Å; F820-I824 HydrophobicContact CD2-CG1 3.91Å; F820-I824 HydrophobicContact CE2-CB 3.97Å; F820-I824 HydrophobicContact CE2-CG1 3.92Å; F820-I824 HydrophobicContact CE2-CG2 4.05Å; F820-I824 HydrophobicContact CZ-CG2 4.37Å; F820-I824 WeakPolarHBondContact O-CB 3.43Å; F820-I824 PolarHBondContact O-N 3.22Å
825	C	96.4	Very high	95.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.203	C	C	.	.	I	π-helix	trans	-78.4	-46.6	-163.4	-54.2	0	0	0	0	114.2	I768 F820 I821 Q827 L828 Y829	I768-C825 HydrophobicContact CG2-CB 4.21Å; F820-C825 WeakPolarHBondContact CE1-SG 3.49Å; I821-C825 PolarHBondContact O-N 3.01Å; I821-C825 VanDerWaalsContact O-N 3.12Å; C825-Q827 PolarHBondContact O-N 3.34Å; C825-L828 PolarHBondContact O-N 2.86Å; C825-Y829 HydrophobicContact CB-CD2 4.26Å; C825-Y829 HydrophobicContact CB-CE2 4.09Å; C825-Y829 WeakPolarHBondContact O-CD2 3.39Å; C825-Y829 PolarHBondContact O-N 2.94Å; C825-Y829 VanDerWaalsContact O-N 3.11Å
826	L	96.7	Very high	95.6	Very high	23 Å²	23	34 Å²	34	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-50.8	-170.2	-79.1	179.4	0	0	0	112.7	I821 D822 L828 Y829 E830 L843 R847	I821-L826 HydrophobicContact CG2-CD1 4.37Å; I821-L826 HydrophobicContact CG2-CD2 4.32Å; I821-L826 HydrophobicContact CG2-CG 3.86Å; I821-L826 PolarHBondContact O-N 3.22Å; D822-L826 WeakPolarHBondContact OD1-CD1 3.23Å; L826-L828 PolarHBondContact O-N 2.91Å; L826-Y829 PolarHBondContact O-N 3.3Å; L826-E830 WeakPolarHBondContact O-CB 3.15Å; L826-E830 VanDerWaalsContact O-CG 3.29Å; L826-E830 WeakPolarHBondContact O-CG 3.47Å; L826-E830 PolarHBondContact O-N 3.33Å; L826-L843 HydrophobicContact CD2-CD1 4.29Å; L826-R847 HydrophobicContact CD2-CG 3.88Å
827	Q	96.7	Very high	95.9	Very high	87 Å²	87	39 Å²	39	41%	0.407	21%	0.209	S	C	.	.	H	α-helix	trans	-60.2	-36.5	-178.1	-63.4	-177.6	-32.8	0	0	111.9	F736 C825 A831	F736-Q827 HydrophobicContact CD2-CB 4.37Å; F736-Q827 HydrophobicContact CE1-CB 4.33Å; F736-Q827 WeakPolarHBondContact CE1-O 3.47Å; F736-Q827 HydrophobicContact CE2-CB 3.58Å; F736-Q827 HydrophobicContact CE2-CG 4.47Å; F736-Q827 HydrophobicContact CZ-CB 3.56Å; C825-Q827 PolarHBondContact O-N 3.34Å; Q827-A831 WeakPolarHBondContact O-CB 3.1Å; Q827-A831 PolarHBondContact O-N 3.3Å
828	L	97.8	Very high	96.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-49.2	177.6	-180	57	0	0	0	111.5	Y728 M758 T761 A762 C825 L826 A831 L832	Y728-L828 HydrophobicContact CE2-CD1 4.22Å; Y728-L828 HydrophobicContact CE2-CD2 4.19Å; M758-L828 HydrophobicContact CB-CD1 4.08Å; M758-L828 HydrophobicContact SD-CD1 4.33Å; T761-L828 HydrophobicContact CG2-CD2 4.04Å; A762-L828 HydrophobicContact CB-CD1 4.48Å; A762-L828 HydrophobicContact CB-CD2 3.92Å; A762-L828 HydrophobicContact CB-CG 4.1Å; C825-L828 PolarHBondContact O-N 2.86Å; L826-L828 PolarHBondContact O-N 2.91Å; L828-A831 PolarHBondContact O-N 3.06Å; L828-L832 WeakPolarHBondContact O-CB 3.14Å; L828-L832 PolarHBondContact O-N 3.35Å
829	Y	98.4	Very high	96.2	Very high	1 Å²	1	40 Å²	40	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-72	-29.2	-179.8	-66.3	-57.6	0	0	0	113.2	A762 L765 S766 I768 T769 C825 L826 L832 T833 L842 C846	A762-Y829 HydrophobicContact CB-CE1 4.02Å; A762-Y829 PolarHBondContact O-OH 2.88Å; L765-Y829 VanDerWaalsContact C-OH 3.32Å; L765-Y829 PolarHBondContact O-OH 2.69Å; S766-Y829 WeakPolarHBondContact CA-OH 3.34Å; S766-Y829 PolarHBondContact N-OH 2.87Å; I768-Y829 HydrophobicContact CG2-CE2 3.8Å; T769-Y829 HydrophobicContact CG2-CD2 4.13Å; T769-Y829 HydrophobicContact CG2-CE1 3.97Å; T769-Y829 HydrophobicContact CG2-CE2 3.5Å; T769-Y829 VanDerWaalsContact CG2-CE2 3.5Å; T769-Y829 VanDerWaalsContact CG2-CZ 3.42Å; C825-Y829 HydrophobicContact CB-CD2 4.26Å; C825-Y829 HydrophobicContact CB-CE2 4.09Å; C825-Y829 WeakPolarHBondContact O-CD2 3.39Å; C825-Y829 PolarHBondContact O-N 2.94Å; C825-Y829 VanDerWaalsContact O-N 3.11Å; L826-Y829 PolarHBondContact O-N 3.3Å; Y829-L832 HydrophobicContact CD1-CD2 4.39Å; Y829-T833 WeakPolarHBondContact O-CB 3.38Å; Y829-T833 PolarHBondContact O-N 2.84Å; Y829-T833 PolarHBondContact O-OG1 3.49Å; Y829-L842 HydrophobicContact CD1-CB 3.79Å; Y829-L842 HydrophobicContact CD1-CD1 4.3Å; Y829-L842 HydrophobicContact CE1-CB 4.1Å; Y829-L842 HydrophobicContact CE1-CD1 4.22Å; Y829-L842 HydrophobicContact CG-CB 4.43Å; Y829-C846 HydrophobicContact CD2-CB 4.07Å
830	E	97.6	Very high	96.4	Very high	68 Å²	68	42.5 Å²	42.5	32%	0.318	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-50.5	169.8	-73.5	176.8	168.4	0	0	110.9	L826 L832 T833 H834 L843 R847	L826-E830 WeakPolarHBondContact O-CB 3.15Å; L826-E830 VanDerWaalsContact O-CG 3.29Å; L826-E830 WeakPolarHBondContact O-CG 3.47Å; L826-E830 PolarHBondContact O-N 3.33Å; E830-L832 PolarHBondContact O-N 2.78Å; E830-T833 PolarHBondContact O-N 3.39Å; E830-H834 PolarHBondContact O-CD2 3.13Å; E830-H834 PolarHBondContact O-N 2.62Å; E830-H834 VanDerWaalsContact O-N 3.09Å; E830-L843 HydrophobicContact CG-CD1 3.58Å; E830-L843 HydrophobicContact CG-CD2 3.84Å; E830-L843 HydrophobicContact CG-CG 4.37Å; E830-R847 IonicContact OE1-CZ 3.31Å; E830-R847 IonicContact OE1-NE 3.59Å; E830-R847 IonicContact OE1-NH2 3.62Å; E830-R847 PolarHBondContact OE1-NH2 3.48Å
831	A	97	Very high	96.6	Very high	7 Å²	7	42.5 Å²	42.5	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-40.3	176.9	0	0	0	0	0	112.4	F735 F736 I739 Q827 L828 T833 H834 V835	F735-A831 HydrophobicContact CD1-CB 4.11Å; F735-A831 HydrophobicContact CE1-CB 3.58Å; F735-A831 HydrophobicContact CZ-CB 4.44Å; F736-A831 HydrophobicContact CD1-CB 3.69Å; F736-A831 HydrophobicContact CE1-CB 3.71Å; I739-A831 HydrophobicContact CG1-CB 4.46Å; Q827-A831 WeakPolarHBondContact O-CB 3.1Å; Q827-A831 PolarHBondContact O-N 3.3Å; L828-A831 PolarHBondContact O-N 3.06Å; A831-T833 VanDerWaalsContact C-N 3.33Å; A831-T833 PolarHBondContact O-N 3.49Å; A831-H834 WeakPolarHBondContact O-CB 3.29Å; A831-H834 PolarHBondContact O-N 3.3Å; A831-V835 PolarHBondContact O-N 3.48Å
832	L	96.8	Very high	96.7	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-39.8	176.3	-175.6	62.1	0	0	0	111.9	I634 F755 L759 A762 L828 Y829 E830 H834 V835 S836 C839 L842	I634-L832 HydrophobicContact CD1-CD1 4.11Å; F755-L832 HydrophobicContact CE2-CD1 4.16Å; L759-L832 HydrophobicContact CD1-CD1 4.09Å; A762-L832 HydrophobicContact CB-CD2 4.05Å; L828-L832 WeakPolarHBondContact O-CB 3.14Å; L828-L832 PolarHBondContact O-N 3.35Å; Y829-L832 HydrophobicContact CD1-CD2 4.39Å; E830-L832 PolarHBondContact O-N 2.78Å; L832-H834 VanDerWaalsContact C-N 3.29Å; L832-H834 PolarHBondContact O-N 3.12Å; L832-V835 PolarHBondContact O-N 3.23Å; L832-V835 VanDerWaalsContact O-N 3.13Å; L832-S836 PolarHBondContact O-N 3.38Å; L832-C839 HydrophobicContact CD2-CB 4.25Å; L832-C839 HydrophobicContact CG-CB 4.02Å; L832-L842 HydrophobicContact CD2-CD1 3.94Å
833	T	97.1	Very high	96.8	Very high	19 Å²	19	40 Å²	40	12%	0.117	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-32.8	176.1	-55.3	0	0	0	0	111.8	Y829 E830 A831 V835 S836 E837 F840	Y829-T833 WeakPolarHBondContact O-CB 3.38Å; Y829-T833 PolarHBondContact O-N 2.84Å; Y829-T833 PolarHBondContact O-OG1 3.49Å; E830-T833 PolarHBondContact O-N 3.39Å; A831-T833 VanDerWaalsContact C-N 3.33Å; A831-T833 PolarHBondContact O-N 3.49Å; T833-V835 VanDerWaalsContact C-N 3.33Å; T833-S836 WeakPolarHBondContact CA-O 3.42Å; T833-S836 CarbonylContact O-C 3.54Å; T833-S836 PolarHBondContact O-N 2.99Å; T833-E837 WeakPolarHBondContact O-CA 3.39Å; T833-E837 PolarHBondContact O-N 2.97Å; T833-F840 HydrophobicContact CG2-CB 3.9Å; T833-F840 HydrophobicContact CG2-CD2 4.11Å
834	H	95.3	Very high	97.1	Very high	145 Å²	145	40 Å²	40	67%	0.671	20%	0.2	S	C	*	.	H	α-helix	trans	-66.5	-32.2	172.2	-80	-70.4	0	0	0	113	I739 E830 A831 L832	I739-H834 HydrophobicContact CG2-CB 3.59Å; E830-H834 PolarHBondContact O-CD2 3.13Å; E830-H834 PolarHBondContact O-N 2.62Å; E830-H834 VanDerWaalsContact O-N 3.09Å; A831-H834 WeakPolarHBondContact O-CB 3.29Å; A831-H834 PolarHBondContact O-N 3.3Å; L832-H834 VanDerWaalsContact C-N 3.29Å; L832-H834 PolarHBondContact O-N 3.12Å
835	V	94.6	Very high	97.3	Very high	15 Å²	15	39.8 Å²	39.8	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-74.8	-37.6	175.7	178.2	0	0	0	0	111.7	K637 F735 I739 F744 F755 A831 L832 T833	K637-V835 HydrophobicContact CD-CG1 4.45Å; K637-V835 PolarHBondContact NZ-O 3.37Å; F735-V835 HydrophobicContact CZ-CG2 4.08Å; I739-V835 HydrophobicContact CD1-CG2 3.51Å; F744-V835 HydrophobicContact CD1-CG2 3.99Å; F744-V835 HydrophobicContact CE1-CB 4.43Å; F744-V835 HydrophobicContact CE1-CG1 3.89Å; F744-V835 HydrophobicContact CE1-CG2 3.65Å; F744-V835 HydrophobicContact CZ-CG2 4.32Å; F755-V835 HydrophobicContact CD2-CG1 4.43Å; F755-V835 HydrophobicContact CE2-CB 4.26Å; F755-V835 HydrophobicContact CE2-CG1 3.72Å; F755-V835 HydrophobicContact CE2-CG2 4.26Å; F755-V835 HydrophobicContact CZ-CG1 4.04Å; A831-V835 PolarHBondContact O-N 3.48Å; L832-V835 PolarHBondContact O-N 3.23Å; L832-V835 VanDerWaalsContact O-N 3.13Å; T833-V835 VanDerWaalsContact C-N 3.33Å
836	S	96.4	Very high	97.4	Very high	10 Å²	10	39.8 Å²	39.8	7%	0.07	20%	0.202	C	C	.	.			trans	-148.1	113.6	174.6	-167.4	0	0	0	0	111.2	G632 L832 T833 D838 C839	G632-S836 WeakPolarHBondContact O-CB 3.39Å; G632-S836 PolarHBondContact O-OG 2.94Å; L832-S836 PolarHBondContact O-N 3.38Å; T833-S836 WeakPolarHBondContact CA-O 3.42Å; T833-S836 CarbonylContact O-C 3.54Å; T833-S836 PolarHBondContact O-N 2.99Å; S836-D838 PolarHBondContact O-N 2.97Å; S836-D838 VanDerWaalsContact O-N 3.16Å; S836-C839 WeakPolarHBondContact O-CB 3.49Å; S836-C839 PolarHBondContact O-N 2.8Å
837	E	97	Very high	97.4	Very high	163 Å²	163	43.9 Å²	43.9	76%	0.762	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-59.8	-27.8	-179.7	-65.6	-178.3	-170.7	0	0	112.4	T833 C839 F840	T833-E837 WeakPolarHBondContact O-CA 3.39Å; T833-E837 PolarHBondContact O-N 2.97Å; E837-C839 PolarHBondContact O-N 3.32Å; E837-C839 VanDerWaalsContact O-N 3.14Å; E837-F840 WeakPolarHBondContact O-CB 3.46Å; E837-F840 PolarHBondContact O-N 2.92Å
838	D	97.6	Very high	97.5	Very high	64 Å²	64	45.2 Å²	45.2	34%	0.342	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-66.3	-12.9	177.3	-62.8	-73.3	0	0	0	113.1	A631 K633 S836 F840 P841	A631-D838 WeakPolarHBondContact O-CB 3.27Å; K633-D838 WeakPolarHBondContact CD-OD2 3.46Å; K633-D838 WeakPolarHBondContact CE-OD2 3Å; K633-D838 HydrophobicContact CG-CB 4.45Å; K633-D838 WeakPolarHBondContact CG-OD2 3.47Å; K633-D838 IonicContact NZ-OD1 2.8Å; K633-D838 PolarHBondContact NZ-OD1 2.99Å; K633-D838 IonicContact NZ-OD2 2.89Å; K633-D838 PolarHBondContact NZ-OD2 3.14Å; S836-D838 PolarHBondContact O-N 2.97Å; S836-D838 VanDerWaalsContact O-N 3.16Å; D838-F840 VanDerWaalsContact C-N 3.32Å; D838-P841 VanDerWaalsContact O-CD 3.29Å; D838-P841 WeakPolarHBondContact O-CD 3.36Å
839	C	97.7	Very high	97.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-84.2	-1.7	171.4	-67.5	0	0	0	0	113.5	L832 S836 E837 P841 L842	L832-C839 HydrophobicContact CD2-CB 4.25Å; L832-C839 HydrophobicContact CG-CB 4.02Å; S836-C839 WeakPolarHBondContact O-CB 3.49Å; S836-C839 PolarHBondContact O-N 2.8Å; E837-C839 PolarHBondContact O-N 3.32Å; E837-C839 VanDerWaalsContact O-N 3.14Å; C839-P841 VanDerWaalsContact C-N 3.28Å; C839-P841 VanDerWaalsContact O-N 3.14Å; C839-L842 WeakPolarHBondContact O-CB 3.3Å; C839-L842 PolarHBondContact O-N 3.37Å
840	F	98.3	Very high	97.5	Very high	93 Å²	93	49.1 Å²	49.1	41%	0.408	24%	0.236	S	C	.	.	H	α-helix	trans	-49.2	-35.7	177.2	177.6	-102.1	0	0	0	115.2	T833 E837 D838 L842 L843 D844	T833-F840 HydrophobicContact CG2-CB 3.9Å; T833-F840 HydrophobicContact CG2-CD2 4.11Å; E837-F840 WeakPolarHBondContact O-CB 3.46Å; E837-F840 PolarHBondContact O-N 2.92Å; D838-F840 VanDerWaalsContact C-N 3.32Å; F840-L842 PolarHBondContact O-N 3.13Å; F840-L842 VanDerWaalsContact O-N 3.13Å; F840-L843 HydrophobicContact CD2-CD2 4.33Å; F840-L843 HydrophobicContact CE2-CD2 4.46Å; F840-L843 WeakPolarHBondContact O-CB 3.45Å; F840-L843 PolarHBondContact O-N 3.44Å; F840-D844 HydrophobicContact CD1-CB 4.33Å; F840-D844 HydrophobicContact CE1-CB 3.85Å; F840-D844 HydrophobicContact CZ-CB 4.04Å; F840-D844 PolarHBondContact O-N 3.21Å
841	P	98.3	Very high	97.5	Very high	64 Å²	64	52.4 Å²	52.4	42%	0.416	25%	0.251	S	S	.	.	H	α-helix	trans	-56.1	-30.4	177.5	-27.7	36.7	0	0	0	114.3	F559 D838 C839 G845	F559-P841 HydrophobicContact CB-CB 4.49Å; F559-P841 HydrophobicContact CD2-CB 3.87Å; F559-P841 HydrophobicContact CD2-CG 4.1Å; F559-P841 HydrophobicContact CE2-CG 4.49Å; D838-P841 VanDerWaalsContact O-CD 3.29Å; D838-P841 WeakPolarHBondContact O-CD 3.36Å; C839-P841 VanDerWaalsContact C-N 3.28Å; C839-P841 VanDerWaalsContact O-N 3.14Å; P841-G845 PolarHBondContact O-N 3.46Å
842	L	98.3	Very high	97.5	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-65.9	-46	175	-66.9	173	0	0	0	111.3	F559 T769 Y829 L832 C839 F840 C846	F559-L842 HydrophobicContact CB-CD2 4.26Å; F559-L842 HydrophobicContact CD1-CD1 4.19Å; F559-L842 HydrophobicContact CD1-CD2 3.52Å; F559-L842 HydrophobicContact CD1-CG 3.81Å; F559-L842 HydrophobicContact CE1-CD1 3.82Å; F559-L842 HydrophobicContact CE1-CD2 4.03Å; F559-L842 HydrophobicContact CE1-CG 3.91Å; F559-L842 HydrophobicContact CG-CD2 4.02Å; F559-L842 HydrophobicContact CG-CG 4.19Å; F559-L842 HydrophobicContact CZ-CD1 4.27Å; F559-L842 HydrophobicContact CZ-CG 4.36Å; T769-L842 WeakPolarHBondContact CB-O 3.46Å; T769-L842 HydrophobicContact CG2-CB 4.15Å; T769-L842 HydrophobicContact CG2-CD2 4.06Å; T769-L842 VanDerWaalsContact CG2-O 3.31Å; T769-L842 WeakPolarHBondContact CG2-O 3.44Å; T769-L842 VanDerWaalsContact OG1-CD2 3.3Å; T769-L842 WeakPolarHBondContact OG1-CD2 3.1Å; Y829-L842 HydrophobicContact CD1-CB 3.79Å; Y829-L842 HydrophobicContact CD1-CD1 4.3Å; Y829-L842 HydrophobicContact CE1-CB 4.1Å; Y829-L842 HydrophobicContact CE1-CD1 4.22Å; Y829-L842 HydrophobicContact CG-CB 4.43Å; L832-L842 HydrophobicContact CD2-CD1 3.94Å; C839-L842 WeakPolarHBondContact O-CB 3.3Å; C839-L842 PolarHBondContact O-N 3.37Å; F840-L842 PolarHBondContact O-N 3.13Å; F840-L842 VanDerWaalsContact O-N 3.13Å; L842-C846 WeakPolarHBondContact O-CB 3.37Å; L842-C846 PolarHBondContact O-N 3.02Å
843	L	98.4	Very high	97.5	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-44.9	177.7	176.1	58.5	0	0	0	111.7	L826 E830 F840 C846 R847	L826-L843 HydrophobicContact CD2-CD1 4.29Å; E830-L843 HydrophobicContact CG-CD1 3.58Å; E830-L843 HydrophobicContact CG-CD2 3.84Å; E830-L843 HydrophobicContact CG-CG 4.37Å; F840-L843 HydrophobicContact CD2-CD2 4.33Å; F840-L843 HydrophobicContact CE2-CD2 4.46Å; F840-L843 WeakPolarHBondContact O-CB 3.45Å; F840-L843 PolarHBondContact O-N 3.44Å; L843-C846 WeakPolarHBondContact O-CB 3.03Å; L843-C846 PolarHBondContact O-N 3.32Å; L843-R847 HydrophobicContact CD1-CG 4.29Å; L843-R847 WeakPolarHBondContact O-CG 3.46Å; L843-R847 PolarHBondContact O-N 3.23Å
844	D	98.4	Very high	97.5	Very high	49 Å²	49	59.8 Å²	59.8	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-43.7	178.4	-178.5	52.1	0	0	0	111.8	F840 C846 R847 K848	F840-D844 HydrophobicContact CD1-CB 4.33Å; F840-D844 HydrophobicContact CE1-CB 3.85Å; F840-D844 HydrophobicContact CZ-CB 4.04Å; F840-D844 PolarHBondContact O-N 3.21Å; D844-C846 PolarHBondContact O-N 3.28Å; D844-R847 PolarHBondContact O-N 2.89Å; D844-K848 WeakPolarHBondContact O-CB 3.46Å; D844-K848 WeakPolarHBondContact O-CG 3.5Å; D844-K848 PolarHBondContact O-N 3.43Å; D844-K848 WeakPolarHBondContact OD1-CE 3.5Å; D844-K848 IonicContact OD1-NZ 2.76Å; D844-K848 WeakPolarHBondContact OD2-CE 3.21Å; D844-K848 IonicContact OD2-NZ 3.89Å; D844-K848 PolarHBondContact OD2-NZ 3.47Å
845	G	98.1	Very high	97.5	Very high	12 Å²	12	54.8 Å²	54.8	12%	0.124	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-46.1	173.1	0	0	0	0	0	112.6	T769 P841 R847 K848 N849	T769-G845 WeakPolarHBondContact O-CA 3.5Å; P841-G845 PolarHBondContact O-N 3.46Å; G845-R847 PolarHBondContact O-N 3.02Å; G845-K848 PolarHBondContact O-N 3.05Å; G845-N849 PolarHBondContact O-N 3.47Å; G845-N849 PolarHBondContact O-ND2 3.08Å
846	C	98.4	Very high	97.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-46.5	176.2	-170.7	0	0	0	0	112.1	T769 Y829 L842 L843 D844 N849 R850	T769-C846 HydrophobicContact CG2-CB 4.32Å; Y829-C846 HydrophobicContact CD2-CB 4.07Å; L842-C846 WeakPolarHBondContact O-CB 3.37Å; L842-C846 PolarHBondContact O-N 3.02Å; L843-C846 WeakPolarHBondContact O-CB 3.03Å; L843-C846 PolarHBondContact O-N 3.32Å; D844-C846 PolarHBondContact O-N 3.28Å; C846-N849 PolarHBondContact O-N 3.38Å; C846-R850 WeakPolarHBondContact O-CB 3.48Å; C846-R850 PolarHBondContact O-N 3.47Å
847	R	98.3	Very high	97.3	Very high	109 Å²	109	56.8 Å²	56.8	41%	0.411	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-42.3	177.9	-74.6	174.5	174	167.4	-0.6	112.5	L826 E830 L843 D844 G845 R850 Q851	L826-R847 HydrophobicContact CD2-CG 3.88Å; E830-R847 IonicContact OE1-CZ 3.31Å; E830-R847 IonicContact OE1-NE 3.59Å; E830-R847 IonicContact OE1-NH2 3.62Å; E830-R847 PolarHBondContact OE1-NH2 3.48Å; L843-R847 HydrophobicContact CD1-CG 4.29Å; L843-R847 WeakPolarHBondContact O-CG 3.46Å; L843-R847 PolarHBondContact O-N 3.23Å; D844-R847 PolarHBondContact O-N 2.89Å; G845-R847 PolarHBondContact O-N 3.02Å; R847-R850 WeakPolarHBondContact O-CB 3.47Å; R847-R850 PolarHBondContact O-N 2.81Å; R847-Q851 PolarHBondContact O-N 2.77Å; R847-Q851 VanDerWaalsContact O-N 3.1Å
848	K	98.2	Very high	97.1	Very high	115 Å²	115	52.8 Å²	52.8	50%	0.5	26%	0.257	S	S	.	.	H	α-helix	trans	-61.5	-45	175.5	-75.2	168.8	176.2	168.3	0	111.5	D844 G845 Q851 K852	D844-K848 WeakPolarHBondContact O-CB 3.46Å; D844-K848 WeakPolarHBondContact O-CG 3.5Å; D844-K848 PolarHBondContact O-N 3.43Å; D844-K848 WeakPolarHBondContact OD1-CE 3.5Å; D844-K848 IonicContact OD1-NZ 2.76Å; D844-K848 WeakPolarHBondContact OD2-CE 3.21Å; D844-K848 IonicContact OD2-NZ 3.89Å; D844-K848 PolarHBondContact OD2-NZ 3.47Å; G845-K848 PolarHBondContact O-N 3.05Å; K848-Q851 PolarHBondContact O-N 2.9Å; K848-K852 WeakPolarHBondContact O-CG 3.43Å; K848-K852 PolarHBondContact O-N 3.22Å; K848-K852 VanDerWaalsContact O-N 3.16Å
849	N	98.2	Very high	96.7	Very high	4 Å²	4	55 Å²	55	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-39.1	178.5	-73.9	-29	0	0	0	112.2	I768 K770 Q775 G845 C846 Q851 K852 W853	I768-N849 PolarHBondContact O-ND2 3.08Å; K770-N849 PolarHBondContact O-ND2 2.9Å; Q775-N849 HydrophobicContact CG-CB 4.36Å; G845-N849 PolarHBondContact O-N 3.47Å; G845-N849 PolarHBondContact O-ND2 3.08Å; C846-N849 PolarHBondContact O-N 3.38Å; N849-Q851 VanDerWaalsContact C-N 3.31Å; N849-Q851 PolarHBondContact O-N 2.92Å; N849-K852 PolarHBondContact O-N 3.29Å; N849-W853 VanDerWaalsContact O-CD1 3.23Å; N849-W853 PolarHBondContact O-N 3.41Å
850	R	98.1	Very high	96	Very high	79 Å²	79	57.8 Å²	57.8	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-54.7	-47.3	171.7	-170.7	-165.8	179.4	-80.4	-7.8	111.9	I821 D822 C846 R847 K852 W853 Q854	I821-R850 HydrophobicContact CD1-CB 4.22Å; I821-R850 HydrophobicContact CG2-CB 3.94Å; I821-R850 HydrophobicContact CG2-CG 4.01Å; D822-R850 IonicContact OD1-CZ 2.59Å; D822-R850 IonicContact OD1-NE 3.79Å; D822-R850 PolarHBondContact OD1-NE 2.81Å; D822-R850 IonicContact OD1-NH2 3.6Å; D822-R850 PolarHBondContact OD1-NH2 3.02Å; D822-R850 IonicContact OD2-CZ 2.62Å; D822-R850 IonicContact OD2-NE 2.82Å; D822-R850 PolarHBondContact OD2-NE 3.07Å; D822-R850 IonicContact OD2-NH2 3.46Å; D822-R850 PolarHBondContact OD2-NH2 3.38Å; C846-R850 WeakPolarHBondContact O-CB 3.48Å; C846-R850 PolarHBondContact O-N 3.47Å; R847-R850 WeakPolarHBondContact O-CB 3.47Å; R847-R850 PolarHBondContact O-N 2.81Å; R850-K852 VanDerWaalsContact C-N 3.32Å; R850-K852 PolarHBondContact O-N 3.1Å; R850-W853 PolarHBondContact O-N 2.87Å; R850-Q854 VanDerWaalsContact O-CB 3.31Å; R850-Q854 WeakPolarHBondContact O-CB 3.44Å; R850-Q854 PolarHBondContact O-N 3.18Å
851	Q	97.6	Very high	95.2	Very high	138 Å²	138	59.1 Å²	59.1	65%	0.645	29%	0.286	S	S	*	.	H	α-helix	trans	-61.6	-40.7	179.4	-169.4	-171.4	37.7	0	0	111.9	R847 K848 N849 A855	R847-Q851 PolarHBondContact O-N 2.77Å; R847-Q851 VanDerWaalsContact O-N 3.1Å; K848-Q851 PolarHBondContact O-N 2.9Å; N849-Q851 VanDerWaalsContact C-N 3.31Å; N849-Q851 PolarHBondContact O-N 2.92Å; Q851-A855 PolarHBondContact O-N 3.44Å
852	K	97.1	Very high	94.2	Very high	110 Å²	110	62.1 Å²	62.1	48%	0.478	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-45.5	176.7	-68.2	-66.8	-175.6	-179.4	0	112.2	W772 K848 N849 R850 A855 L856	W772-K852 HydrophobicContact CD2-CB 3.88Å; W772-K852 HydrophobicContact CD2-CG 4.02Å; W772-K852 HydrophobicContact CE3-CB 3.62Å; W772-K852 HydrophobicContact CE3-CG 4.09Å; W772-K852 HydrophobicContact CG-CG 4.35Å; W772-K852 HydrophobicContact CH2-CB 3.92Å; W772-K852 HydrophobicContact CZ2-CB 4.15Å; W772-K852 HydrophobicContact CZ3-CB 3.64Å; K848-K852 WeakPolarHBondContact O-CG 3.43Å; K848-K852 PolarHBondContact O-N 3.22Å; K848-K852 VanDerWaalsContact O-N 3.16Å; N849-K852 PolarHBondContact O-N 3.29Å; R850-K852 VanDerWaalsContact C-N 3.32Å; R850-K852 PolarHBondContact O-N 3.1Å; K852-A855 PolarHBondContact O-N 3.15Å; K852-L856 PolarHBondContact O-N 3.07Å; K852-L856 VanDerWaalsContact O-N 3.11Å
853	W	96.9	Very high	93.1	Very high	17 Å²	17	68.5 Å²	68.5	6%	0.064	32%	0.323	C	S	.	.	H	α-helix	trans	-63.1	-40.6	176	-76.7	123.6	0	0	0	112.3	W772 A779 P814 Q817 V818 N849 R850 A855 L856 A857	W772-W853 AromaticContact CH2-CD2 3.76Å; W772-W853 HydrophobicContact CH2-CD2 3.76Å; W772-W853 AromaticContact CH2-CE2 3.76Å; W772-W853 AromaticContact CH2-CE3 3.97Å; W772-W853 HydrophobicContact CH2-CE3 3.97Å; W772-W853 HydrophobicContact CH2-CG 4.28Å; W772-W853 HydrophobicContact CH2-CH2 4.19Å; W772-W853 AromaticContact CH2-CZ2 3.99Å; W772-W853 HydrophobicContact CH2-CZ2 3.99Å; W772-W853 HydrophobicContact CH2-CZ3 4.18Å; W772-W853 AromaticContact CZ3-CD1 3.92Å; W772-W853 AromaticContact CZ3-CD2 3.87Å; W772-W853 HydrophobicContact CZ3-CD2 3.87Å; W772-W853 AromaticContact CZ3-CE2 3.6Å; W772-W853 HydrophobicContact CZ3-CG 4.08Å; W772-W853 HydrophobicContact CZ3-CZ2 4.05Å; W772-W853 AromaticContact CZ3-NE1 3.65Å; A779-W853 HydrophobicContact CB-CH2 4.02Å; A779-W853 HydrophobicContact CB-CZ2 3.63Å; P814-W853 HydrophobicContact CB-CE3 3.86Å; P814-W853 HydrophobicContact CB-CZ3 4.32Å; P814-W853 HydrophobicContact CG-CE3 4.08Å; P814-W853 HydrophobicContact CG-CZ3 4.03Å; Q817-W853 HydrophobicContact CB-CD2 3.97Å; Q817-W853 HydrophobicContact CB-CE3 4.47Å; Q817-W853 HydrophobicContact CB-CG 3.99Å; Q817-W853 HydrophobicContact CG-CD2 4.25Å; Q817-W853 HydrophobicContact CG-CZ2 4.24Å; V818-W853 HydrophobicContact CG2-CB 3.78Å; N849-W853 VanDerWaalsContact O-CD1 3.23Å; N849-W853 PolarHBondContact O-N 3.41Å; R850-W853 PolarHBondContact O-N 2.87Å; W853-A855 PolarHBondContact O-N 3.45Å; W853-L856 HydrophobicContact CE3-CD1 3.87Å; W853-L856 HydrophobicContact CZ3-CD1 3.92Å; W853-L856 PolarHBondContact O-N 3.09Å; W853-A857 PolarHBondContact O-N 3.06Å
854	Q	96.2	Very high	91.7	Very high	60 Å²	60	74.2 Å²	74.2	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-45.4	174.8	-179	62	26.9	0	0	111.7	V818 R850 L856 A857 E858	V818-Q854 HydrophobicContact CG2-CB 4.18Å; R850-Q854 VanDerWaalsContact O-CB 3.31Å; R850-Q854 WeakPolarHBondContact O-CB 3.44Å; R850-Q854 PolarHBondContact O-N 3.18Å; Q854-L856 VanDerWaalsContact C-N 3.29Å; Q854-L856 PolarHBondContact O-N 2.95Å; Q854-A857 PolarHBondContact O-N 2.9Å; Q854-E858 WeakPolarHBondContact CG-OE1 3.44Å; Q854-E858 PolarHBondContact NE2-OE1 3.32Å; Q854-E858 WeakPolarHBondContact O-CG 3.39Å; Q854-E858 PolarHBondContact O-N 3.43Å
855	A	95.1	Very high	90.2	Very high	40 Å²	40	77.8 Å²	77.8	33%	0.331	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-37.5	177	0	0	0	0	0	112.3	Q851 K852 W853 Q859	Q851-A855 PolarHBondContact O-N 3.44Å; K852-A855 PolarHBondContact O-N 3.15Å; W853-A855 PolarHBondContact O-N 3.45Å; A855-Q859 VanDerWaalsContact O-CG 3.23Å; A855-Q859 WeakPolarHBondContact O-CG 3.38Å; A855-Q859 PolarHBondContact O-N 3.15Å; A855-Q859 VanDerWaalsContact O-N 3.12Å
856	L	94.3	Very high	88.2	Confident	52 Å²	52	83.1 Å²	83.1	27%	0.272	40%	0.397	S	S	.	.	H	α-helix	trans	-68.5	-40.4	174.7	-71.9	178.5	0	0	0	112.5	W772 P814 K852 W853 Q854 Q859 Q860	W772-L856 HydrophobicContact CH2-CD1 3.74Å; W772-L856 HydrophobicContact CZ2-CD1 3.7Å; P814-L856 HydrophobicContact CB-CB 3.97Å; P814-L856 HydrophobicContact CG-CB 4.12Å; K852-L856 PolarHBondContact O-N 3.07Å; K852-L856 VanDerWaalsContact O-N 3.11Å; W853-L856 HydrophobicContact CE3-CD1 3.87Å; W853-L856 HydrophobicContact CZ3-CD1 3.92Å; W853-L856 PolarHBondContact O-N 3.09Å; Q854-L856 VanDerWaalsContact C-N 3.29Å; Q854-L856 PolarHBondContact O-N 2.95Å; L856-Q859 PolarHBondContact O-N 3.43Å; L856-Q860 WeakPolarHBondContact O-CG 3.49Å; L856-Q860 PolarHBondContact O-N 3.25Å; L856-Q860 VanDerWaalsContact O-N 3.08Å
857	A	92.8	Very high	85.9	Confident	15 Å²	15	85.9 Å²	85.9	12%	0.124	43%	0.425	C	S	.	.	H	α-helix	trans	-61.8	-46.3	177	0	0	0	0	0	111.4	P814 W853 Q854 Q859 Q860 E861	P814-A857 HydrophobicContact CB-CB 4.01Å; W853-A857 PolarHBondContact O-N 3.06Å; Q854-A857 PolarHBondContact O-N 2.9Å; A857-Q859 VanDerWaalsContact C-N 3.34Å; A857-Q859 PolarHBondContact O-N 2.74Å; A857-Q860 PolarHBondContact O-N 2.72Å; A857-E861 PolarHBondContact O-N 3.49Å
858	E	92.5	Very high	83.3	Confident	80 Å²	80	89 Å²	89	37%	0.374	45%	0.445	S	S	.	.	H	α-helix	trans	-64.7	-35.2	177.4	-70.6	173.6	-165.8	0	0	112.8	Q854 K862	Q854-E858 WeakPolarHBondContact CG-OE1 3.44Å; Q854-E858 PolarHBondContact NE2-OE1 3.32Å; Q854-E858 WeakPolarHBondContact O-CG 3.39Å; Q854-E858 PolarHBondContact O-N 3.43Å; E858-K862 WeakPolarHBondContact O-CB 3.14Å; E858-K862 VanDerWaalsContact O-CG 3.29Å; E858-K862 WeakPolarHBondContact O-CG 3.34Å; E858-K862 PolarHBondContact O-N 3.3Å
859	Q	89.4	Confident	80.6	Confident	109 Å²	109	88.6 Å²	88.6	51%	0.509	46%	0.456	S	S	.	.	H	α-helix	trans	-65.1	-43.5	175	-77.9	174.5	18.2	0	0	111.5	A855 L856 A857 K862 M863	A855-Q859 VanDerWaalsContact O-CG 3.23Å; A855-Q859 WeakPolarHBondContact O-CG 3.38Å; A855-Q859 PolarHBondContact O-N 3.15Å; A855-Q859 VanDerWaalsContact O-N 3.12Å; L856-Q859 PolarHBondContact O-N 3.43Å; A857-Q859 VanDerWaalsContact C-N 3.34Å; A857-Q859 PolarHBondContact O-N 2.74Å; Q859-K862 PolarHBondContact O-N 3.21Å; Q859-M863 WeakPolarHBondContact O-CG 3.2Å; Q859-M863 PolarHBondContact O-N 3.32Å
860	Q	83.9	Confident	77.7	Confident	59 Å²	59	92 Å²	92	28%	0.276	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-40.7	178	-72.2	171.9	-27.5	0	0	111.8	N811 L856 A857 M863 L864	N811-Q860 VanDerWaalsContact O-CD 3.26Å; N811-Q860 PolarHBondContact O-NE2 3.27Å; N811-Q860 PolarHBondContact O-OE1 3.41Å; L856-Q860 WeakPolarHBondContact O-CG 3.49Å; L856-Q860 PolarHBondContact O-N 3.25Å; L856-Q860 VanDerWaalsContact O-N 3.08Å; A857-Q860 PolarHBondContact O-N 2.72Å; Q860-M863 PolarHBondContact O-N 2.82Å; Q860-L864 WeakPolarHBondContact O-CD1 3.39Å; Q860-L864 PolarHBondContact O-N 2.76Å
861	E	80.1	Confident	74.8	Confident	122 Å²	122	96.9 Å²	96.9	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-42.3	175.8	-169.5	173.3	-162.2	0	0	111.5	A857 M863 L864 I865	A857-E861 PolarHBondContact O-N 3.49Å; E861-M863 PolarHBondContact O-N 3.01Å; E861-L864 PolarHBondContact O-N 3.16Å; E861-I865 HydrophobicContact CG-CD1 3.92Å; E861-I865 VanDerWaalsContact O-CG1 3.25Å; E861-I865 WeakPolarHBondContact O-CG1 3.21Å; E861-I865 PolarHBondContact O-N 2.62Å
862	K	78.2	Confident	71.9	Confident	127 Å²	127	94.9 Å²	94.9	55%	0.552	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-38.5	173.4	-74.4	171.6	-177	170.2	0	113	E858 Q859 L864 I865 N866	E858-K862 WeakPolarHBondContact O-CB 3.14Å; E858-K862 VanDerWaalsContact O-CG 3.29Å; E858-K862 WeakPolarHBondContact O-CG 3.34Å; E858-K862 PolarHBondContact O-N 3.3Å; Q859-K862 PolarHBondContact O-N 3.21Å; K862-L864 VanDerWaalsContact C-N 3.35Å; K862-I865 PolarHBondContact O-N 3.04Å; K862-N866 VanDerWaalsContact O-CB 3.27Å; K862-N866 WeakPolarHBondContact O-CB 3.41Å; K862-N866 VanDerWaalsContact O-CG 3.28Å; K862-N866 PolarHBondContact O-N 3.13Å; K862-N866 PolarHBondContact O-ND2 2.91Å
863	M	75.4	Confident	69	Low	137 Å²	137	99.3 Å²	99.3	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-66.6	-35.9	175	-73.4	-178.7	175.4	0	0	112.4	Q859 Q860 E861	Q859-M863 WeakPolarHBondContact O-CG 3.2Å; Q859-M863 PolarHBondContact O-N 3.32Å; Q860-M863 PolarHBondContact O-N 2.82Å; E861-M863 PolarHBondContact O-N 3.01Å
864	L	68.8	Low	66.3	Low	124 Å²	124	110.1 Å²	110.1	65%	0.649	59%	0.586	S	S	*	*	H	α-helix	trans	-68.8	-39.7	174.3	-86.2	148.3	0	0	0	112.3	Q860 E861 K862	Q860-L864 WeakPolarHBondContact O-CD1 3.39Å; Q860-L864 PolarHBondContact O-N 2.76Å; E861-L864 PolarHBondContact O-N 3.16Å; K862-L864 VanDerWaalsContact C-N 3.35Å
865	I	66.6	Low	63.3	Low	124 Å²	124	118.6 Å²	118.6	64%	0.636	63%	0.633	S	S	*	*	H	α-helix	trans	-73	-36.3	179.3	-67.2	167.7	0	0	0	111.8	E861 K862 G867	E861-I865 HydrophobicContact CG-CD1 3.92Å; E861-I865 VanDerWaalsContact O-CG1 3.25Å; E861-I865 WeakPolarHBondContact O-CG1 3.21Å; E861-I865 PolarHBondContact O-N 2.62Å; K862-I865 PolarHBondContact O-N 3.04Å; I865-G867 VanDerWaalsContact C-N 3.32Å; I865-G867 PolarHBondContact O-N 3.1Å
866	N	57.2	Low	61.7	Low	124 Å²	124	122.6 Å²	122.6	66%	0.663	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	1	-175.7	-71.6	-12.7	0	0	0	114.8	K862 E868	K862-N866 VanDerWaalsContact O-CB 3.27Å; K862-N866 WeakPolarHBondContact O-CB 3.41Å; K862-N866 VanDerWaalsContact O-CG 3.28Å; K862-N866 PolarHBondContact O-N 3.13Å; K862-N866 PolarHBondContact O-ND2 2.91Å; N866-E868 VanDerWaalsContact C-N 3.28Å; N866-E868 PolarHBondContact O-N 3.49Å; N866-E868 VanDerWaalsContact O-N 3.16Å
867	G	48.8	Very low	60	Low	58 Å²	58	126.3 Å²	126.3	60%	0.598	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.2	23.5	168	0	0	0	0	0	116	I865 S869	I865-G867 VanDerWaalsContact C-N 3.32Å; I865-G867 PolarHBondContact O-N 3.1Å; G867-S869 PolarHBondContact O-N 2.82Å
868	E	44.7	Very low	58.1	Low	176 Å²	176	132.4 Å²	132.4	82%	0.822	70%	0.698	S	S	*	*			trans	-79.2	78.2	171.3	-75.2	-169.1	160.3	0	0	109.7	N866 G870	N866-E868 VanDerWaalsContact C-N 3.28Å; N866-E868 PolarHBondContact O-N 3.49Å; N866-E868 VanDerWaalsContact O-N 3.16Å; E868-G870 PolarHBondContact O-N 3.15Å
869	S	40.2	Very low	56.1	Low	105 Å²	105	135.5 Å²	135.5	73%	0.734	72%	0.717	S	S	*	*			trans	-62.9	103	156.5	62.3	0	0	0	0	107.3	G867 Q871	G867-S869 PolarHBondContact O-N 2.82Å; S869-Q871 VanDerWaalsContact C-N 3.3Å; S869-Q871 PolarHBondContact O-N 3.27Å
870	G	38.6	Very low	54	Low	76 Å²	76	137.2 Å²	137.2	78%	0.784	73%	0.73	S	S	*	*			trans	-58.3	91.9	169.4	0	0	0	0	0	110.5	E868 A872	E868-G870 PolarHBondContact O-N 3.15Å; G870-A872 VanDerWaalsContact C-N 3.32Å; G870-A872 PolarHBondContact O-N 3.06Å
871	Q	35.7	Very low	52	Low	181 Å²	181	142.4 Å²	142.4	85%	0.846	76%	0.76	S	S	*	*			trans	-60.5	103.2	148	-89.4	-176.8	-15.5	0	0	106.4	S869 K873	S869-Q871 VanDerWaalsContact C-N 3.3Å; S869-Q871 PolarHBondContact O-N 3.27Å; Q871-K873 PolarHBondContact O-N 3.17Å
872	A	36.8	Very low	50	Low	96 Å²	96	143.9 Å²	143.9	79%	0.793	77%	0.774	S	S	*	*			trans	-55	112	160.2	0	0	0	0	0	107.7	G870 R874	G870-A872 VanDerWaalsContact C-N 3.32Å; G870-A872 PolarHBondContact O-N 3.06Å; A872-R874 PolarHBondContact O-N 2.89Å
873	K	36.9	Very low	47.9	Very low	204 Å²	204	145.2 Å²	145.2	89%	0.887	79%	0.791	S	S	*	*			trans	-57	108.5	164.9	-77.3	178.9	175.2	176.2	0	107.5	Q871 N875	Q871-K873 PolarHBondContact O-N 3.17Å; K873-N875 PolarHBondContact O-N 2.8Å
874	R	40.3	Very low	45.6	Very low	244 Å²	244	145.8 Å²	145.8	92%	0.921	80%	0.8	S	S	*	*			trans	-70.6	109.3	152.4	-87	-178.9	171.5	176.1	-2.4	107	A872	A872-R874 PolarHBondContact O-N 2.89Å
875	N	32.7	Very low	43.5	Very low	238 Å²	238	147.8 Å²	147.8	100%	1.273	81%	0.814	S	S	*	*			trans	-156.8	0	139.3	-95.5	-7.6	0	0	0	108.1	K873	K873-N875 PolarHBondContact O-N 2.8Å

Retrieved 875 of 875 residues in 303.3 ms (Link to these results)

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