A0A3Q0KMH1_SCHMA Loading...

Putative tetratricopeptide repeat protein 10, tpr10

AlphaFold DB , UniProt , Accession A0A3Q0KMH1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 846 aa.

						>A0A3Q0KMH1_SCHMA|A0A3Q0KMH1
MITDNDDDDLYEGFDNLNTKLEVEEFVNDAGFQNVIKNTSYGRKPPVLDRGLNTSVIRGPIGRTPTSANFRLVTASGPAGGDFGRPMTSVRAAGYSSMGRRLSTGQPGNQVWLGDQTVPTTIDVSAVPPLESKSDDSSEERIKNMEKRVNHLVEESCVAACQGEITLALEKAKEASRKERVLARQREQLGVADQINLDLTYSVLFNLANRYTANGMYQEALNTYQTIVRNKMFAHAGRLKVNMGNIYYVQKNYSKAIKFFRMGLDQVPNTHKLMRIKIMQNIGISFVKLGQFSEAIAAFEYIMQEEPDTKTGFNLIVCYFIKRDRNKMKYAFQQLLRVDLHLDDEDRYLQHNDDKQYDLILEVIQNDELRQYEKKKKVQAENFIKMAAKIIAPVIESNFSTGYDWCIDHVKMSSYHEIAHDLEIDKAVMFLKQRDFHQAIDTLKSFERKDTRVACSAATNLSFLYFLEGDLLQAEKYADQALSVDRYNPAALVNKGNVLYQQQQYERARDCYAEALQDDTRCVEALYNLGLVCKQLERYEEALEAFFKLYSVLRNSAPVVYQLMDIYEKLGDSTQAQEWAMQLHGMVPTDPFLLQRLGDSYEQEGDKSQAFSYYYDSFKYYPCNFDVIEWLGAYYIESQFCEKAIAYFERASLMQPNQIKWQLMIASCHRRSGNYQQALETYRIIHRRFPENIECLQFLVRLSSDMDLPEAQDYITKLKRAEKLKQAREQRRLSTSNRRSFGLTNASRTTGSRENSASVSSESRESSANYDNHFSVQSKHTHSKNNSSRQTEARKETGLSKDIDNEYIKYNDPLGPSVERPRTAARTRSIQDDFADEEVDENLLPD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28	Very low	36.6	Very low	200 Å²	200	98.2 Å²	98.2	99%	0.985	52%	0.515	S	S	*	.				0	118.5	0	-70.2	170.9	176.9	0	0	104.2
2	I	32.5	Very low	36.7	Very low	68 Å²	68	102.6 Å²	102.6	35%	0.349	53%	0.531	S	S	.	.			trans	-115	102.7	169	-60.3	172	0	0	0	102.4	Y561	I2-Y561 HydrophobicContact CD1-CD1 4.45Å; I2-Y561 HydrophobicContact CD1-CD2 4.47Å; I2-Y561 HydrophobicContact CD1-CG 4.2Å; I2-Y561 HydrophobicContact CG2-CD1 4.18Å; I2-Y561 HydrophobicContact CG2-CE1 3.71Å; I2-Y561 HydrophobicContact CG2-CE2 4.3Å
3	T	31.5	Very low	36.5	Very low	55 Å²	55	97.5 Å²	97.5	34%	0.337	52%	0.519	S	S	.	.			trans	-90.4	149.6	-178.4	29.2	0	0	0	0	109.8	N5 D8 F592	T3-N5 PolarHBondContact O-N 3.38Å; T3-D8 WeakPolarHBondContact CB-OD2 3.5Å; T3-D8 PolarHBondContact OG1-OD2 3.29Å; T3-F592 HydrophobicContact CG2-CE2 4.19Å; T3-F592 HydrophobicContact CG2-CZ 4.46Å
4	D	35.2	Very low	36.5	Very low	94 Å²	94	94 Å²	94	50%	0.503	50%	0.497	S	S	.	.			trans	-90.9	37.2	-178.5	-77.5	-46.8	0	0	0	111.7	Y561 R596	D4-Y561 PolarHBondContact OD1-OH 3.33Å; D4-Y561 VanDerWaalsContact OD1-OH 3.08Å; D4-R596 IonicContact OD1-NH2 2.83Å; D4-R596 PolarHBondContact OD1-NH2 3.45Å; D4-R596 IonicContact OD2-CZ 2.68Å; D4-R596 IonicContact OD2-NH2 2.66Å; D4-R596 PolarHBondContact OD2-NH2 3.29Å
5	N	30.7	Very low	36.7	Very low	105 Å²	105	98.7 Å²	98.7	56%	0.561	52%	0.522	S	S	*	.			trans	-92.4	131.5	170.1	-59.6	-46.4	0	0	0	109.6	T3 D7 D8	T3-N5 PolarHBondContact O-N 3.38Å; N5-D7 PolarHBondContact O-N 3.46Å; N5-D8 WeakPolarHBondContact CB-OD2 3.42Å; N5-D8 PolarHBondContact N-OD2 2.95Å; N5-D8 PolarHBondContact O-N 3.18Å
6	D	37.1	Very low	36.5	Very low	133 Å²	133	101.6 Å²	101.6	71%	0.711	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	1.5	177.8	-58.5	-67.6	0	0	0	114	R820	D6-R820 IonicContact OD2-CZ 3.71Å; D6-R820 IonicContact OD2-NH2 2.69Å; D6-R820 PolarHBondContact OD2-NH2 3.11Å
7	D	39	Very low	36.2	Very low	162 Å²	162	98.9 Å²	98.9	87%	0.866	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	3.8	-177.6	-66.8	-52.5	0	0	0	113.7	N5	N5-D7 PolarHBondContact O-N 3.46Å
8	D	39	Very low	35.8	Very low	65 Å²	65	100 Å²	100	35%	0.348	53%	0.53	S	S	.	.	S	Bend	trans	-74.1	143.6	-176.4	-70.4	-29.6	0	0	0	112.9	T3 N5 L10	T3-D8 WeakPolarHBondContact CB-OD2 3.5Å; T3-D8 PolarHBondContact OG1-OD2 3.29Å; N5-D8 WeakPolarHBondContact CB-OD2 3.42Å; N5-D8 PolarHBondContact N-OD2 2.95Å; N5-D8 PolarHBondContact O-N 3.18Å; D8-L10 PolarHBondContact O-N 3.14Å; D8-L10 VanDerWaalsContact O-N 3.15Å
9	D	45.2	Very low	35.7	Very low	98 Å²	98	100.5 Å²	100.5	52%	0.524	54%	0.538	S	S	.	.			trans	-59.1	115.1	-174.6	-172.9	-11.2	0	0	0	111.4	Y11 E12	D9-Y11 PolarHBondContact O-N 2.9Å; D9-Y11 PolarHBondContact OD1-N 3.37Å; D9-E12 HydrophobicContact CB-CB 4.38Å; D9-E12 HydrophobicContact CB-CG 4.24Å; D9-E12 PolarHBondContact O-N 3.41Å
10	L	40.7	Very low	35.6	Very low	64 Å²	64	102.7 Å²	102.7	34%	0.335	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-16.5	-171.4	-149.4	79.1	0	0	0	113.7	D8 Y500 L531	D8-L10 PolarHBondContact O-N 3.14Å; D8-L10 VanDerWaalsContact O-N 3.15Å; L10-Y500 HydrophobicContact CD1-CE1 4.44Å; L10-Y500 HydrophobicContact CD2-CD1 4.47Å; L10-Y500 HydrophobicContact CD2-CE1 4.19Å; L10-L531 HydrophobicContact CD1-CD1 4.11Å; L10-L531 HydrophobicContact CD2-CD1 3.93Å; L10-L531 HydrophobicContact CG-CD1 3.93Å
11	Y	43.8	Very low	35.4	Very low	36 Å²	36	103.8 Å²	103.8	14%	0.141	55%	0.548	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	4.9	-176.7	-60.5	-80.1	0	0	0	114.6	D9 G13 F14 F466 N497 N528	D9-Y11 PolarHBondContact O-N 2.9Å; D9-Y11 PolarHBondContact OD1-N 3.37Å; Y11-G13 VanDerWaalsContact C-N 3.28Å; Y11-G13 PolarHBondContact O-N 3.08Å; Y11-F14 HydrophobicContact CD1-CB 4.32Å; Y11-F14 HydrophobicContact CD1-CG 4.44Å; Y11-F14 PolarHBondContact O-N 3.08Å; Y11-F466 HydrophobicContact CD2-CE1 4.41Å; Y11-F466 AromaticContact CE2-CE1 3.78Å; Y11-F466 HydrophobicContact CE2-CE1 3.78Å; Y11-F466 HydrophobicContact CE2-CZ 4.31Å; Y11-N497 VanDerWaalsContact OH-CG 3.23Å; Y11-N497 PolarHBondContact OH-ND2 2.98Å; Y11-N497 PolarHBondContact OH-OD1 3.06Å; Y11-N497 VanDerWaalsContact OH-OD1 3.13Å; Y11-N528 PolarHBondContact OH-ND2 2.98Å; Y11-N528 VanDerWaalsContact OH-ND2 3.11Å
12	E	37.7	Very low	35.5	Very low	151 Å²	151	100.9 Å²	100.9	71%	0.706	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	81.3	178.1	-107.8	-157.8	162.1	0	0	112.5	D9	D9-E12 HydrophobicContact CB-CB 4.38Å; D9-E12 HydrophobicContact CB-CG 4.24Å; D9-E12 PolarHBondContact O-N 3.41Å
13	G	34	Very low	35.7	Very low	37 Å²	37	101.6 Å²	101.6	38%	0.381	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	143.2	-19.5	-177	0	0	0	0	0	114.2	Y11 D15 N16	Y11-G13 VanDerWaalsContact C-N 3.28Å; Y11-G13 PolarHBondContact O-N 3.08Å; G13-D15 VanDerWaalsContact C-N 3.3Å; G13-D15 PolarHBondContact O-N 3.02Å; G13-N16 PolarHBondContact O-N 3.44Å; G13-N16 PolarHBondContact O-ND2 3.23Å
14	F	36	Very low	36	Very low	48 Å²	48	106.6 Å²	106.6	21%	0.211	56%	0.559	C	S	.	*	G	3₁₀ helix	trans	-67.6	-29.4	-176.9	-148.9	-89	0	0	0	112.6	Y11 N16 L17 V523 E524 Y527	Y11-F14 HydrophobicContact CD1-CB 4.32Å; Y11-F14 HydrophobicContact CD1-CG 4.44Å; Y11-F14 PolarHBondContact O-N 3.08Å; F14-N16 PolarHBondContact O-N 3Å; F14-L17 HydrophobicContact CD1-CD1 4.03Å; F14-L17 HydrophobicContact CD2-CD1 3.74Å; F14-L17 HydrophobicContact CE1-CD1 3.95Å; F14-L17 HydrophobicContact CE2-CD1 3.66Å; F14-L17 HydrophobicContact CG-CD1 3.93Å; F14-L17 HydrophobicContact CZ-CD1 3.77Å; F14-L17 WeakPolarHBondContact O-CB 3.45Å; F14-L17 PolarHBondContact O-N 2.71Å; F14-V523 HydrophobicContact CZ-CG1 4.14Å; F14-E524 HydrophobicContact CE1-CG 3.99Å; F14-E524 HydrophobicContact CZ-CG 3.9Å; F14-Y527 HydrophobicContact CE2-CD1 4.38Å
15	D	39.8	Very low	36.2	Very low	164 Å²	164	109 Å²	109	88%	0.877	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-55	-17.6	175.9	-79.7	-19	0	0	0	115.1	G13	G13-D15 VanDerWaalsContact C-N 3.3Å; G13-D15 PolarHBondContact O-N 3.02Å
16	N	33.9	Very low	36.8	Very low	145 Å²	145	109.3 Å²	109.3	78%	0.775	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-85.8	-7.1	177.9	-65.1	-62.1	0	0	0	113.7	G13 F14 N18	G13-N16 PolarHBondContact O-N 3.44Å; G13-N16 PolarHBondContact O-ND2 3.23Å; F14-N16 PolarHBondContact O-N 3Å; N16-N18 PolarHBondContact O-N 2.69Å
17	L	31.8	Very low	37.1	Very low	57 Å²	57	105.8 Å²	105.8	30%	0.298	55%	0.546	S	S	.	.			trans	-78.7	101.8	179.1	-78	156.4	0	0	0	111	F14 T19 L553	F14-L17 HydrophobicContact CD1-CD1 4.03Å; F14-L17 HydrophobicContact CD2-CD1 3.74Å; F14-L17 HydrophobicContact CE1-CD1 3.95Å; F14-L17 HydrophobicContact CE2-CD1 3.66Å; F14-L17 HydrophobicContact CG-CD1 3.93Å; F14-L17 HydrophobicContact CZ-CD1 3.77Å; F14-L17 WeakPolarHBondContact O-CB 3.45Å; F14-L17 PolarHBondContact O-N 2.71Å; L17-T19 PolarHBondContact O-N 3.33Å; L17-L553 HydrophobicContact CD2-CD1 3.81Å
18	N	28.6	Very low	37.4	Very low	118 Å²	118	104.8 Å²	104.8	63%	0.631	54%	0.541	S	S	*	.			trans	-73	89	171.5	-170	19.6	0	0	0	110	N16 K20 L21	N16-N18 PolarHBondContact O-N 2.69Å; N18-K20 PolarHBondContact O-N 3.39Å; N18-L21 PolarHBondContact O-N 3.2Å
19	T	34.8	Very low	37.7	Very low	110 Å²	110	104.6 Å²	104.6	68%	0.675	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	18.6	-179.1	38.8	0	0	0	0	115.7	L17	L17-T19 PolarHBondContact O-N 3.33Å
20	K	32.8	Very low	37.9	Very low	143 Å²	143	103 Å²	103	62%	0.622	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	18.9	179.9	-73.3	-163.3	170.9	-161.1	0	114.6	N18	N18-K20 PolarHBondContact O-N 3.39Å
21	L	31.2	Very low	38.5	Very low	127 Å²	127	101.1 Å²	101.1	67%	0.665	54%	0.537	S	S	*	.	S	Bend	trans	-65.1	135.9	164.2	-78.4	162.6	0	0	0	109.4	N18 V23	N18-L21 PolarHBondContact O-N 3.2Å; L21-V23 WeakPolarHBondContact O-CG2 3.4Å; L21-V23 PolarHBondContact O-N 3.45Å
22	E	30.8	Very low	38.5	Very low	139 Å²	139	100.7 Å²	100.7	65%	0.65	54%	0.535	S	S	*	.			trans	-70.4	84.7	-159.6	-69.7	164.3	139.3	0	0	113.1	E24 E25 F26	E22-E24 PolarHBondContact O-N 2.88Å; E22-E25 HydrophobicContact CB-CG 4.5Å; E22-E25 PolarHBondContact O-N 3.38Å; E22-F26 WeakPolarHBondContact O-CD2 3.3Å
23	V	36.1	Very low	39.1	Very low	82 Å²	82	97.5 Å²	97.5	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-54.5	-26.4	180	-178	0	0	0	0	112.9	L21 E25 F26 V27	L21-V23 WeakPolarHBondContact O-CG2 3.4Å; L21-V23 PolarHBondContact O-N 3.45Å; V23-E25 PolarHBondContact O-N 2.95Å; V23-F26 PolarHBondContact O-N 3.08Å; V23-V27 PolarHBondContact O-N 3.03Å
24	E	37.1	Very low	39.9	Very low	161 Å²	161	100 Å²	100	75%	0.752	53%	0.525	S	S	*	.	H	α-helix	trans	-65.8	-31.3	177	-66	-165.8	155.7	0	0	113.8	E22 F26 N28	E22-E24 PolarHBondContact O-N 2.88Å; E24-F26 VanDerWaalsContact C-N 3.33Å; E24-N28 PolarHBondContact O-ND2 3.3Å
25	E	41.1	Very low	40.4	Very low	143 Å²	143	99.7 Å²	99.7	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-69.4	-33.9	176.6	-67.9	-157.1	146.2	0	0	111.4	E22 V23 N28	E22-E25 HydrophobicContact CB-CG 4.5Å; E22-E25 PolarHBondContact O-N 3.38Å; V23-E25 PolarHBondContact O-N 2.95Å; E25-N28 PolarHBondContact O-N 2.95Å
26	F	42.8	Very low	40.8	Very low	113 Å²	113	96.3 Å²	96.3	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-75.2	-24.4	-179.7	-62.7	-79.9	0	0	0	114	E22 V23 E24 N28 D29	E22-F26 WeakPolarHBondContact O-CD2 3.3Å; V23-F26 PolarHBondContact O-N 3.08Å; E24-F26 VanDerWaalsContact C-N 3.33Å; F26-N28 PolarHBondContact O-N 3.01Å; F26-D29 PolarHBondContact O-N 3.43Å
27	V	43.5	Very low	41.6	Very low	59 Å²	59	96.2 Å²	96.2	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-32.6	174.4	173	0	0	0	0	111.5	V23 R521	V23-V27 PolarHBondContact O-N 3.03Å; V27-R521 VanDerWaalsContact CG2-NH1 3.25Å
28	N	44.4	Very low	42.2	Very low	140 Å²	140	99.3 Å²	99.3	75%	0.749	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.3	-179.5	-63.8	-53	0	0	0	113.4	E24 E25 F26 A30	E24-N28 PolarHBondContact O-ND2 3.3Å; E25-N28 PolarHBondContact O-N 2.95Å; F26-N28 PolarHBondContact O-N 3.01Å; N28-A30 PolarHBondContact O-N 2.97Å
29	D	46.3	Very low	42.6	Very low	61 Å²	61	98.7 Å²	98.7	33%	0.326	52%	0.519	S	S	.	.			trans	-74.6	114.8	176.4	178.5	26.7	0	0	0	111.2	F26 G31 F32 Q33	F26-D29 PolarHBondContact O-N 3.43Å; D29-G31 PolarHBondContact O-N 3.02Å; D29-G31 PolarHBondContact OD1-N 2.91Å; D29-F32 HydrophobicContact CB-CB 4.02Å; D29-F32 WeakPolarHBondContact O-CB 3.34Å; D29-F32 PolarHBondContact O-N 3.18Å; D29-F32 VanDerWaalsContact O-N 3.17Å; D29-F32 PolarHBondContact OD2-N 3.46Å; D29-Q33 PolarHBondContact O-N 2.77Å; D29-Q33 VanDerWaalsContact O-N 3.1Å
30	A	49.7	Very low	42.7	Very low	66 Å²	66	97.4 Å²	97.4	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-25.2	172.7	0	0	0	0	0	112.6	N28 N34	N28-A30 PolarHBondContact O-N 2.97Å; A30-N34 WeakPolarHBondContact O-CB 3.46Å; A30-N34 PolarHBondContact O-N 2.72Å; A30-N34 VanDerWaalsContact O-N 3.08Å; A30-N34 PolarHBondContact O-ND2 2.89Å
31	G	51.9	Low	42.7	Very low	24 Å²	24	101 Å²	101	25%	0.247	53%	0.525	C	S	.	.	H	α-helix	trans	-63	-52.7	170.7	0	0	0	0	0	111.9	D29 Q33 N34 V35	D29-G31 PolarHBondContact O-N 3.02Å; D29-G31 PolarHBondContact OD1-N 2.91Å; G31-Q33 PolarHBondContact O-N 3Å; G31-N34 PolarHBondContact O-N 3.02Å; G31-V35 WeakPolarHBondContact O-CG2 3.45Å; G31-V35 PolarHBondContact O-N 3.04Å
32	F	44.8	Very low	42.7	Very low	26 Å²	26	99 Å²	99	11%	0.114	54%	0.535	C	S	.	.	H	α-helix	trans	-56.3	-46.8	175.1	-175.2	-102.4	0	0	0	112.5	D29 N34 V35 I36	D29-F32 HydrophobicContact CB-CB 4.02Å; D29-F32 WeakPolarHBondContact O-CB 3.34Å; D29-F32 PolarHBondContact O-N 3.18Å; D29-F32 VanDerWaalsContact O-N 3.17Å; D29-F32 PolarHBondContact OD2-N 3.46Å; F32-N34 VanDerWaalsContact C-N 3.33Å; F32-N34 PolarHBondContact O-N 3.16Å; F32-V35 PolarHBondContact O-N 3.34Å; F32-I36 HydrophobicContact CD1-CD1 3.84Å; F32-I36 HydrophobicContact CE1-CD1 3.42Å; F32-I36 VanDerWaalsContact CE1-CD1 3.42Å; F32-I36 HydrophobicContact CZ-CD1 3.81Å; F32-I36 PolarHBondContact O-N 2.91Å
33	Q	49.5	Very low	42.9	Very low	84 Å²	84	103.8 Å²	103.8	39%	0.393	55%	0.547	S	S	.	.	H	α-helix	trans	-61.3	-35.6	176.6	-70.8	-71.9	-17	0	0	113.7	D29 G31 K37	D29-Q33 PolarHBondContact O-N 2.77Å; D29-Q33 VanDerWaalsContact O-N 3.1Å; G31-Q33 PolarHBondContact O-N 3Å; Q33-K37 WeakPolarHBondContact O-CG 3.31Å
34	N	50.8	Low	42.8	Very low	89 Å²	89	106.4 Å²	106.4	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-79.1	-28.5	177.3	-77.8	-25.6	0	0	0	113.1	A30 G31 F32 K37 N38	A30-N34 WeakPolarHBondContact O-CB 3.46Å; A30-N34 PolarHBondContact O-N 2.72Å; A30-N34 VanDerWaalsContact O-N 3.08Å; A30-N34 PolarHBondContact O-ND2 2.89Å; G31-N34 PolarHBondContact O-N 3.02Å; F32-N34 VanDerWaalsContact C-N 3.33Å; F32-N34 PolarHBondContact O-N 3.16Å; N34-K37 PolarHBondContact O-N 3.09Å; N34-N38 WeakPolarHBondContact O-CB 3.37Å; N34-N38 VanDerWaalsContact O-CG 3.25Å; N34-N38 PolarHBondContact O-N 2.98Å; N34-N38 PolarHBondContact O-ND2 3.14Å
35	V	46.5	Very low	42.7	Very low	42 Å²	42	102.5 Å²	102.5	26%	0.255	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-47.6	173	169.8	0	0	0	0	110.3	G31 F32 K37 N38 T39	G31-V35 WeakPolarHBondContact O-CG2 3.45Å; G31-V35 PolarHBondContact O-N 3.04Å; F32-V35 PolarHBondContact O-N 3.34Å; V35-K37 PolarHBondContact O-N 3.05Å; V35-N38 PolarHBondContact O-N 3.43Å; V35-T39 HydrophobicContact CG1-CG2 3.91Å; V35-T39 WeakPolarHBondContact O-CG2 3.36Å; V35-T39 PolarHBondContact O-N 2.93Å; V35-T39 VanDerWaalsContact O-N 3.15Å; V35-T39 PolarHBondContact O-OG1 3.11Å
36	I	48.5	Very low	42.3	Very low	94 Å²	94	100.3 Å²	100.3	48%	0.482	54%	0.538	S	S	.	.	H	α-helix	trans	-55.5	-36.6	177.7	-68.9	166.9	0	0	0	112.4	F32 N38 T39	F32-I36 HydrophobicContact CD1-CD1 3.84Å; F32-I36 HydrophobicContact CE1-CD1 3.42Å; F32-I36 VanDerWaalsContact CE1-CD1 3.42Å; F32-I36 HydrophobicContact CZ-CD1 3.81Å; F32-I36 PolarHBondContact O-N 2.91Å; I36-N38 VanDerWaalsContact C-N 3.3Å; I36-N38 PolarHBondContact O-N 3.28Å; I36-T39 PolarHBondContact O-OG1 3.49Å
37	K	50.4	Low	41.8	Very low	142 Å²	142	101.7 Å²	101.7	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-73.5	-19.5	178.8	-70.8	172.9	-175.8	173.6	0	114.1	Q33 N34 V35	Q33-K37 WeakPolarHBondContact O-CG 3.31Å; N34-K37 PolarHBondContact O-N 3.09Å; V35-K37 PolarHBondContact O-N 3.05Å
38	N	44.8	Very low	41.3	Very low	122 Å²	122	104.1 Å²	104.1	65%	0.652	57%	0.566	S	S	*	*	H	α-helix	trans	-113	-3.1	-170	-67.7	-9.2	0	0	0	113.7	N34 V35 I36 S40	N34-N38 WeakPolarHBondContact O-CB 3.37Å; N34-N38 VanDerWaalsContact O-CG 3.25Å; N34-N38 PolarHBondContact O-N 2.98Å; N34-N38 PolarHBondContact O-ND2 3.14Å; V35-N38 PolarHBondContact O-N 3.43Å; I36-N38 VanDerWaalsContact C-N 3.3Å; I36-N38 PolarHBondContact O-N 3.28Å; N38-S40 PolarHBondContact O-N 3.36Å
39	T	37.4	Very low	40.5	Very low	106 Å²	106	104.1 Å²	104.1	65%	0.65	57%	0.566	S	S	*	*			trans	-81.5	16.5	-178.4	41.4	0	0	0	0	115	V35 I36	V35-T39 HydrophobicContact CG1-CG2 3.91Å; V35-T39 WeakPolarHBondContact O-CG2 3.36Å; V35-T39 PolarHBondContact O-N 2.93Å; V35-T39 VanDerWaalsContact O-N 3.15Å; V35-T39 PolarHBondContact O-OG1 3.11Å; I36-T39 PolarHBondContact O-OG1 3.49Å
40	S	35.6	Very low	39.7	Very low	82 Å²	82	111.4 Å²	111.4	57%	0.573	59%	0.589	S	S	*	*	S	Bend	trans	-98.6	133.1	163.3	55	0	0	0	0	110	N38	N38-S40 PolarHBondContact O-N 3.36Å
41	Y	34.1	Very low	38.6	Very low	219 Å²	219	112.1 Å²	112.1	86%	0.859	60%	0.603	S	S	*	*	S	Bend	trans	76.4	121.1	-173.2	-57.2	-81	0	0	0	116.3	R43	Y41-R43 PolarHBondContact O-N 3.21Å; Y41-R43 VanDerWaalsContact O-N 3.1Å
42	G	30.7	Very low	37.4	Very low	84 Å²	84	117.3 Å²	117.3	87%	0.866	62%	0.624	S	S	*	*			trans	-61.3	110.1	-178.4	0	0	0	0	0	113.4
43	R	34.1	Very low	36.5	Very low	240 Å²	240	124.1 Å²	124.1	91%	0.906	66%	0.662	S	S	*	*	S	Bend	trans	-159.8	139.7	157.2	-101.2	156.6	-155.7	-95.4	0	107.8	Y41	Y41-R43 PolarHBondContact O-N 3.21Å; Y41-R43 VanDerWaalsContact O-N 3.1Å
44	K	35.9	Very low	35.6	Very low	138 Å²	138	125.6 Å²	125.6	60%	0.6	68%	0.676	S	S	*	*			trans	-25.4	129.3	-174.6	-61.5	-166.1	170.1	-144.4	0	114.8	E578	K44-E578 IonicContact NZ-OE1 3.39Å; K44-E578 PolarHBondContact NZ-OE1 2.76Å; K44-E578 IonicContact NZ-OE2 2.8Å; K44-E578 PolarHBondContact NZ-OE2 2.85Å; K44-E578 VanDerWaalsContact NZ-OE2 3.07Å
45	P	33.1	Very low	34.5	Very low	79 Å²	79	127 Å²	127	51%	0.513	69%	0.693	S	S	.	*			trans	-56.7	139	165.8	27.4	-33.6	0	0	0	108.2	V47	P45-V47 PolarHBondContact O-N 3.21Å
46	P	33	Very low	33.9	Very low	96 Å²	96	131.8 Å²	131.8	62%	0.623	72%	0.722	S	S	*	*			trans	-62	126.7	179	26	-33	0	0	0	108.3	L48	P46-L48 PolarHBondContact O-N 3.42Å
47	V	33.5	Very low	33.2	Very low	143 Å²	143	134.9 Å²	134.9	87%	0.867	74%	0.738	S	S	*	*			trans	-62.3	94.2	166.6	177.9	0	0	0	0	106.3	P45 D49	P45-V47 PolarHBondContact O-N 3.21Å; V47-D49 PolarHBondContact O-N 3.07Å; V47-D49 VanDerWaalsContact O-N 3.08Å
48	L	33.1	Very low	32.2	Very low	110 Å²	110	140.1 Å²	140.1	58%	0.576	75%	0.754	S	S	*	*			trans	-69.2	109.4	176.9	-92.9	166.9	0	0	0	107.8	P46 R50	P46-L48 PolarHBondContact O-N 3.42Å; L48-R50 PolarHBondContact O-N 3.45Å
49	D	27.6	Very low	31.6	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	76%	0.758	S	S	*	*			trans	-34.4	116.4	-173.4	-155.5	6.6	0	0	0	113	V47 G51	V47-D49 PolarHBondContact O-N 3.07Å; V47-D49 VanDerWaalsContact O-N 3.08Å; D49-G51 PolarHBondContact O-N 3.01Å
50	R	29	Very low	31.3	Very low	214 Å²	214	138.3 Å²	138.3	81%	0.808	76%	0.763	S	S	*	*			trans	-61.1	108.4	164	-95	-174.8	172	176.9	-0.6	105.8	L48 L52	L48-R50 PolarHBondContact O-N 3.45Å; R50-L52 VanDerWaalsContact C-N 3.3Å; R50-L52 WeakPolarHBondContact O-CB 3.45Å; R50-L52 PolarHBondContact O-N 2.9Å
51	G	25.8	Very low	31.1	Very low	81 Å²	81	143 Å²	143	84%	0.835	78%	0.78	S	S	*	*			trans	-50.5	88.1	-177.8	0	0	0	0	0	113.4	D49	D49-G51 PolarHBondContact O-N 3.01Å
52	L	27.4	Very low	31	Very low	133 Å²	133	136.1 Å²	136.1	70%	0.696	78%	0.776	S	S	*	*			trans	-102.9	95.3	-177.4	-94.6	161.5	0	0	0	108.4	R50 T54	R50-L52 VanDerWaalsContact C-N 3.3Å; R50-L52 WeakPolarHBondContact O-CB 3.45Å; R50-L52 PolarHBondContact O-N 2.9Å; L52-T54 PolarHBondContact O-N 3.46Å
53	N	25.5	Very low	31	Very low	169 Å²	169	143.6 Å²	143.6	90%	0.904	78%	0.778	S	S	*	*			trans	-62.3	78.6	156.8	-85.1	-33.2	0	0	0	110.1
54	T	30.4	Very low	31.2	Very low	114 Å²	114	138.8 Å²	138.8	70%	0.699	78%	0.776	S	S	*	*			trans	-156.3	95.1	154	44.8	0	0	0	0	110.6	L52 V56	L52-T54 PolarHBondContact O-N 3.46Å; T54-V56 PolarHBondContact O-N 3.42Å
55	S	27.7	Very low	31	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	78%	0.781	S	S	*	*			trans	-68.3	117.7	156.3	53.4	0	0	0	0	110
56	V	35	Very low	30.9	Very low	143 Å²	143	140.1 Å²	140.1	87%	0.867	80%	0.796	S	S	*	*			trans	-156.2	135.3	140.4	169	0	0	0	0	110.1	T54	T54-V56 PolarHBondContact O-N 3.42Å
57	I	34	Very low	30.9	Very low	160 Å²	160	141 Å²	141	82%	0.821	81%	0.805	S	S	*	*			trans	-46.1	148.9	175.9	-67.2	156.7	0	0	0	115.8
58	R	28.7	Very low	31	Very low	252 Å²	252	138 Å²	138	95%	0.951	80%	0.795	S	S	*	*			trans	-61.4	141.9	174.8	-68.8	175.6	169.1	178.6	-4.7	114.1
59	G	32	Very low	30.8	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	80%	0.804	S	S	*	*			trans	-172.4	143.4	159.8	0	0	0	0	0	111.1
60	P	32.1	Very low	31.1	Very low	119 Å²	119	142.5 Å²	142.5	77%	0.773	81%	0.811	S	S	*	*			trans	-103.8	150.4	-157.7	5.3	16.5	0	0	0	116.4
61	I	31.4	Very low	31.1	Very low	180 Å²	180	142.5 Å²	142.5	92%	0.923	81%	0.811	S	S	*	*			trans	65.5	114.4	146.9	-57	163.3	0	0	0	118
62	G	32	Very low	31.2	Very low	76 Å²	76	145.7 Å²	145.7	78%	0.784	81%	0.808	S	S	*	*			trans	-178.1	119.4	163.7	0	0	0	0	0	111.2
63	R	30.6	Very low	31.4	Very low	240 Å²	240	145.4 Å²	145.4	91%	0.906	81%	0.811	S	S	*	*			trans	-82.4	156.6	-171.2	-71.2	174.5	165.3	174.1	-6.5	113.6
64	T	37.1	Very low	31.7	Very low	140 Å²	140	143.6 Å²	143.6	86%	0.859	81%	0.806	S	S	*	*			trans	121.6	147.1	143.4	64.7	0	0	0	0	117
65	P	31.4	Very low	31.8	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	82%	0.816	S	S	*	*			trans	-126.3	-177.4	-150.6	42.9	-27.5	0	0	0	116.7
66	T	31.3	Very low	31.9	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	82%	0.819	S	S	*	*			trans	73.7	115.8	163	64.3	0	0	0	0	119.6
67	S	34.1	Very low	31.8	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	81%	0.814	S	S	*	*				161.8	128.3	107.8	-168.2	0	0	0	0	114.2
68	A	33.7	Very low	31.9	Very low	79 Å²	79	139.3 Å²	139.3	65%	0.653	82%	0.816	S	S	*	*			trans	27	125.5	152.4	0	0	0	0	0	123.7
69	N	30.5	Very low	32.2	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	81%	0.813	S	S	*	*			trans	41.6	120.6	131.3	-60.2	-23.8	0	0	0	120.6
70	F	33.6	Very low	32.1	Very low	201 Å²	201	133.1 Å²	133.1	88%	0.882	82%	0.821	S	S	*	*				-168.3	171.2	97.6	-115.1	-89.3	0	0	0	111.9
71	R	28.3	Very low	32.1	Very low	214 Å²	214	131.3 Å²	131.3	81%	0.808	82%	0.824	S	S	*	*			trans	-89.5	166.8	-168.1	-64.1	173.3	166.8	165.5	-5	114.4
72	L	28.2	Very low	32	Very low	148 Å²	148	129.7 Å²	129.7	78%	0.775	82%	0.817	S	S	*	*				105.7	134.5	124.8	-103.7	159.4	0	0	0	120.9
73	V	32.6	Very low	32	Very low	126 Å²	126	136 Å²	136	76%	0.764	82%	0.823	S	S	*	*			trans	90.5	125	157.8	-170.3	0	0	0	0	119.9
74	T	29.9	Very low	32.1	Very low	131 Å²	131	128 Å²	128	80%	0.804	82%	0.816	S	S	*	*			trans	-77.2	148.2	172.9	49.2	0	0	0	0	114.6
75	A	32.7	Very low	31.8	Very low	110 Å²	110	132.6 Å²	132.6	91%	0.909	82%	0.818	S	S	*	*			trans	-158.5	149.6	143.7	0	0	0	0	0	112.1
76	S	31	Very low	31.8	Very low	126 Å²	126	133.6 Å²	133.6	88%	0.881	82%	0.824	S	S	*	*			trans	-98.6	149.8	-173.1	52.1	0	0	0	0	113.9
77	G	33.5	Very low	31.6	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	82%	0.82	S	S	*	*			trans	-175.9	121	166.4	0	0	0	0	0	113.1
78	P	34.9	Very low	31.6	Very low	135 Å²	135	136 Å²	136	88%	0.877	83%	0.826	S	S	*	*			trans	-109.3	137.6	-171.4	37.7	-31.1	0	0	0	115.6
79	A	34.9	Very low	31.5	Very low	107 Å²	107	137 Å²	137	88%	0.884	83%	0.827	S	S	*	*			trans	-170.7	146	154.2	0	0	0	0	0	106.1
80	G	30.8	Very low	31.8	Very low	85 Å²	85	137.4 Å²	137.4	88%	0.876	84%	0.835	S	S	*	*			cis	127.6	104.6	15.7	0	0	0	0	0	107.9
81	G	30.9	Very low	31.6	Very low	82 Å²	82	138.9 Å²	138.9	85%	0.845	83%	0.834	S	S	*	*			trans	157.5	108.4	-177.5	0	0	0	0	0	114.2
82	D	29.5	Very low	32	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	84%	0.837	S	S	*	*			trans	-46.7	157.6	172.6	-121.1	-44.8	0	0	0	116.3
83	F	32.1	Very low	32.2	Very low	209 Å²	209	131.2 Å²	131.2	92%	0.917	84%	0.838	S	S	*	*				169.6	127.8	122	-90.5	-61.6	0	0	0	113.3
84	G	33.4	Very low	32.3	Very low	73 Å²	73	128.5 Å²	128.5	75%	0.753	84%	0.836	S	S	*	*			trans	97.1	90.7	144.9	0	0	0	0	0	119.5
85	R	29.9	Very low	32.6	Very low	236 Å²	236	133.4 Å²	133.4	89%	0.891	84%	0.841	S	S	*	*			trans	-85.7	167.3	153.3	-72.5	-174.2	175.2	-152.1	-0.7	110.8
86	P	31.5	Very low	32.7	Very low	130 Å²	130	133.6 Å²	133.6	84%	0.844	84%	0.836	S	S	*	*				-125.5	153.8	124.7	34.4	-28	0	0	0	114.1
87	M	28.6	Very low	33.1	Very low	152 Å²	152	133.6 Å²	133.6	75%	0.749	84%	0.836	S	S	*	*			trans	-84.8	156.7	173.1	-81.6	-175.5	-77.6	0	0	111.9
88	T	34.1	Very low	33.1	Very low	149 Å²	149	139.4 Å²	139.4	91%	0.914	85%	0.846	S	S	*	*				-133.5	148.2	127	48.4	0	0	0	0	110.2
89	S	30.4	Very low	33.1	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	84%	0.838	S	S	*	*			trans	-152.7	137.8	-176.8	56.6	0	0	0	0	109.7
90	V	37.1	Very low	33.1	Very low	154 Å²	154	143.4 Å²	143.4	93%	0.933	84%	0.842	S	S	*	*			trans	-143.1	148.6	156.8	-178.4	0	0	0	0	108.6
91	R	30.2	Very low	33	Very low	232 Å²	232	150.4 Å²	150.4	88%	0.875	84%	0.842	S	S	*	*			trans	-128.1	146.2	-166.9	-178.1	-173.4	-164.3	148.3	-0.2	108.2
92	A	34.9	Very low	33.1	Very low	105 Å²	105	154 Å²	154	87%	0.868	84%	0.841	S	S	*	*			trans	-133.7	127.7	163.3	0	0	0	0	0	109.3
93	A	32.7	Very low	33.2	Very low	96 Å²	96	151.8 Å²	151.8	79%	0.793	84%	0.837	S	S	*	*			trans	-118	145.3	173.9	0	0	0	0	0	108.5
94	G	35.9	Very low	33.3	Very low	69 Å²	69	148.2 Å²	148.2	71%	0.711	83%	0.832	S	S	*	*			trans	-157.2	87.7	-173.6	0	0	0	0	0	113.9
95	Y	35.9	Very low	33.3	Very low	235 Å²	235	147.9 Å²	147.9	92%	0.922	83%	0.829	S	S	*	*			trans	46.3	126.5	149.9	-71.4	-86	0	0	0	122.3
96	S	33.5	Very low	33.7	Very low	114 Å²	114	145.9 Å²	145.9	80%	0.797	83%	0.829	S	S	*	*			trans	-76.9	150.3	161.4	44.1	0	0	0	0	112.6
97	S	40.9	Very low	34.1	Very low	126 Å²	126	145.2 Å²	145.2	88%	0.881	83%	0.825	S	S	*	*			trans	-154.1	144	144.6	62.8	0	0	0	0	112
98	M	31.9	Very low	34.4	Very low	196 Å²	196	141.2 Å²	141.2	97%	0.966	82%	0.823	S	S	*	*			trans	-104.6	126	-179.9	178	83.6	155.6	0	0	107.6
99	G	35.5	Very low	34.6	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	83%	0.825	S	S	*	*			trans	177.9	99.1	179.7	0	0	0	0	0	120.1
100	R	34.2	Very low	34.7	Very low	256 Å²	256	146.6 Å²	146.6	97%	0.966	83%	0.833	S	S	*	*			trans	72.6	126.6	143.8	-59	-172.3	-177.1	-154.1	0.7	121
101	R	29.5	Very low	34.6	Very low	232 Å²	232	146.3 Å²	146.3	88%	0.875	83%	0.831	S	S	*	*			trans	-57.2	148.1	157.8	-52.4	169.4	179.9	-177.9	-2.4	111.4
102	L	33.3	Very low	34.6	Very low	158 Å²	158	146.5 Å²	146.5	83%	0.827	83%	0.832	S	S	*	*				-172.5	144.8	112.3	-121.9	73.8	0	0	0	110.7
103	S	32.4	Very low	34.5	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	84%	0.835	S	S	*	*			trans	48.4	139.5	130.6	-119.1	0	0	0	0	121
104	T	33	Very low	34.5	Very low	134 Å²	134	148.4 Å²	148.4	82%	0.822	83%	0.829	S	S	*	*			cis	-167.2	155.6	9.8	-20.7	0	0	0	0	111.4
105	G	34.1	Very low	34.6	Very low	66 Å²	66	151.9 Å²	151.9	68%	0.68	83%	0.831	S	S	*	*			trans	82	115.1	155.2	0	0	0	0	0	117.2
106	Q	37.6	Very low	34.8	Very low	194 Å²	194	147.4 Å²	147.4	91%	0.907	82%	0.818	S	S	*	*				79.7	150.1	55.2	-83.8	-153.3	-25.9	0	0	115.4
107	P	39.2	Very low	35	Very low	116 Å²	116	147.7 Å²	147.7	75%	0.753	82%	0.815	S	S	*	*				-145.1	-172.6	-52.2	39.5	-19.6	0	0	0	113.3
108	G	35.6	Very low	34.9	Very low	69 Å²	69	148 Å²	148	71%	0.711	81%	0.812	S	S	*	*			trans	132.5	96.1	142.4	0	0	0	0	0	119.4
109	N	38.4	Very low	35.1	Very low	177 Å²	177	144.2 Å²	144.2	95%	0.947	80%	0.802	S	S	*	*				-170.7	143.1	107.9	-113.2	-7.2	0	0	0	111.9
110	Q	32.2	Very low	35	Very low	182 Å²	182	146.7 Å²	146.7	85%	0.85	80%	0.803	S	S	*	*			trans	-120.1	140	-178	-65.5	172.4	-53.2	0	0	111.3
111	V	35	Very low	34.9	Very low	148 Å²	148	140.9 Å²	140.9	90%	0.897	80%	0.796	S	S	*	*			trans	-159.9	142.1	150.8	-176.3	0	0	0	0	106.6
112	W	31.6	Very low	35.3	Very low	237 Å²	237	137 Å²	137	90%	0.898	79%	0.791	S	S	*	*			cis	-161.2	137.7	-40.4	-152.7	67.5	0	0	0	105.3
113	L	31.2	Very low	35.2	Very low	176 Å²	176	137.2 Å²	137.2	92%	0.921	79%	0.793	S	S	*	*			trans	-133.9	138.9	178.4	-86.2	171.4	0	0	0	110.2
114	G	34.2	Very low	35.6	Very low	65 Å²	65	138.9 Å²	138.9	67%	0.67	80%	0.799	S	S	*	*			trans	-152.8	158.6	162.2	0	0	0	0	0	108.2
115	D	37.4	Very low	35.7	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	79%	0.792	S	S	*	*			cis	-163.3	-177.2	-1.8	-148.8	16.6	0	0	0	107
116	Q	39.9	Very low	35.7	Very low	141 Å²	141	138.7 Å²	138.7	66%	0.659	80%	0.799	S	S	*	*			cis	-157.8	127.3	9.6	-171.2	166.9	102.2	0	0	111.4
117	T	38.1	Very low	35.8	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	79%	0.793	S	S	*	*			trans	65.3	153.5	156.4	61.3	0	0	0	0	118.6
118	V	38.6	Very low	35.9	Very low	133 Å²	133	134.8 Å²	134.8	81%	0.806	79%	0.787	S	S	*	*			cis	-149.2	156.2	47.5	163.8	0	0	0	0	110.7
119	P	37.1	Very low	36	Very low	116 Å²	116	138 Å²	138	75%	0.753	80%	0.796	S	S	*	*			trans	-114.1	-179.9	-139.8	42.8	-36.9	0	0	0	119.6
120	T	31.6	Very low	36.1	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	78%	0.784	S	S	*	*			trans	-52	150.5	179.2	51.1	0	0	0	0	119.9
121	T	33.5	Very low	36.5	Very low	134 Å²	134	134.9 Å²	134.9	82%	0.822	78%	0.779	S	S	*	*				172.1	149.6	120.4	34.3	0	0	0	0	107.1
122	I	38.1	Very low	36.3	Very low	149 Å²	149	133.2 Å²	133.2	76%	0.764	77%	0.774	S	S	*	*				-156.3	142.1	52.9	-72.7	165.7	0	0	0	109.5	V124	I122-V124 HydrophobicContact CG2-CG2 4.26Å
123	D	31.5	Very low	36.6	Very low	163 Å²	163	131.7 Å²	131.7	87%	0.872	77%	0.774	S	S	*	*			trans	-74.8	134.6	166	-87.4	-53.9	0	0	0	112.2
124	V	39.3	Very low	36.7	Very low	133 Å²	133	128.1 Å²	128.1	81%	0.806	76%	0.764	S	S	*	*			trans	-139.3	126.4	153.4	-174.4	0	0	0	0	111	I122	I122-V124 HydrophobicContact CG2-CG2 4.26Å
125	S	35.3	Very low	36.8	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	77%	0.77	S	S	*	*			trans	-75	150.3	-179	54	0	0	0	0	115
126	A	34	Very low	37.4	Very low	99 Å²	99	130.7 Å²	130.7	82%	0.818	76%	0.762	S	S	*	*			trans	46.5	100.3	143.8	0	0	0	0	0	118.7
127	V	40.8	Very low	38.6	Very low	128 Å²	128	126.6 Å²	126.6	78%	0.776	75%	0.749	S	S	*	*			trans	-117.6	139.4	160.8	-179.8	0	0	0	0	108.8
128	P	41.1	Very low	40.1	Very low	99 Å²	99	123.5 Å²	123.5	64%	0.643	73%	0.732	S	S	*	*			trans	-68	164.8	-177.8	-16.9	31.6	0	0	0	113.1	L130	P128-L130 PolarHBondContact O-N 2.92Å
129	P	37.6	Very low	41.7	Very low	136 Å²	136	122.5 Å²	122.5	88%	0.883	72%	0.718	S	S	*	*			trans	-71.8	101.1	-175.9	29.8	-34.1	0	0	0	111.2	E131	P129-E131 PolarHBondContact O-N 2.8Å
130	L	40.9	Very low	43.6	Very low	134 Å²	134	122.5 Å²	122.5	70%	0.702	71%	0.708	S	S	*	*			trans	-77.1	120	171	-107.9	82.3	0	0	0	111.1	P128	P128-L130 PolarHBondContact O-N 2.92Å
131	E	40.2	Very low	45.8	Very low	161 Å²	161	122.9 Å²	122.9	75%	0.752	70%	0.696	S	S	*	*			trans	59	110.9	143.3	-62.9	177.3	170	0	0	117.8	P129 K133	P129-E131 PolarHBondContact O-N 2.8Å; E131-K133 PolarHBondContact O-N 3.06Å
132	S	30.6	Very low	48.1	Very low	112 Å²	112	117.2 Å²	117.2	78%	0.783	66%	0.661	S	S	*	*			trans	-51.2	108.8	164.1	49.3	0	0	0	0	111.2	S134	S132-S134 PolarHBondContact O-N 3.38Å
133	K	38.2	Very low	50.3	Low	206 Å²	206	115.6 Å²	115.6	90%	0.896	65%	0.648	S	S	*	*			trans	-68.8	82.2	164.5	-72.4	-171.7	177.1	-176.4	0	109.9	E131 D135	E131-K133 PolarHBondContact O-N 3.06Å; K133-D135 VanDerWaalsContact C-N 3.26Å; K133-D135 PolarHBondContact O-N 3.01Å
134	S	32	Very low	52.9	Low	101 Å²	101	111.2 Å²	111.2	71%	0.706	62%	0.624	S	S	*	*			trans	-66.3	91.6	156.8	52.4	0	0	0	0	108	S132	S132-S134 PolarHBondContact O-N 3.38Å
135	D	36.4	Very low	55.1	Low	150 Å²	150	106.7 Å²	106.7	80%	0.802	60%	0.595	S	S	*	*			trans	159.2	99.2	143	-80.4	-13.9	0	0	0	108.6	K133 S137	K133-D135 VanDerWaalsContact C-N 3.26Å; K133-D135 PolarHBondContact O-N 3.01Å; D135-S137 VanDerWaalsContact C-N 3.31Å; D135-S137 PolarHBondContact O-N 3.28Å
136	D	50.3	Low	57.6	Low	110 Å²	110	103.5 Å²	103.5	59%	0.588	57%	0.569	S	S	*	*			trans	-57.8	97	160.9	-91.5	-14.7	0	0	0	107.9	S138 R141	D136-S138 PolarHBondContact O-N 3.21Å; D136-R141 HydrophobicContact CB-CG 4.33Å; D136-R141 VanDerWaalsContact CB-CZ 3.49Å; D136-R141 VanDerWaalsContact CB-NE 3.32Å; D136-R141 VanDerWaalsContact CB-NH2 3.3Å; D136-R141 IonicContact OD2-CZ 3.08Å; D136-R141 IonicContact OD2-NE 2.91Å; D136-R141 PolarHBondContact OD2-NE 3.4Å; D136-R141 IonicContact OD2-NH2 2.64Å; D136-R141 PolarHBondContact OD2-NH2 2.87Å
137	S	65.2	Low	60.3	Low	54 Å²	54	105.4 Å²	105.4	38%	0.378	56%	0.559	S	S	.	*			trans	-54.6	131.2	172.7	174.3	0	0	0	0	109.4	D135 E139 E140 R141	D135-S137 VanDerWaalsContact C-N 3.31Å; D135-S137 PolarHBondContact O-N 3.28Å; S137-E139 PolarHBondContact O-N 3.29Å; S137-E139 VanDerWaalsContact O-N 3.13Å; S137-E139 PolarHBondContact OG-N 3.13Å; S137-E140 PolarHBondContact O-N 3.25Å; S137-R141 PolarHBondContact O-N 2.83Å
138	S	69.2	Low	62.7	Low	55 Å²	55	107 Å²	107	39%	0.385	55%	0.551	S	S	.	*	H	α-helix	trans	-54.8	-32.6	178.7	51	0	0	0	0	111.7	D136 I142	D136-S138 PolarHBondContact O-N 3.21Å; S138-I142 WeakPolarHBondContact O-CG1 3.48Å; S138-I142 PolarHBondContact O-N 3Å; S138-I142 VanDerWaalsContact O-N 3.15Å
139	E	72.3	Confident	65.1	Low	112 Å²	112	102.4 Å²	102.4	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-39.6	174.2	-60.2	-169.8	172.8	0	0	113.8	S137 I142 K143	S137-E139 PolarHBondContact O-N 3.29Å; S137-E139 VanDerWaalsContact O-N 3.13Å; S137-E139 PolarHBondContact OG-N 3.13Å; E139-I142 PolarHBondContact O-N 3.31Å; E139-K143 WeakPolarHBondContact O-CG 3.37Å; E139-K143 PolarHBondContact O-N 3.25Å; E139-K143 IonicContact OE2-NZ 2.62Å
140	E	76.7	Confident	67.7	Low	116 Å²	116	99.5 Å²	99.5	54%	0.542	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-35.3	-178.5	-171.9	161.2	-154.5	0	0	110.8	S137 K143 N144	S137-E140 PolarHBondContact O-N 3.25Å; E140-K143 PolarHBondContact O-N 3.29Å; E140-N144 WeakPolarHBondContact O-CB 3.5Å; E140-N144 PolarHBondContact O-N 3.08Å; E140-N144 PolarHBondContact O-ND2 3.01Å
141	R	79.6	Confident	70.2	Confident	132 Å²	132	98 Å²	98	50%	0.498	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-45.8	167.4	-68.9	-177.5	175.3	158.3	2	111.6	D136 S137 N144 M145	D136-R141 HydrophobicContact CB-CG 4.33Å; D136-R141 VanDerWaalsContact CB-CZ 3.49Å; D136-R141 VanDerWaalsContact CB-NE 3.32Å; D136-R141 VanDerWaalsContact CB-NH2 3.3Å; D136-R141 IonicContact OD2-CZ 3.08Å; D136-R141 IonicContact OD2-NE 2.91Å; D136-R141 PolarHBondContact OD2-NE 3.4Å; D136-R141 IonicContact OD2-NH2 2.64Å; D136-R141 PolarHBondContact OD2-NH2 2.87Å; S137-R141 PolarHBondContact O-N 2.83Å; R141-N144 PolarHBondContact O-N 3.13Å; R141-M145 WeakPolarHBondContact O-CG 3.49Å; R141-M145 PolarHBondContact O-N 3Å
142	I	81.3	Confident	72.8	Confident	15 Å²	15	90.7 Å²	90.7	8%	0.077	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-50.7	176.7	-68	163.3	0	0	0	111	S138 E139 N144 M145 E146 R186 L189	S138-I142 WeakPolarHBondContact O-CG1 3.48Å; S138-I142 PolarHBondContact O-N 3Å; S138-I142 VanDerWaalsContact O-N 3.15Å; E139-I142 PolarHBondContact O-N 3.31Å; I142-N144 VanDerWaalsContact C-N 3.29Å; I142-N144 PolarHBondContact O-N 3.21Å; I142-M145 WeakPolarHBondContact O-CA 3.24Å; I142-M145 WeakPolarHBondContact O-CB 3.36Å; I142-M145 PolarHBondContact O-N 2.59Å; I142-E146 PolarHBondContact O-N 2.94Å; I142-R186 HydrophobicContact CD1-CG 4.35Å; I142-L189 HydrophobicContact CD1-CD1 3.76Å
143	K	83.6	Confident	75.8	Confident	115 Å²	115	86.5 Å²	86.5	50%	0.5	42%	0.423	S	S	.	.	H	α-helix	trans	-58.1	-40.1	179.3	-73.4	168.3	-178.7	161.1	0	112	E139 E140 E146 K147	E139-K143 WeakPolarHBondContact O-CG 3.37Å; E139-K143 PolarHBondContact O-N 3.25Å; E139-K143 IonicContact OE2-NZ 2.62Å; E140-K143 PolarHBondContact O-N 3.29Å; K143-E146 PolarHBondContact O-N 3.12Å; K143-K147 WeakPolarHBondContact O-CG 3.31Å; K143-K147 PolarHBondContact O-N 3.09Å; K143-K147 VanDerWaalsContact O-N 3.11Å
144	N	86.9	Confident	78.5	Confident	70 Å²	70	81.9 Å²	81.9	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-70.4	-29.1	175.9	-75.4	-30.9	0	0	0	113.1	E140 R141 I142 R148	E140-N144 WeakPolarHBondContact O-CB 3.5Å; E140-N144 PolarHBondContact O-N 3.08Å; E140-N144 PolarHBondContact O-ND2 3.01Å; R141-N144 PolarHBondContact O-N 3.13Å; I142-N144 VanDerWaalsContact C-N 3.29Å; I142-N144 PolarHBondContact O-N 3.21Å; N144-R148 WeakPolarHBondContact O-CG 2.86Å; N144-R148 PolarHBondContact O-N 3.01Å
145	M	85.6	Confident	81.4	Confident	38 Å²	38	80 Å²	80	19%	0.187	39%	0.385	C	S	.	.	H	α-helix	trans	-72.7	-40.9	169.6	-66.7	-159.1	-53.2	0	0	112.5	R141 I142 K147 R148 V149 L182 Q185	R141-M145 WeakPolarHBondContact O-CG 3.49Å; R141-M145 PolarHBondContact O-N 3Å; I142-M145 WeakPolarHBondContact O-CA 3.24Å; I142-M145 WeakPolarHBondContact O-CB 3.36Å; I142-M145 PolarHBondContact O-N 2.59Å; M145-K147 VanDerWaalsContact C-N 3.35Å; M145-K147 PolarHBondContact O-N 3.44Å; M145-R148 WeakPolarHBondContact O-CB 3.36Å; M145-R148 PolarHBondContact O-N 2.81Å; M145-R148 VanDerWaalsContact O-N 3.11Å; M145-V149 WeakPolarHBondContact O-CG2 3.43Å; M145-V149 PolarHBondContact O-N 3.32Å; M145-L182 HydrophobicContact CB-CD1 3.62Å; M145-L182 HydrophobicContact CB-CG 4.41Å; M145-L182 HydrophobicContact CE-CB 3.93Å; M145-L182 HydrophobicContact CE-CD1 4.28Å; M145-L182 HydrophobicContact CE-CG 3.91Å; M145-Q185 HydrophobicContact CE-CB 4.36Å
146	E	87.4	Confident	84.2	Confident	31 Å²	31	72.8 Å²	72.8	15%	0.145	35%	0.346	C	S	.	.	H	α-helix	trans	-58.9	-46.4	176.5	-71.8	-168.7	122.5	0	0	111.1	I142 K143 R148 V149 N150 L182 R186 N196 L199	I142-E146 PolarHBondContact O-N 2.94Å; K143-E146 PolarHBondContact O-N 3.12Å; E146-R148 VanDerWaalsContact C-N 3.29Å; E146-R148 PolarHBondContact O-N 3.42Å; E146-V149 PolarHBondContact O-N 2.83Å; E146-V149 VanDerWaalsContact O-N 3.07Å; E146-N150 PolarHBondContact O-N 3.22Å; E146-L182 HydrophobicContact CB-CD1 4.19Å; E146-L182 HydrophobicContact CG-CD1 3.46Å; E146-L182 VanDerWaalsContact CG-CD1 3.46Å; E146-L182 HydrophobicContact CG-CD2 4.17Å; E146-L182 HydrophobicContact CG-CG 4.41Å; E146-R186 IonicContact OE1-CZ 2.87Å; E146-R186 VanDerWaalsContact OE1-CZ 3.25Å; E146-R186 IonicContact OE1-NH1 2.87Å; E146-R186 PolarHBondContact OE1-NH1 3.09Å; E146-R186 IonicContact OE1-NH2 2.69Å; E146-R186 PolarHBondContact OE1-NH2 3.05Å; E146-R186 IonicContact OE2-NH2 2.72Å; E146-R186 PolarHBondContact OE2-NH2 2.94Å; E146-N196 WeakPolarHBondContact OE1-CB 3.4Å; E146-N196 PolarHBondContact OE1-ND2 3.14Å; E146-L199 HydrophobicContact CB-CD2 4.27Å; E146-L199 HydrophobicContact CG-CD2 3.97Å
147	K	90.2	Very high	86.2	Confident	139 Å²	139	70.3 Å²	70.3	60%	0.604	34%	0.337	S	S	*	.	H	α-helix	trans	-55.6	-42.6	173.7	-72	175.9	-179.8	179.2	0	112.3	K143 M145 N150 H151	K143-K147 WeakPolarHBondContact O-CG 3.31Å; K143-K147 PolarHBondContact O-N 3.09Å; K143-K147 VanDerWaalsContact O-N 3.11Å; M145-K147 VanDerWaalsContact C-N 3.35Å; M145-K147 PolarHBondContact O-N 3.44Å; K147-N150 PolarHBondContact O-N 3.34Å; K147-H151 WeakPolarHBondContact O-CB 3.36Å; K147-H151 PolarHBondContact O-N 3.01Å
148	R	91.4	Very high	87.6	Confident	162 Å²	162	71.5 Å²	71.5	61%	0.611	34%	0.341	S	S	*	.	H	α-helix	trans	-67.6	-32	176.3	-76.5	171	173.1	160.6	-0.4	113.3	N144 M145 E146 L152	N144-R148 WeakPolarHBondContact O-CG 2.86Å; N144-R148 PolarHBondContact O-N 3.01Å; M145-R148 WeakPolarHBondContact O-CB 3.36Å; M145-R148 PolarHBondContact O-N 2.81Å; M145-R148 VanDerWaalsContact O-N 3.11Å; E146-R148 VanDerWaalsContact C-N 3.29Å; E146-R148 PolarHBondContact O-N 3.42Å; R148-L152 WeakPolarHBondContact O-CG 3.35Å; R148-L152 PolarHBondContact O-N 3.39Å
149	V	91.8	Very high	88.7	Confident	1 Å²	1	69 Å²	69	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-70	-47.1	174.8	175	0	0	0	0	110.2	M145 E146 H151 L152 V153 K178 E179 L182 L199 V203	M145-V149 WeakPolarHBondContact O-CG2 3.43Å; M145-V149 PolarHBondContact O-N 3.32Å; E146-V149 PolarHBondContact O-N 2.83Å; E146-V149 VanDerWaalsContact O-N 3.07Å; V149-H151 VanDerWaalsContact C-N 3.33Å; V149-H151 PolarHBondContact O-N 2.91Å; V149-L152 PolarHBondContact O-N 3.26Å; V149-V153 WeakPolarHBondContact O-CG2 3.41Å; V149-V153 PolarHBondContact O-N 3.1Å; V149-V153 VanDerWaalsContact O-N 3.13Å; V149-K178 HydrophobicContact CG2-CB 3.77Å; V149-E179 HydrophobicContact CG1-CB 4Å; V149-E179 HydrophobicContact CG2-CB 4.38Å; V149-L182 HydrophobicContact CG2-CD1 4.42Å; V149-L199 HydrophobicContact CB-CD1 4.36Å; V149-L199 HydrophobicContact CB-CD2 4.47Å; V149-L199 HydrophobicContact CG1-CD1 3.76Å; V149-L199 HydrophobicContact CG1-CD2 4.32Å; V149-L199 HydrophobicContact CG1-CG 4.18Å; V149-V203 HydrophobicContact CG1-CG2 3.43Å; V149-V203 VanDerWaalsContact CG1-CG2 3.43Å
150	N	92.5	Very high	89.6	Confident	76 Å²	76	65 Å²	65	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-56.8	-46.6	174.9	-79.3	-20	0	0	0	111.7	E146 K147 L152 V153 E154 L199	E146-N150 PolarHBondContact O-N 3.22Å; K147-N150 PolarHBondContact O-N 3.34Å; N150-L152 VanDerWaalsContact C-N 3.33Å; N150-L152 PolarHBondContact O-N 3.05Å; N150-V153 WeakPolarHBondContact O-CA 3.45Å; N150-V153 WeakPolarHBondContact O-CB 3.4Å; N150-V153 PolarHBondContact O-N 3.05Å; N150-E154 WeakPolarHBondContact O-CG 3.25Å; N150-E154 PolarHBondContact O-N 2.87Å; N150-L199 WeakPolarHBondContact OD1-CD1 3.37Å
151	H	93.6	Very high	90.2	Very high	102 Å²	102	65.1 Å²	65.1	47%	0.472	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-37.7	179.9	-165.5	50.6	0	0	0	113.3	K147 V149 V153 E154 E155	K147-H151 WeakPolarHBondContact O-CB 3.36Å; K147-H151 PolarHBondContact O-N 3.01Å; V149-H151 VanDerWaalsContact C-N 3.33Å; V149-H151 PolarHBondContact O-N 2.91Å; H151-V153 VanDerWaalsContact C-N 3.32Å; H151-V153 PolarHBondContact O-N 3.36Å; H151-E154 IonicContact ND1-OE2 2.93Å; H151-E154 PolarHBondContact ND1-OE2 3.05Å; H151-E154 WeakPolarHBondContact O-CB 3.49Å; H151-E154 PolarHBondContact O-N 3.41Å; H151-E155 WeakPolarHBondContact O-CG 3.4Å; H151-E155 PolarHBondContact O-N 3.34Å
152	L	94.4	Very high	90.8	Very high	8 Å²	8	65.2 Å²	65.2	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-67.8	-30.2	172.8	-72.2	177.3	0	0	0	113.3	R148 V149 N150 E155 S156 K171 E174 A175 K178	R148-L152 WeakPolarHBondContact O-CG 3.35Å; R148-L152 PolarHBondContact O-N 3.39Å; V149-L152 PolarHBondContact O-N 3.26Å; N150-L152 VanDerWaalsContact C-N 3.33Å; N150-L152 PolarHBondContact O-N 3.05Å; L152-E155 WeakPolarHBondContact CD2-OE2 3.35Å; L152-S156 VanDerWaalsContact O-CB 3.26Å; L152-S156 WeakPolarHBondContact O-CB 3.32Å; L152-S156 PolarHBondContact O-N 2.88Å; L152-K171 HydrophobicContact CD2-CD 4.06Å; L152-E174 HydrophobicContact CD1-CB 3.98Å; L152-E174 HydrophobicContact CD1-CG 3.76Å; L152-A175 HydrophobicContact CB-CB 3.8Å; L152-A175 HydrophobicContact CD1-CB 4.29Å; L152-K178 HydrophobicContact CD1-CD 3.64Å; L152-K178 HydrophobicContact CD1-CG 4.42Å
153	V	93.4	Very high	91.1	Very high	23 Å²	23	66.9 Å²	66.9	14%	0.139	35%	0.35	C	S	.	.	H	α-helix	trans	-69.1	-42.7	173.5	172.4	0	0	0	0	109.9	V149 N150 H151 S156 C157 A175 V203 N206	V149-V153 WeakPolarHBondContact O-CG2 3.41Å; V149-V153 PolarHBondContact O-N 3.1Å; V149-V153 VanDerWaalsContact O-N 3.13Å; N150-V153 WeakPolarHBondContact O-CA 3.45Å; N150-V153 WeakPolarHBondContact O-CB 3.4Å; N150-V153 PolarHBondContact O-N 3.05Å; H151-V153 VanDerWaalsContact C-N 3.32Å; H151-V153 PolarHBondContact O-N 3.36Å; V153-S156 WeakPolarHBondContact O-CB 3.47Å; V153-S156 PolarHBondContact O-N 3.49Å; V153-C157 PolarHBondContact O-N 2.97Å; V153-C157 PolarHBondContact O-SG 3.44Å; V153-A175 HydrophobicContact CG2-CB 4.06Å; V153-V203 HydrophobicContact CG2-CG2 3.73Å; V153-N206 HydrophobicContact CG1-CB 4.43Å
154	E	93.8	Very high	91.4	Very high	109 Å²	109	65.7 Å²	65.7	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-59.9	-51.8	172.9	-67.4	164.3	178	0	0	111.7	N150 H151 S156 C157 V158	N150-E154 WeakPolarHBondContact O-CG 3.25Å; N150-E154 PolarHBondContact O-N 2.87Å; H151-E154 IonicContact ND1-OE2 2.93Å; H151-E154 PolarHBondContact ND1-OE2 3.05Å; H151-E154 WeakPolarHBondContact O-CB 3.49Å; H151-E154 PolarHBondContact O-N 3.41Å; E154-S156 VanDerWaalsContact C-N 3.28Å; E154-S156 PolarHBondContact O-N 3.41Å; E154-C157 CarbonylContact O-C 3.59Å; E154-C157 WeakPolarHBondContact O-CA 3.42Å; E154-C157 WeakPolarHBondContact O-CB 3.31Å; E154-C157 PolarHBondContact O-N 2.95Å; E154-V158 WeakPolarHBondContact O-CG2 3.29Å; E154-V158 PolarHBondContact O-N 2.96Å
155	E	93.8	Very high	91.5	Very high	61 Å²	61	66.3 Å²	66.3	29%	0.285	35%	0.348	S	S	.	.	H	α-helix	trans	-55.8	-42.2	176.4	-75.4	-177.3	153.8	0	0	112	H151 L152 C157 V158 A159 K171	H151-E155 WeakPolarHBondContact O-CG 3.4Å; H151-E155 PolarHBondContact O-N 3.34Å; L152-E155 WeakPolarHBondContact CD2-OE2 3.35Å; E155-C157 VanDerWaalsContact C-N 3.34Å; E155-C157 PolarHBondContact O-N 3.01Å; E155-V158 PolarHBondContact O-N 3.08Å; E155-A159 VanDerWaalsContact O-CB 3.32Å; E155-A159 WeakPolarHBondContact O-CB 3.47Å; E155-A159 PolarHBondContact O-N 3.3Å; E155-K171 HydrophobicContact CB-CD 4.41Å; E155-K171 HydrophobicContact CB-CG 4.41Å; E155-K171 IonicContact OE1-NZ 3.9Å; E155-K171 PolarHBondContact OE1-NZ 3.06Å; E155-K171 VanDerWaalsContact OE2-CD 3.28Å; E155-K171 WeakPolarHBondContact OE2-CD 3.41Å; E155-K171 WeakPolarHBondContact OE2-CE 3.42Å; E155-K171 IonicContact OE2-NZ 3.12Å; E155-K171 PolarHBondContact OE2-NZ 3.28Å
156	S	94.8	Very high	91.8	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-38.2	176	179	0	0	0	0	112.7	L152 V153 E154 A160 A168 N206	L152-S156 VanDerWaalsContact O-CB 3.26Å; L152-S156 WeakPolarHBondContact O-CB 3.32Å; L152-S156 PolarHBondContact O-N 2.88Å; V153-S156 WeakPolarHBondContact O-CB 3.47Å; V153-S156 PolarHBondContact O-N 3.49Å; E154-S156 VanDerWaalsContact C-N 3.28Å; E154-S156 PolarHBondContact O-N 3.41Å; S156-A160 VanDerWaalsContact O-CB 3.28Å; S156-A160 WeakPolarHBondContact O-CB 3.24Å; S156-A160 PolarHBondContact O-N 2.64Å; S156-A160 VanDerWaalsContact O-N 3.11Å; S156-A168 WeakPolarHBondContact O-CB 3.32Å; S156-A168 PolarHBondContact OG-O 3.3Å; S156-N206 WeakPolarHBondContact CB-ND2 3.4Å; S156-N206 PolarHBondContact OG-ND2 3.42Å; S156-N206 VanDerWaalsContact OG-ND2 3.11Å
157	C	92.7	Very high	92	Very high	57 Å²	57	71 Å²	71	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-70.9	-40.2	175.1	-71.7	0	0	0	0	112.4	V153 E154 E155 A160 C161	V153-C157 PolarHBondContact O-N 2.97Å; V153-C157 PolarHBondContact O-SG 3.44Å; E154-C157 CarbonylContact O-C 3.59Å; E154-C157 WeakPolarHBondContact O-CA 3.42Å; E154-C157 WeakPolarHBondContact O-CB 3.31Å; E154-C157 PolarHBondContact O-N 2.95Å; E155-C157 VanDerWaalsContact C-N 3.34Å; E155-C157 PolarHBondContact O-N 3.01Å; C157-A160 WeakPolarHBondContact O-CB 3.41Å; C157-A160 PolarHBondContact O-N 3.19Å; C157-C161 PolarHBondContact O-N 3.16Å; C157-C161 VanDerWaalsContact O-N 3.08Å; C157-C161 PolarHBondContact O-SG 2.97Å; C157-C161 VanDerWaalsContact O-SG 3.33Å
158	V	93.9	Very high	92.1	Very high	79 Å²	79	64.3 Å²	64.3	48%	0.479	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-48.7	177	172.7	0	0	0	0	110.9	E154 E155 A160 C161 Q162	E154-V158 WeakPolarHBondContact O-CG2 3.29Å; E154-V158 PolarHBondContact O-N 2.96Å; E155-V158 PolarHBondContact O-N 3.08Å; V158-A160 PolarHBondContact O-N 2.71Å; V158-C161 WeakPolarHBondContact O-CB 3.49Å; V158-C161 PolarHBondContact O-N 3.05Å; V158-Q162 WeakPolarHBondContact O-CG 3.38Å; V158-Q162 PolarHBondContact O-N 2.86Å
159	A	92.9	Very high	92.2	Very high	3 Å²	3	57.1 Å²	57.1	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-58.8	-36.6	175.5	0	0	0	0	0	112.1	E155 Q162 G163 E164 L167 A168	E155-A159 VanDerWaalsContact O-CB 3.32Å; E155-A159 WeakPolarHBondContact O-CB 3.47Å; E155-A159 PolarHBondContact O-N 3.3Å; A159-Q162 PolarHBondContact O-N 3.2Å; A159-G163 PolarHBondContact O-N 2.72Å; A159-E164 HydrophobicContact CB-CB 4.36Å; A159-E164 PolarHBondContact O-N 2.73Å; A159-L167 HydrophobicContact CB-CD2 3.46Å; A159-L167 VanDerWaalsContact CB-CD2 3.46Å; A159-A168 HydrophobicContact CB-CB 3.9Å
160	A	90.9	Very high	92.3	Very high	27 Å²	27	63.7 Å²	63.7	22%	0.223	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-37	174.2	0	0	0	0	0	113.4	S156 C157 V158 Q162 G163 A168 R210	S156-A160 VanDerWaalsContact O-CB 3.28Å; S156-A160 WeakPolarHBondContact O-CB 3.24Å; S156-A160 PolarHBondContact O-N 2.64Å; S156-A160 VanDerWaalsContact O-N 3.11Å; C157-A160 WeakPolarHBondContact O-CB 3.41Å; C157-A160 PolarHBondContact O-N 3.19Å; V158-A160 PolarHBondContact O-N 2.71Å; A160-Q162 VanDerWaalsContact C-N 3.34Å; A160-G163 PolarHBondContact O-N 2.86Å; A160-A168 HydrophobicContact CB-CB 4.15Å; A160-R210 VanDerWaalsContact CB-CZ 3.4Å
161	C	90.7	Very high	92.4	Very high	119 Å²	119	62.5 Å²	62.5	80%	0.804	35%	0.345	S	S	*	.	H	α-helix	trans	-71.4	-28.7	174.9	-67.6	0	0	0	0	112.5	C157 V158 G163	C157-C161 PolarHBondContact O-N 3.16Å; C157-C161 VanDerWaalsContact O-N 3.08Å; C157-C161 PolarHBondContact O-SG 2.97Å; C157-C161 VanDerWaalsContact O-SG 3.33Å; V158-C161 WeakPolarHBondContact O-CB 3.49Å; V158-C161 PolarHBondContact O-N 3.05Å; C161-G163 VanDerWaalsContact C-N 3.28Å; C161-G163 PolarHBondContact O-N 3.47Å
162	Q	91.1	Very high	92.4	Very high	134 Å²	134	57.7 Å²	57.7	63%	0.626	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	175.7	-69.1	171.5	-21.8	0	0	113.8	V158 A159 A160 E164	V158-Q162 WeakPolarHBondContact O-CG 3.38Å; V158-Q162 PolarHBondContact O-N 2.86Å; A159-Q162 PolarHBondContact O-N 3.2Å; A160-Q162 VanDerWaalsContact C-N 3.34Å; Q162-E164 VanDerWaalsContact C-N 3.34Å
163	G	87.6	Confident	92.4	Very high	51 Å²	51	59.9 Å²	59.9	53%	0.526	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	4.5	-177.6	0	0	0	0	0	114.8	A159 A160 C161 I165	A159-G163 PolarHBondContact O-N 2.72Å; A160-G163 PolarHBondContact O-N 2.86Å; C161-G163 VanDerWaalsContact C-N 3.28Å; C161-G163 PolarHBondContact O-N 3.47Å; G163-I165 VanDerWaalsContact C-N 3.27Å; G163-I165 PolarHBondContact O-N 3.38Å
164	E	91	Very high	92.4	Very high	90 Å²	90	61.9 Å²	61.9	42%	0.421	34%	0.34	S	S	.	.			trans	-80	70.6	179	-62.4	-165.5	162.9	0	0	111.7	A159 Q162 T166 L167 A168	A159-E164 HydrophobicContact CB-CB 4.36Å; A159-E164 PolarHBondContact O-N 2.73Å; Q162-E164 VanDerWaalsContact C-N 3.34Å; E164-T166 VanDerWaalsContact C-N 3.25Å; E164-T166 PolarHBondContact O-N 3.49Å; E164-L167 HydrophobicContact CB-CB 4.16Å; E164-L167 PolarHBondContact O-N 2.9Å; E164-A168 VanDerWaalsContact O-CB 3.26Å; E164-A168 WeakPolarHBondContact O-CB 3.4Å; E164-A168 PolarHBondContact O-N 3.2Å
165	I	88.6	Confident	92.4	Very high	82 Å²	82	56.7 Å²	56.7	42%	0.421	32%	0.316	S	S	.	.	H	α-helix	trans	-56.3	-35.5	-172.1	-64.4	169.7	0	0	0	113.1	G163 L169 A213 N214	G163-I165 VanDerWaalsContact C-N 3.27Å; G163-I165 PolarHBondContact O-N 3.38Å; I165-L169 PolarHBondContact O-N 3.48Å; I165-A213 HydrophobicContact CG2-CB 4.47Å; I165-N214 VanDerWaalsContact CG2-ND2 3.27Å; I165-N214 WeakPolarHBondContact CG2-ND2 3.27Å; I165-N214 PolarHBondContact O-ND2 2.96Å
166	T	91	Very high	92.4	Very high	100 Å²	100	53.9 Å²	53.9	61%	0.613	30%	0.303	S	S	*	.	H	α-helix	trans	-76	-51.9	-179.7	48.6	0	0	0	0	112.1	E164 A168 L169 E170	E164-T166 VanDerWaalsContact C-N 3.25Å; E164-T166 PolarHBondContact O-N 3.49Å; T166-A168 VanDerWaalsContact C-N 3.3Å; T166-A168 PolarHBondContact O-N 3.4Å; T166-L169 WeakPolarHBondContact O-CB 3.4Å; T166-L169 PolarHBondContact O-N 2.98Å; T166-E170 PolarHBondContact O-N 3.42Å
167	L	91.3	Very high	92.3	Very high	67 Å²	67	61.8 Å²	61.8	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-41.8	178.7	-172.4	145.5	0	0	0	111	A159 E164 L169 E170 K171	A159-L167 HydrophobicContact CB-CD2 3.46Å; A159-L167 VanDerWaalsContact CB-CD2 3.46Å; E164-L167 HydrophobicContact CB-CB 4.16Å; E164-L167 PolarHBondContact O-N 2.9Å; L167-L169 VanDerWaalsContact C-N 3.26Å; L167-L169 PolarHBondContact O-N 2.94Å; L167-E170 PolarHBondContact O-N 3.28Å; L167-K171 HydrophobicContact CD2-CG 3.92Å; L167-K171 WeakPolarHBondContact O-CG 3.22Å; L167-K171 PolarHBondContact O-N 3.43Å
168	A	93	Very high	92.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57.2	-37.8	174.3	0	0	0	0	0	112.8	S156 A159 A160 E164 T166 A172	S156-A168 WeakPolarHBondContact O-CB 3.32Å; S156-A168 PolarHBondContact OG-O 3.3Å; A159-A168 HydrophobicContact CB-CB 3.9Å; A160-A168 HydrophobicContact CB-CB 4.15Å; E164-A168 VanDerWaalsContact O-CB 3.26Å; E164-A168 WeakPolarHBondContact O-CB 3.4Å; E164-A168 PolarHBondContact O-N 3.2Å; T166-A168 VanDerWaalsContact C-N 3.3Å; T166-A168 PolarHBondContact O-N 3.4Å; A168-A172 WeakPolarHBondContact O-CB 3.31Å; A168-A172 PolarHBondContact O-N 2.85Å; A168-A172 VanDerWaalsContact O-N 3.14Å
169	L	93.3	Very high	92.1	Very high	11 Å²	11	59.6 Å²	59.6	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-71.6	-40.9	176.1	-177.5	67.9	0	0	0	112.5	I165 T166 L167 A172 K173 R210 Y211 N214 M216	I165-L169 PolarHBondContact O-N 3.48Å; T166-L169 WeakPolarHBondContact O-CB 3.4Å; T166-L169 PolarHBondContact O-N 2.98Å; L167-L169 VanDerWaalsContact C-N 3.26Å; L167-L169 PolarHBondContact O-N 2.94Å; L169-A172 PolarHBondContact O-N 2.9Å; L169-K173 HydrophobicContact CD1-CD 4.49Å; L169-K173 HydrophobicContact CG-CD 4.11Å; L169-K173 WeakPolarHBondContact O-CB 3.47Å; L169-K173 WeakPolarHBondContact O-CG 3.47Å; L169-K173 PolarHBondContact O-N 3.27Å; L169-R210 HydrophobicContact CB-CB 4.45Å; L169-R210 HydrophobicContact CD1-CB 3.73Å; L169-Y211 HydrophobicContact CD1-CD1 3.69Å; L169-Y211 HydrophobicContact CD1-CE1 3.91Å; L169-Y211 HydrophobicContact CD1-CG 4.3Å; L169-N214 HydrophobicContact CD2-CB 4.1Å; L169-M216 HydrophobicContact CD2-SD 3.95Å
170	E	93.8	Very high	91.8	Very high	139 Å²	139	66 Å²	66	65%	0.65	33%	0.334	S	S	*	.	H	α-helix	trans	-62.1	-46.4	177.2	-68.1	-166.5	158	0	0	111.3	T166 L167 A172 K173 E174	T166-E170 PolarHBondContact O-N 3.42Å; L167-E170 PolarHBondContact O-N 3.28Å; E170-A172 PolarHBondContact O-N 3.04Å; E170-K173 PolarHBondContact O-N 2.94Å; E170-E174 PolarHBondContact O-N 3.31Å
171	K	93.9	Very high	91.7	Very high	51 Å²	51	68.4 Å²	68.4	22%	0.222	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-42.5	175.1	-66	-64.1	-168.7	160.7	0	112.5	L152 E155 L167 E174 A175	L152-K171 HydrophobicContact CD2-CD 4.06Å; E155-K171 HydrophobicContact CB-CD 4.41Å; E155-K171 HydrophobicContact CB-CG 4.41Å; E155-K171 IonicContact OE1-NZ 3.9Å; E155-K171 PolarHBondContact OE1-NZ 3.06Å; E155-K171 VanDerWaalsContact OE2-CD 3.28Å; E155-K171 WeakPolarHBondContact OE2-CD 3.41Å; E155-K171 WeakPolarHBondContact OE2-CE 3.42Å; E155-K171 IonicContact OE2-NZ 3.12Å; E155-K171 PolarHBondContact OE2-NZ 3.28Å; L167-K171 HydrophobicContact CD2-CG 3.92Å; L167-K171 WeakPolarHBondContact O-CG 3.22Å; L167-K171 PolarHBondContact O-N 3.43Å; K171-E174 PolarHBondContact O-N 3.35Å; K171-A175 PolarHBondContact O-N 2.74Å
172	A	94.1	Very high	91.5	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-38.7	174.7	0	0	0	0	0	113.1	A168 L169 E170 E174 A175 S176 L207 R210	A168-A172 WeakPolarHBondContact O-CB 3.31Å; A168-A172 PolarHBondContact O-N 2.85Å; A168-A172 VanDerWaalsContact O-N 3.14Å; L169-A172 PolarHBondContact O-N 2.9Å; E170-A172 PolarHBondContact O-N 3.04Å; A172-E174 VanDerWaalsContact C-N 3.34Å; A172-A175 PolarHBondContact O-N 2.97Å; A172-S176 PolarHBondContact O-N 2.93Å; A172-L207 HydrophobicContact CB-CB 4.47Å; A172-L207 HydrophobicContact CB-CD1 4.04Å; A172-R210 HydrophobicContact CB-CB 4.25Å; A172-R210 HydrophobicContact CB-CG 3.74Å
173	K	94.6	Very high	91.2	Very high	53 Å²	53	57.3 Å²	57.3	23%	0.23	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-38.5	173.9	-76.7	173.8	176.4	174.6	0	111.1	L169 E170 R177 L207 Y211	L169-K173 HydrophobicContact CD1-CD 4.49Å; L169-K173 HydrophobicContact CG-CD 4.11Å; L169-K173 WeakPolarHBondContact O-CB 3.47Å; L169-K173 WeakPolarHBondContact O-CG 3.47Å; L169-K173 PolarHBondContact O-N 3.27Å; E170-K173 PolarHBondContact O-N 2.94Å; K173-R177 VanDerWaalsContact O-CG 3.31Å; K173-R177 WeakPolarHBondContact O-CG 3.15Å; K173-R177 PolarHBondContact O-N 3.04Å; K173-R177 VanDerWaalsContact O-N 3.09Å; K173-L207 HydrophobicContact CG-CD1 3.86Å; K173-Y211 WeakPolarHBondContact CE-OH 3.29Å
174	E	93.8	Very high	91.1	Very high	65 Å²	65	62.3 Å²	62.3	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-45.4	174.2	-162.9	-169.9	155.8	0	0	111.7	L152 E170 K171 A172 S176 R177 K178	L152-E174 HydrophobicContact CD1-CB 3.98Å; L152-E174 HydrophobicContact CD1-CG 3.76Å; E170-E174 PolarHBondContact O-N 3.31Å; K171-E174 PolarHBondContact O-N 3.35Å; A172-E174 VanDerWaalsContact C-N 3.34Å; E174-S176 VanDerWaalsContact C-N 3.34Å; E174-S176 PolarHBondContact O-N 2.9Å; E174-R177 WeakPolarHBondContact O-CB 3.22Å; E174-R177 PolarHBondContact O-N 3.26Å; E174-R177 VanDerWaalsContact O-N 3.09Å; E174-K178 PolarHBondContact O-N 3.45Å; E174-K178 WeakPolarHBondContact OE1-CE 3.2Å; E174-K178 IonicContact OE1-NZ 3.63Å; E174-K178 PolarHBondContact OE1-NZ 2.94Å
175	A	93.7	Very high	90.7	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-56.3	-47.7	175.3	0	0	0	0	0	111.2	L152 V153 K171 A172 R177 K178 E179 V203	L152-A175 HydrophobicContact CB-CB 3.8Å; L152-A175 HydrophobicContact CD1-CB 4.29Å; V153-A175 HydrophobicContact CG2-CB 4.06Å; K171-A175 PolarHBondContact O-N 2.74Å; A172-A175 PolarHBondContact O-N 2.97Å; A175-R177 VanDerWaalsContact C-N 3.29Å; A175-R177 PolarHBondContact O-N 3.21Å; A175-K178 PolarHBondContact O-N 3.43Å; A175-E179 VanDerWaalsContact O-CB 3.29Å; A175-E179 WeakPolarHBondContact O-CB 3.48Å; A175-E179 PolarHBondContact O-N 3.01Å; A175-V203 HydrophobicContact CB-CG1 4.19Å
176	S	93.1	Very high	90.5	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-24.1	177.5	-174.7	0	0	0	0	114.4	A172 E174 R180 V203	A172-S176 PolarHBondContact O-N 2.93Å; E174-S176 VanDerWaalsContact C-N 3.34Å; E174-S176 PolarHBondContact O-N 2.9Å; S176-R180 WeakPolarHBondContact O-CG 3.42Å; S176-R180 PolarHBondContact O-N 3.11Å; S176-R180 PolarHBondContact O-NE 2.67Å; S176-R180 PolarHBondContact OG-NH2 2.88Å; S176-V203 VanDerWaalsContact CA-CG1 3.49Å
177	R	93.1	Very high	90	Very high	167 Å²	167	58 Å²	58	63%	0.63	26%	0.258	S	S	*	.	H	α-helix	trans	-75.8	-47	171.1	-71.6	168.2	-173.4	165.8	2	110.8	K173 E174 A175 R180 V181	K173-R177 VanDerWaalsContact O-CG 3.31Å; K173-R177 WeakPolarHBondContact O-CG 3.15Å; K173-R177 PolarHBondContact O-N 3.04Å; K173-R177 VanDerWaalsContact O-N 3.09Å; E174-R177 WeakPolarHBondContact O-CB 3.22Å; E174-R177 PolarHBondContact O-N 3.26Å; E174-R177 VanDerWaalsContact O-N 3.09Å; A175-R177 VanDerWaalsContact C-N 3.29Å; A175-R177 PolarHBondContact O-N 3.21Å; R177-R180 PolarHBondContact O-N 3.14Å; R177-V181 WeakPolarHBondContact O-CG2 3.38Å; R177-V181 PolarHBondContact O-N 3.05Å; R177-V181 VanDerWaalsContact O-N 3.1Å
178	K	91.2	Very high	89.6	Confident	76 Å²	76	62.5 Å²	62.5	33%	0.33	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-39.6	179.8	-71.3	-173.2	-174.6	160.2	0	112.1	V149 L152 E174 A175 V181 L182	V149-K178 HydrophobicContact CG2-CB 3.77Å; L152-K178 HydrophobicContact CD1-CD 3.64Å; L152-K178 HydrophobicContact CD1-CG 4.42Å; E174-K178 PolarHBondContact O-N 3.45Å; E174-K178 WeakPolarHBondContact OE1-CE 3.2Å; E174-K178 IonicContact OE1-NZ 3.63Å; E174-K178 PolarHBondContact OE1-NZ 2.94Å; A175-K178 PolarHBondContact O-N 3.43Å; K178-V181 PolarHBondContact O-N 3.15Å; K178-L182 WeakPolarHBondContact O-CB 3.31Å; K178-L182 PolarHBondContact O-N 3.4Å
179	E	90.9	Very high	89	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.061	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-45	174.4	-174.4	-80.1	158.3	0	0	111.8	V149 A175 V181 L182 A183 T200 V203	V149-E179 HydrophobicContact CG1-CB 4Å; V149-E179 HydrophobicContact CG2-CB 4.38Å; A175-E179 VanDerWaalsContact O-CB 3.29Å; A175-E179 WeakPolarHBondContact O-CB 3.48Å; A175-E179 PolarHBondContact O-N 3.01Å; E179-V181 VanDerWaalsContact C-N 3.33Å; E179-V181 PolarHBondContact O-N 3.26Å; E179-L182 WeakPolarHBondContact O-CA 3.33Å; E179-L182 WeakPolarHBondContact O-CB 3.47Å; E179-L182 PolarHBondContact O-N 3.48Å; E179-L182 VanDerWaalsContact O-N 3.1Å; E179-A183 PolarHBondContact O-N 3.5Å; E179-T200 VanDerWaalsContact OE1-CB 3.29Å; E179-T200 WeakPolarHBondContact OE1-CB 3.48Å; E179-T200 VanDerWaalsContact OE1-CG2 3.3Å; E179-T200 WeakPolarHBondContact OE1-CG2 3.34Å; E179-T200 PolarHBondContact OE1-OG1 2.74Å; E179-V203 HydrophobicContact CB-CG1 4.12Å; E179-V203 HydrophobicContact CB-CG2 4.3Å; E179-V203 HydrophobicContact CG-CB 4.37Å; E179-V203 HydrophobicContact CG-CG1 4.4Å; E179-V203 HydrophobicContact CG-CG2 4.22Å
180	R	87.9	Confident	87.9	Confident	137 Å²	137	69 Å²	69	52%	0.517	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-33.1	174.9	-80.5	-177.9	-97.3	-172.8	-14.3	114	S176 R177 R184	S176-R180 WeakPolarHBondContact O-CG 3.42Å; S176-R180 PolarHBondContact O-N 3.11Å; S176-R180 PolarHBondContact O-NE 2.67Å; S176-R180 PolarHBondContact OG-NH2 2.88Å; R177-R180 PolarHBondContact O-N 3.14Å; R180-R184 VanDerWaalsContact O-CG 3.3Å; R180-R184 WeakPolarHBondContact O-CG 3.24Å; R180-R184 PolarHBondContact O-N 3.45Å
181	V	89	Confident	87	Confident	78 Å²	78	64.4 Å²	64.4	47%	0.473	31%	0.309	S	S	.	.	H	α-helix	trans	-68.6	-40.2	172.4	171.6	0	0	0	0	110.4	R177 K178 E179 R184 Q185	R177-V181 WeakPolarHBondContact O-CG2 3.38Å; R177-V181 PolarHBondContact O-N 3.05Å; R177-V181 VanDerWaalsContact O-N 3.1Å; K178-V181 PolarHBondContact O-N 3.15Å; E179-V181 VanDerWaalsContact C-N 3.33Å; E179-V181 PolarHBondContact O-N 3.26Å; V181-R184 PolarHBondContact O-N 3.37Å; V181-Q185 WeakPolarHBondContact O-CB 3.49Å; V181-Q185 PolarHBondContact O-N 3.37Å
182	L	86	Confident	85.6	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-44.3	177.5	-169.7	153.7	0	0	0	112.5	M145 E146 V149 K178 E179 Q185 R186	M145-L182 HydrophobicContact CB-CD1 3.62Å; M145-L182 HydrophobicContact CB-CG 4.41Å; M145-L182 HydrophobicContact CE-CB 3.93Å; M145-L182 HydrophobicContact CE-CD1 4.28Å; M145-L182 HydrophobicContact CE-CG 3.91Å; E146-L182 HydrophobicContact CB-CD1 4.19Å; E146-L182 HydrophobicContact CG-CD1 3.46Å; E146-L182 VanDerWaalsContact CG-CD1 3.46Å; E146-L182 HydrophobicContact CG-CD2 4.17Å; E146-L182 HydrophobicContact CG-CG 4.41Å; V149-L182 HydrophobicContact CG2-CD1 4.42Å; K178-L182 WeakPolarHBondContact O-CB 3.31Å; K178-L182 PolarHBondContact O-N 3.4Å; E179-L182 WeakPolarHBondContact O-CA 3.33Å; E179-L182 WeakPolarHBondContact O-CB 3.47Å; E179-L182 PolarHBondContact O-N 3.48Å; E179-L182 VanDerWaalsContact O-N 3.1Å; L182-Q185 PolarHBondContact O-N 3.08Å; L182-R186 HydrophobicContact CD2-CG 4.49Å; L182-R186 VanDerWaalsContact CD2-NH1 3.32Å; L182-R186 PolarHBondContact O-N 3.05Å
183	A	84.7	Confident	84.2	Confident	16 Å²	16	72.2 Å²	72.2	13%	0.132	36%	0.359	C	S	.	.	H	α-helix	trans	-58.6	-49.5	173.9	0	0	0	0	0	111.4	E179 Q185 R186 E187	E179-A183 PolarHBondContact O-N 3.5Å; A183-Q185 VanDerWaalsContact C-N 3.31Å; A183-Q185 PolarHBondContact O-N 3.35Å; A183-R186 WeakPolarHBondContact O-CB 3.25Å; A183-R186 PolarHBondContact O-N 3.29Å; A183-R186 VanDerWaalsContact O-N 3.13Å; A183-E187 WeakPolarHBondContact O-CG 3.45Å; A183-E187 PolarHBondContact O-N 3.46Å
184	R	85.2	Confident	82.9	Confident	156 Å²	156	75.8 Å²	75.8	59%	0.589	38%	0.377	S	S	*	.	H	α-helix	trans	-59.8	-37.7	175.7	-72.4	171.7	-179.9	-176.5	-1.3	113.2	R180 V181 E187 Q188	R180-R184 VanDerWaalsContact O-CG 3.3Å; R180-R184 WeakPolarHBondContact O-CG 3.24Å; R180-R184 PolarHBondContact O-N 3.45Å; V181-R184 PolarHBondContact O-N 3.37Å; R184-E187 PolarHBondContact O-N 3.04Å; R184-Q188 WeakPolarHBondContact O-CB 3.41Å; R184-Q188 VanDerWaalsContact O-CG 3.26Å; R184-Q188 WeakPolarHBondContact O-CG 3.34Å; R184-Q188 PolarHBondContact O-N 3.2Å
185	Q	83.1	Confident	81.9	Confident	51 Å²	51	75.1 Å²	75.1	24%	0.238	38%	0.375	C	S	.	.	H	α-helix	trans	-69.1	-35.4	177.5	-173.4	170.2	-12.2	0	0	111.7	M145 V181 L182 A183 L189	M145-Q185 HydrophobicContact CE-CB 4.36Å; V181-Q185 WeakPolarHBondContact O-CB 3.49Å; V181-Q185 PolarHBondContact O-N 3.37Å; L182-Q185 PolarHBondContact O-N 3.08Å; A183-Q185 VanDerWaalsContact C-N 3.31Å; A183-Q185 PolarHBondContact O-N 3.35Å; Q185-L189 HydrophobicContact CG-CD1 4.11Å; Q185-L189 WeakPolarHBondContact O-CD1 3.39Å; Q185-L189 WeakPolarHBondContact O-CG 3.48Å; Q185-L189 PolarHBondContact O-N 2.86Å
186	R	83	Confident	81	Confident	19 Å²	19	78 Å²	78	7%	0.072	39%	0.39	C	S	.	.	H	α-helix	trans	-64.8	-44.2	171.2	-77.3	-177.9	159.8	144.6	-2.9	112.1	I142 E146 L182 A183 L189 G190 V191 Q194 I195	I142-R186 HydrophobicContact CD1-CG 4.35Å; E146-R186 IonicContact OE1-CZ 2.87Å; E146-R186 VanDerWaalsContact OE1-CZ 3.25Å; E146-R186 IonicContact OE1-NH1 2.87Å; E146-R186 PolarHBondContact OE1-NH1 3.09Å; E146-R186 IonicContact OE1-NH2 2.69Å; E146-R186 PolarHBondContact OE1-NH2 3.05Å; E146-R186 IonicContact OE2-NH2 2.72Å; E146-R186 PolarHBondContact OE2-NH2 2.94Å; L182-R186 HydrophobicContact CD2-CG 4.49Å; L182-R186 VanDerWaalsContact CD2-NH1 3.32Å; L182-R186 PolarHBondContact O-N 3.05Å; A183-R186 WeakPolarHBondContact O-CB 3.25Å; A183-R186 PolarHBondContact O-N 3.29Å; A183-R186 VanDerWaalsContact O-N 3.13Å; R186-L189 PolarHBondContact O-N 3.44Å; R186-G190 PolarHBondContact O-N 2.94Å; R186-V191 CarbonylContact O-C 3.53Å; R186-V191 PolarHBondContact O-N 3.32Å; R186-Q194 WeakPolarHBondContact CD-O 3.36Å; R186-Q194 PolarHBondContact NE-O 3.19Å; R186-Q194 PolarHBondContact NH1-O 2.98Å; R186-I195 HydrophobicContact CB-CG1 4.46Å
187	E	82	Confident	80.5	Confident	111 Å²	111	80.9 Å²	80.9	52%	0.519	41%	0.405	S	S	.	.	H	α-helix	trans	-58.7	-47.3	174.3	-69.5	169	173	0	0	111.8	A183 R184 L189 G190	A183-E187 WeakPolarHBondContact O-CG 3.45Å; A183-E187 PolarHBondContact O-N 3.46Å; R184-E187 PolarHBondContact O-N 3.04Å; E187-L189 VanDerWaalsContact C-N 3.27Å; E187-L189 PolarHBondContact O-N 2.93Å; E187-G190 PolarHBondContact O-N 2.82Å
188	Q	82.4	Confident	80	Confident	163 Å²	163	78.8 Å²	78.8	76%	0.762	41%	0.406	S	S	*	.	H	α-helix	trans	-63.1	-29.5	179.6	-76.8	173.9	-3.4	0	0	114	R184 G190	R184-Q188 WeakPolarHBondContact O-CB 3.41Å; R184-Q188 VanDerWaalsContact O-CG 3.26Å; R184-Q188 WeakPolarHBondContact O-CG 3.34Å; R184-Q188 PolarHBondContact O-N 3.2Å; Q188-G190 VanDerWaalsContact C-N 3.27Å
189	L	80.6	Confident	79.8	Confident	78 Å²	78	75.5 Å²	75.5	41%	0.408	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.8	176.7	-69.3	165.7	0	0	0	112.8	I142 Q185 R186 E187 V191	I142-L189 HydrophobicContact CD1-CD1 3.76Å; Q185-L189 HydrophobicContact CG-CD1 4.11Å; Q185-L189 WeakPolarHBondContact O-CD1 3.39Å; Q185-L189 WeakPolarHBondContact O-CG 3.48Å; Q185-L189 PolarHBondContact O-N 2.86Å; R186-L189 PolarHBondContact O-N 3.44Å; E187-L189 VanDerWaalsContact C-N 3.27Å; E187-L189 PolarHBondContact O-N 2.93Å; L189-V191 HydrophobicContact CB-CG2 3.92Å; L189-V191 WeakPolarHBondContact O-CG2 3.4Å; L189-V191 PolarHBondContact O-N 3.22Å
190	G	71	Confident	79.7	Confident	68 Å²	68	76 Å²	76	70%	0.701	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	11.2	-176.7	0	0	0	0	0	114.1	R186 E187 Q188	R186-G190 PolarHBondContact O-N 2.94Å; E187-G190 PolarHBondContact O-N 2.82Å; Q188-G190 VanDerWaalsContact C-N 3.27Å
191	V	73	Confident	79.8	Confident	44 Å²	44	71.9 Å²	71.9	27%	0.267	38%	0.381	S	S	.	.			trans	-105.1	39.7	-174.1	-153.2	0	0	0	0	111.2	R186 L189 D193 Q194	R186-V191 CarbonylContact O-C 3.53Å; R186-V191 PolarHBondContact O-N 3.32Å; L189-V191 HydrophobicContact CB-CG2 3.92Å; L189-V191 WeakPolarHBondContact O-CG2 3.4Å; L189-V191 PolarHBondContact O-N 3.22Å; V191-D193 VanDerWaalsContact C-N 3.26Å; V191-D193 PolarHBondContact O-N 3.19Å; V191-Q194 HydrophobicContact CG1-CB 3.8Å; V191-Q194 HydrophobicContact CG1-CG 3.57Å; V191-Q194 PolarHBondContact O-N 2.9Å; V191-Q194 VanDerWaalsContact O-N 3.17Å
192	A	64.6	Low	79.8	Confident	44 Å²	44	70.6 Å²	70.6	36%	0.364	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-62.4	-31.8	-177.8	0	0	0	0	0	112.7	Q194 I195	A192-Q194 PolarHBondContact O-N 3.23Å; A192-I195 WeakPolarHBondContact O-CD1 3.34Å; A192-I195 VanDerWaalsContact O-CG1 3.25Å; A192-I195 WeakPolarHBondContact O-CG1 3.27Å; A192-I195 PolarHBondContact O-N 2.77Å
193	D	65	Low	80.1	Confident	171 Å²	171	70.5 Å²	70.5	91%	0.914	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68.5	-12.1	178.3	-62.9	-24.9	0	0	0	113.6	V191	V191-D193 VanDerWaalsContact C-N 3.26Å; V191-D193 PolarHBondContact O-N 3.19Å
194	Q	67.4	Low	80.5	Confident	128 Å²	128	71.1 Å²	71.1	60%	0.598	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-101.2	21.4	174.6	-59.3	-179.2	12.5	0	0	113.2	R186 V191 A192 N196	R186-Q194 WeakPolarHBondContact CD-O 3.36Å; R186-Q194 PolarHBondContact NE-O 3.19Å; R186-Q194 PolarHBondContact NH1-O 2.98Å; V191-Q194 HydrophobicContact CG1-CB 3.8Å; V191-Q194 HydrophobicContact CG1-CG 3.57Å; V191-Q194 PolarHBondContact O-N 2.9Å; V191-Q194 VanDerWaalsContact O-N 3.17Å; A192-Q194 PolarHBondContact O-N 3.23Å; Q194-N196 PolarHBondContact O-N 3.17Å; Q194-N196 VanDerWaalsContact O-N 3.15Å
195	I	72	Confident	80.8	Confident	51 Å²	51	66.8 Å²	66.8	26%	0.262	36%	0.362	S	S	.	.			trans	-64.1	116.6	168.7	-69.4	165.7	0	0	0	108.8	R186 A192 L197	R186-I195 HydrophobicContact CB-CG1 4.46Å; A192-I195 WeakPolarHBondContact O-CD1 3.34Å; A192-I195 VanDerWaalsContact O-CG1 3.25Å; A192-I195 WeakPolarHBondContact O-CG1 3.27Å; A192-I195 PolarHBondContact O-N 2.77Å; I195-L197 PolarHBondContact O-N 3.01Å
196	N	76.8	Confident	81.3	Confident	61 Å²	61	64.9 Å²	64.9	33%	0.326	35%	0.353	S	S	.	.			trans	-69.8	89.1	177.5	-174.1	-16.2	0	0	0	110.5	E146 Q194 D198 L199 T200	E146-N196 WeakPolarHBondContact OE1-CB 3.4Å; E146-N196 PolarHBondContact OE1-ND2 3.14Å; Q194-N196 PolarHBondContact O-N 3.17Å; Q194-N196 VanDerWaalsContact O-N 3.15Å; N196-D198 PolarHBondContact O-N 2.89Å; N196-D198 PolarHBondContact OD1-N 3.06Å; N196-L199 HydrophobicContact CB-CB 3.98Å; N196-L199 WeakPolarHBondContact O-CB 3.45Å; N196-L199 PolarHBondContact O-N 3.47Å; N196-L199 VanDerWaalsContact O-N 3.12Å; N196-L199 PolarHBondContact OD1-N 3.23Å; N196-T200 PolarHBondContact O-N 3.3Å; N196-T200 VanDerWaalsContact O-N 3.13Å; N196-T200 PolarHBondContact O-OG1 3.15Å
197	L	81.4	Confident	81.8	Confident	63 Å²	63	64.1 Å²	64.1	33%	0.33	35%	0.351	S	S	.	.	H	α-helix	trans	-55.6	-36.5	-178	-75.7	160.6	0	0	0	112.6	I195 T200 Y201 M232 F233	I195-L197 PolarHBondContact O-N 3.01Å; L197-T200 PolarHBondContact O-N 3.34Å; L197-Y201 VanDerWaalsContact O-CB 3.31Å; L197-Y201 WeakPolarHBondContact O-CB 3.39Å; L197-Y201 PolarHBondContact O-N 3.13Å; L197-M232 HydrophobicContact CD1-CB 4.28Å; L197-M232 HydrophobicContact CD1-CE 4.21Å; L197-M232 HydrophobicContact CD2-CB 4.28Å; L197-F233 HydrophobicContact CB-CE1 4.19Å; L197-F233 HydrophobicContact CD2-CE1 3.85Å; L197-F233 HydrophobicContact CD2-CZ 4.39Å; L197-F233 WeakPolarHBondContact O-CE1 3.23Å
198	D	83.5	Confident	82.4	Confident	122 Å²	122	58.8 Å²	58.8	65%	0.652	33%	0.326	S	S	*	.	H	α-helix	trans	-69.8	-34.6	180	-63.7	-36.1	0	0	0	112	N196 S202	N196-D198 PolarHBondContact O-N 2.89Å; N196-D198 PolarHBondContact OD1-N 3.06Å; D198-S202 VanDerWaalsContact O-CB 3.3Å; D198-S202 WeakPolarHBondContact O-CB 3.43Å; D198-S202 PolarHBondContact O-N 3.34Å; D198-S202 PolarHBondContact O-OG 2.88Å
199	L	86.9	Confident	82.9	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-50.9	171.7	-178.5	61.1	0	0	0	111	E146 V149 N150 N196 Y201 S202 V203	E146-L199 HydrophobicContact CB-CD2 4.27Å; E146-L199 HydrophobicContact CG-CD2 3.97Å; V149-L199 HydrophobicContact CB-CD1 4.36Å; V149-L199 HydrophobicContact CB-CD2 4.47Å; V149-L199 HydrophobicContact CG1-CD1 3.76Å; V149-L199 HydrophobicContact CG1-CD2 4.32Å; V149-L199 HydrophobicContact CG1-CG 4.18Å; N150-L199 WeakPolarHBondContact OD1-CD1 3.37Å; N196-L199 HydrophobicContact CB-CB 3.98Å; N196-L199 WeakPolarHBondContact O-CB 3.45Å; N196-L199 PolarHBondContact O-N 3.47Å; N196-L199 VanDerWaalsContact O-N 3.12Å; N196-L199 PolarHBondContact OD1-N 3.23Å; L199-Y201 VanDerWaalsContact C-N 3.3Å; L199-Y201 PolarHBondContact O-N 3.43Å; L199-S202 PolarHBondContact O-N 2.86Å; L199-V203 HydrophobicContact CD1-CG2 4.19Å; L199-V203 WeakPolarHBondContact O-CB 3.41Å; L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.4Å; L199-V203 PolarHBondContact O-N 3.49Å
200	T	87.8	Confident	83.6	Confident	23 Å²	23	51.3 Å²	51.3	14%	0.141	29%	0.288	C	S	.	.	H	α-helix	trans	-57.9	-43.7	177	-56.4	0	0	0	0	111.2	E179 N196 L197 L204 F233	E179-T200 VanDerWaalsContact OE1-CB 3.29Å; E179-T200 WeakPolarHBondContact OE1-CB 3.48Å; E179-T200 VanDerWaalsContact OE1-CG2 3.3Å; E179-T200 WeakPolarHBondContact OE1-CG2 3.34Å; E179-T200 PolarHBondContact OE1-OG1 2.74Å; N196-T200 PolarHBondContact O-N 3.3Å; N196-T200 VanDerWaalsContact O-N 3.13Å; N196-T200 PolarHBondContact O-OG1 3.15Å; L197-T200 PolarHBondContact O-N 3.34Å; T200-L204 HydrophobicContact CG2-CD1 3.9Å; T200-L204 HydrophobicContact CG2-CG 4.49Å; T200-L204 WeakPolarHBondContact O-CB 3.33Å; T200-L204 VanDerWaalsContact O-CG 3.28Å; T200-L204 WeakPolarHBondContact O-CG 3.17Å; T200-L204 PolarHBondContact O-N 2.98Å; T200-F233 HydrophobicContact CG2-CZ 4.22Å
201	Y	89.8	Confident	84.7	Confident	51 Å²	51	49.4 Å²	49.4	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-50.9	174.9	177.6	-91.2	0	0	0	111.6	L197 L199 V203 L204 F205 I227 F233 L239	L197-Y201 VanDerWaalsContact O-CB 3.31Å; L197-Y201 WeakPolarHBondContact O-CB 3.39Å; L197-Y201 PolarHBondContact O-N 3.13Å; L199-Y201 VanDerWaalsContact C-N 3.3Å; L199-Y201 PolarHBondContact O-N 3.43Å; Y201-V203 PolarHBondContact O-N 2.91Å; Y201-L204 PolarHBondContact O-N 3.42Å; Y201-F205 HydrophobicContact CE1-CB 4.36Å; Y201-F205 WeakPolarHBondContact O-CB 3.32Å; Y201-F205 PolarHBondContact O-N 3.33Å; Y201-I227 HydrophobicContact CD2-CG2 3.81Å; Y201-I227 HydrophobicContact CE2-CG2 3.85Å; Y201-F233 HydrophobicContact CD2-CB 4Å; Y201-F233 AromaticContact CD2-CD1 3.98Å; Y201-F233 HydrophobicContact CD2-CD1 3.98Å; Y201-F233 HydrophobicContact CD2-CD2 4.3Å; Y201-F233 AromaticContact CD2-CG 3.85Å; Y201-F233 HydrophobicContact CD2-CG 3.85Å; Y201-F233 HydrophobicContact CE2-CB 4.35Å; Y201-F233 HydrophobicContact CG-CD1 4.43Å; Y201-L239 HydrophobicContact CE2-CD1 4.25Å
202	S	90.4	Very high	85.6	Confident	52 Å²	52	49.2 Å²	49.2	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-42.7	-176.6	-60.2	0	0	0	0	112.2	D198 L199 N206	D198-S202 VanDerWaalsContact O-CB 3.3Å; D198-S202 WeakPolarHBondContact O-CB 3.43Å; D198-S202 PolarHBondContact O-N 3.34Å; D198-S202 PolarHBondContact O-OG 2.88Å; L199-S202 PolarHBondContact O-N 2.86Å; S202-N206 WeakPolarHBondContact O-CB 3.12Å; S202-N206 PolarHBondContact O-N 2.69Å
203	V	92.3	Very high	86.9	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-47.2	177.3	172.8	0	0	0	0	111.5	V149 V153 A175 S176 E179 L199 Y201 L207	V149-V203 HydrophobicContact CG1-CG2 3.43Å; V149-V203 VanDerWaalsContact CG1-CG2 3.43Å; V153-V203 HydrophobicContact CG2-CG2 3.73Å; A175-V203 HydrophobicContact CB-CG1 4.19Å; S176-V203 VanDerWaalsContact CA-CG1 3.49Å; E179-V203 HydrophobicContact CB-CG1 4.12Å; E179-V203 HydrophobicContact CB-CG2 4.3Å; E179-V203 HydrophobicContact CG-CB 4.37Å; E179-V203 HydrophobicContact CG-CG1 4.4Å; E179-V203 HydrophobicContact CG-CG2 4.22Å; L199-V203 HydrophobicContact CD1-CG2 4.19Å; L199-V203 WeakPolarHBondContact O-CB 3.41Å; L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.4Å; L199-V203 PolarHBondContact O-N 3.49Å; Y201-V203 PolarHBondContact O-N 2.91Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.47Å; V203-L207 PolarHBondContact O-N 3.43Å
204	L	92.4	Very high	88.2	Confident	28 Å²	28	43.7 Å²	43.7	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-38.4	178.7	-70	174.7	0	0	0	112.2	T200 Y201 L207 A208 I227	T200-L204 HydrophobicContact CG2-CD1 3.9Å; T200-L204 HydrophobicContact CG2-CG 4.49Å; T200-L204 WeakPolarHBondContact O-CB 3.33Å; T200-L204 VanDerWaalsContact O-CG 3.28Å; T200-L204 WeakPolarHBondContact O-CG 3.17Å; T200-L204 PolarHBondContact O-N 2.98Å; Y201-L204 PolarHBondContact O-N 3.42Å; L204-L207 PolarHBondContact O-N 3.27Å; L204-A208 WeakPolarHBondContact O-CB 3.29Å; L204-A208 PolarHBondContact O-N 2.93Å; L204-I227 HydrophobicContact CB-CD1 3.79Å; L204-I227 HydrophobicContact CB-CG1 3.77Å; L204-I227 HydrophobicContact CD1-CG1 4.11Å
205	F	92.4	Very high	89.3	Confident	65 Å²	65	39.2 Å²	39.2	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-67.7	-44.8	178	-179.6	-111.7	0	0	0	111.8	Y201 A208 N209 Y224 I227 L239	Y201-F205 HydrophobicContact CE1-CB 4.36Å; Y201-F205 WeakPolarHBondContact O-CB 3.32Å; Y201-F205 PolarHBondContact O-N 3.33Å; F205-A208 PolarHBondContact O-N 3.17Å; F205-N209 WeakPolarHBondContact CE1-ND2 3.38Å; F205-N209 VanDerWaalsContact CZ-ND2 3.3Å; F205-N209 WeakPolarHBondContact CZ-ND2 3.4Å; F205-N209 PolarHBondContact O-N 2.92Å; F205-N209 PolarHBondContact O-ND2 3.26Å; F205-N209 VanDerWaalsContact O-ND2 3.08Å; F205-Y224 HydrophobicContact CD2-CE1 4.13Å; F205-Y224 HydrophobicContact CE2-CE1 4.21Å; F205-I227 HydrophobicContact CB-CD1 4.47Å; F205-L239 HydrophobicContact CD2-CD2 3.73Å; F205-L239 HydrophobicContact CE2-CD2 3.89Å
206	N	93.3	Very high	90.2	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.059	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-47.3	173.8	-173.1	19.2	0	0	0	110.8	V153 S156 S202 A208 N209 R210	V153-N206 HydrophobicContact CG1-CB 4.43Å; S156-N206 WeakPolarHBondContact CB-ND2 3.4Å; S156-N206 PolarHBondContact OG-ND2 3.42Å; S156-N206 VanDerWaalsContact OG-ND2 3.11Å; S202-N206 WeakPolarHBondContact O-CB 3.12Å; S202-N206 PolarHBondContact O-N 2.69Å; N206-A208 VanDerWaalsContact C-N 3.32Å; N206-A208 PolarHBondContact O-N 2.94Å; N206-N209 WeakPolarHBondContact O-CB 3.44Å; N206-N209 PolarHBondContact O-N 3.43Å; N206-N209 VanDerWaalsContact O-N 3.12Å; N206-R210 WeakPolarHBondContact O-CG 3.44Å; N206-R210 PolarHBondContact O-N 3.38Å; N206-R210 PolarHBondContact OD1-NE 3.08Å
207	L	94	Very high	91	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-44.5	176.4	-179.6	66.1	0	0	0	112.5	A172 K173 V203 L204 N209 R210 Y211 T223	A172-L207 HydrophobicContact CB-CB 4.47Å; A172-L207 HydrophobicContact CB-CD1 4.04Å; K173-L207 HydrophobicContact CG-CD1 3.86Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.47Å; V203-L207 PolarHBondContact O-N 3.43Å; L204-L207 PolarHBondContact O-N 3.27Å; L207-N209 PolarHBondContact O-N 3.06Å; L207-R210 PolarHBondContact O-N 3.04Å; L207-Y211 HydrophobicContact CD1-CD2 4.08Å; L207-Y211 HydrophobicContact CD1-CE2 3.61Å; L207-Y211 HydrophobicContact CD2-CE2 3.85Å; L207-Y211 HydrophobicContact CG-CD2 3.83Å; L207-Y211 HydrophobicContact CG-CE2 3.49Å; L207-Y211 VanDerWaalsContact CG-CE2 3.49Å; L207-Y211 VanDerWaalsContact O-CD2 3.29Å; L207-Y211 WeakPolarHBondContact O-CD2 3.42Å; L207-Y211 PolarHBondContact O-N 2.9Å; L207-T223 HydrophobicContact CD2-CG2 4.13Å
208	A	93.9	Very high	91.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-42.1	177.3	0	0	0	0	0	112.1	L204 F205 N206 Y211 T212 T223 Y224	L204-A208 WeakPolarHBondContact O-CB 3.29Å; L204-A208 PolarHBondContact O-N 2.93Å; F205-A208 PolarHBondContact O-N 3.17Å; N206-A208 VanDerWaalsContact C-N 3.32Å; N206-A208 PolarHBondContact O-N 2.94Å; A208-Y211 PolarHBondContact O-N 3.47Å; A208-T212 PolarHBondContact O-N 3.17Å; A208-T212 PolarHBondContact O-OG1 3.11Å; A208-T223 WeakPolarHBondContact CA-OG1 3.4Å; A208-T223 VanDerWaalsContact CB-OG1 3.31Å; A208-T223 WeakPolarHBondContact CB-OG1 3.29Å; A208-Y224 HydrophobicContact CB-CD1 4.17Å; A208-Y224 HydrophobicContact CB-CD2 3.9Å; A208-Y224 HydrophobicContact CB-CE1 3.95Å; A208-Y224 HydrophobicContact CB-CE2 3.64Å; A208-Y224 HydrophobicContact CB-CG 4.14Å
209	N	93.2	Very high	92.1	Very high	38 Å²	38	40.7 Å²	40.7	20%	0.203	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-43.4	174.5	-71.1	-41.1	0	0	0	112.4	F205 N206 L207 Y211 T212 A213 Y224	F205-N209 WeakPolarHBondContact CE1-ND2 3.38Å; F205-N209 VanDerWaalsContact CZ-ND2 3.3Å; F205-N209 WeakPolarHBondContact CZ-ND2 3.4Å; F205-N209 PolarHBondContact O-N 2.92Å; F205-N209 PolarHBondContact O-ND2 3.26Å; F205-N209 VanDerWaalsContact O-ND2 3.08Å; N206-N209 WeakPolarHBondContact O-CB 3.44Å; N206-N209 PolarHBondContact O-N 3.43Å; N206-N209 VanDerWaalsContact O-N 3.12Å; L207-N209 PolarHBondContact O-N 3.06Å; N209-Y211 VanDerWaalsContact C-N 3.32Å; N209-Y211 PolarHBondContact O-N 3.39Å; N209-T212 WeakPolarHBondContact CA-OG1 3.37Å; N209-T212 PolarHBondContact O-N 3.01Å; N209-T212 PolarHBondContact O-OG1 3.38Å; N209-A213 PolarHBondContact O-N 3.38Å; N209-Y224 PolarHBondContact OD1-OH 3.12Å
210	R	93.8	Very high	92.4	Very high	46 Å²	46	40.4 Å²	40.4	17%	0.174	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-37.6	175.8	-63.7	-54.3	95.8	-148.7	9.1	111.9	A160 L169 A172 N206 L207 A213 N214	A160-R210 VanDerWaalsContact CB-CZ 3.4Å; L169-R210 HydrophobicContact CB-CB 4.45Å; L169-R210 HydrophobicContact CD1-CB 3.73Å; A172-R210 HydrophobicContact CB-CB 4.25Å; A172-R210 HydrophobicContact CB-CG 3.74Å; N206-R210 WeakPolarHBondContact O-CG 3.44Å; N206-R210 PolarHBondContact O-N 3.38Å; N206-R210 PolarHBondContact OD1-NE 3.08Å; L207-R210 PolarHBondContact O-N 3.04Å; R210-A213 PolarHBondContact O-N 3.16Å; R210-N214 PolarHBondContact O-N 3.28Å; R210-N214 VanDerWaalsContact O-N 3.12Å; R210-N214 PolarHBondContact O-ND2 3.39Å
211	Y	95.1	Very high	92.7	Very high	27 Å²	27	39.6 Å²	39.6	11%	0.106	21%	0.208	C	C	.	.	H	α-helix	trans	-63.9	-40.5	172.7	-78.9	-48.6	0	0	0	112.7	L169 K173 L207 A208 N209 N214 G215 M216 E219 T223	L169-Y211 HydrophobicContact CD1-CD1 3.69Å; L169-Y211 HydrophobicContact CD1-CE1 3.91Å; L169-Y211 HydrophobicContact CD1-CG 4.3Å; K173-Y211 WeakPolarHBondContact CE-OH 3.29Å; L207-Y211 HydrophobicContact CD1-CD2 4.08Å; L207-Y211 HydrophobicContact CD1-CE2 3.61Å; L207-Y211 HydrophobicContact CD2-CE2 3.85Å; L207-Y211 HydrophobicContact CG-CD2 3.83Å; L207-Y211 HydrophobicContact CG-CE2 3.49Å; L207-Y211 VanDerWaalsContact CG-CE2 3.49Å; L207-Y211 VanDerWaalsContact O-CD2 3.29Å; L207-Y211 WeakPolarHBondContact O-CD2 3.42Å; L207-Y211 PolarHBondContact O-N 2.9Å; A208-Y211 PolarHBondContact O-N 3.47Å; N209-Y211 VanDerWaalsContact C-N 3.32Å; N209-Y211 PolarHBondContact O-N 3.39Å; Y211-N214 PolarHBondContact O-N 3.32Å; Y211-G215 PolarHBondContact O-N 2.89Å; Y211-M216 HydrophobicContact CD1-CB 3.83Å; Y211-M216 HydrophobicContact CD1-CG 4.35Å; Y211-M216 HydrophobicContact CD1-SD 3.78Å; Y211-M216 HydrophobicContact CE1-CE 4.41Å; Y211-M216 HydrophobicContact CE1-SD 3.92Å; Y211-M216 HydrophobicContact CG-CB 4.47Å; Y211-M216 PolarHBondContact O-N 3.39Å; Y211-E219 HydrophobicContact CD1-CB 4.04Å; Y211-E219 HydrophobicContact CD2-CB 4.09Å; Y211-E219 HydrophobicContact CE1-CB 4.04Å; Y211-E219 WeakPolarHBondContact CE1-OE2 3.46Å; Y211-E219 HydrophobicContact CE2-CB 4.06Å; Y211-E219 HydrophobicContact CG-CB 4.09Å; Y211-E219 PolarHBondContact OH-OE2 3.45Å; Y211-T223 HydrophobicContact CD2-CG2 4.13Å; Y211-T223 HydrophobicContact CE2-CG2 3.91Å
212	T	92.7	Very high	92.9	Very high	41 Å²	41	41.6 Å²	41.6	25%	0.252	22%	0.222	S	C	.	.	H	α-helix	trans	-64	-39.4	174.6	50.7	0	0	0	0	112.7	A208 N209 N214 G215 A220 Y224 I246	A208-T212 PolarHBondContact O-N 3.17Å; A208-T212 PolarHBondContact O-OG1 3.11Å; N209-T212 WeakPolarHBondContact CA-OG1 3.37Å; N209-T212 PolarHBondContact O-N 3.01Å; N209-T212 PolarHBondContact O-OG1 3.38Å; T212-N214 VanDerWaalsContact C-N 3.3Å; T212-N214 PolarHBondContact O-N 2.88Å; T212-G215 PolarHBondContact O-N 3.47Å; T212-A220 HydrophobicContact CG2-CB 3.57Å; T212-Y224 HydrophobicContact CG2-CE2 4.26Å; T212-I246 HydrophobicContact CG2-CD1 3.46Å; T212-I246 VanDerWaalsContact CG2-CD1 3.46Å; T212-I246 HydrophobicContact CG2-CG1 3.55Å
213	A	91	Very high	93	Very high	50 Å²	50	40 Å²	40	41%	0.413	21%	0.21	S	C	.	.	H	α-helix	trans	-65.9	-30.6	177.5	0	0	0	0	0	113.1	I165 N209 R210 G215	I165-A213 HydrophobicContact CG2-CB 4.47Å; N209-A213 PolarHBondContact O-N 3.38Å; R210-A213 PolarHBondContact O-N 3.16Å; A213-G215 VanDerWaalsContact C-N 3.32Å
214	N	91.2	Very high	93	Very high	49 Å²	49	40 Å²	40	26%	0.262	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	8.4	176.1	-78.8	-98.6	0	0	0	113.6	I165 L169 R210 Y211 T212 M216	I165-N214 VanDerWaalsContact CG2-ND2 3.27Å; I165-N214 WeakPolarHBondContact CG2-ND2 3.27Å; I165-N214 PolarHBondContact O-ND2 2.96Å; L169-N214 HydrophobicContact CD2-CB 4.1Å; R210-N214 PolarHBondContact O-N 3.28Å; R210-N214 VanDerWaalsContact O-N 3.12Å; R210-N214 PolarHBondContact O-ND2 3.39Å; Y211-N214 PolarHBondContact O-N 3.32Å; T212-N214 VanDerWaalsContact C-N 3.3Å; T212-N214 PolarHBondContact O-N 2.88Å; N214-M216 HydrophobicContact CB-CG 4.09Å; N214-M216 PolarHBondContact O-N 3.5Å; N214-M216 VanDerWaalsContact O-N 3.13Å
215	G	90.6	Very high	93	Very high	33 Å²	33	42.4 Å²	42.4	34%	0.34	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	8.3	-176.9	0	0	0	0	0	115.1	Y211 T212 A213 Y217	Y211-G215 PolarHBondContact O-N 2.89Å; T212-G215 PolarHBondContact O-N 3.47Å; A213-G215 VanDerWaalsContact C-N 3.32Å; G215-Y217 WeakPolarHBondContact O-CD2 3.27Å; G215-Y217 WeakPolarHBondContact O-CE2 3.05Å; G215-Y217 PolarHBondContact O-N 2.98Å
216	M	92.6	Very high	92.9	Very high	60 Å²	60	42.8 Å²	42.8	30%	0.296	23%	0.228	S	C	.	.			trans	-80.4	56.8	-178.6	-60.6	-170.8	80.2	0	0	111.3	L169 Y211 N214 Q218 E219 A220	L169-M216 HydrophobicContact CD2-SD 3.95Å; Y211-M216 HydrophobicContact CD1-CB 3.83Å; Y211-M216 HydrophobicContact CD1-CG 4.35Å; Y211-M216 HydrophobicContact CD1-SD 3.78Å; Y211-M216 HydrophobicContact CE1-CE 4.41Å; Y211-M216 HydrophobicContact CE1-SD 3.92Å; Y211-M216 HydrophobicContact CG-CB 4.47Å; Y211-M216 PolarHBondContact O-N 3.39Å; N214-M216 HydrophobicContact CB-CG 4.09Å; N214-M216 PolarHBondContact O-N 3.5Å; N214-M216 VanDerWaalsContact O-N 3.13Å; M216-Q218 VanDerWaalsContact C-N 3.34Å; M216-Q218 PolarHBondContact O-N 3.35Å; M216-E219 HydrophobicContact CB-CB 4.48Å; M216-E219 VanDerWaalsContact CE-CD 3.41Å; M216-E219 VanDerWaalsContact CE-OE1 3.22Å; M216-E219 WeakPolarHBondContact CE-OE1 3.32Å; M216-E219 VanDerWaalsContact CE-OE2 3.31Å; M216-E219 WeakPolarHBondContact CE-OE2 3.39Å; M216-E219 PolarHBondContact O-N 2.92Å; M216-E219 VanDerWaalsContact O-N 3.16Å; M216-A220 PolarHBondContact O-N 3.15Å
217	Y	93.6	Very high	92.7	Very high	74 Å²	74	42.2 Å²	42.2	29%	0.29	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-33.2	-165.1	-58.3	-57.4	0	0	0	115.3	G215 L221 I246 V249 Q250	G215-Y217 WeakPolarHBondContact O-CD2 3.27Å; G215-Y217 WeakPolarHBondContact O-CE2 3.05Å; G215-Y217 PolarHBondContact O-N 2.98Å; Y217-L221 WeakPolarHBondContact O-CB 3.41Å; Y217-L221 VanDerWaalsContact O-CG 3.26Å; Y217-L221 WeakPolarHBondContact O-CG 3.3Å; Y217-L221 PolarHBondContact O-N 3.4Å; Y217-I246 HydrophobicContact CD1-CG2 3.77Å; Y217-I246 HydrophobicContact CG-CG2 4.02Å; Y217-V249 HydrophobicContact CE1-CG1 4.1Å; Y217-V249 VanDerWaalsContact OH-CG1 3.29Å; Y217-V249 WeakPolarHBondContact OH-CG1 3.47Å; Y217-Q250 HydrophobicContact CD2-CG 4.14Å; Y217-Q250 HydrophobicContact CG-CG 4.34Å
218	Q	93.6	Very high	92.5	Very high	116 Å²	116	44 Å²	44	54%	0.542	24%	0.236	S	C	.	.	H	α-helix	trans	-71.5	-38.8	179	-60.2	-59.5	-25.1	0	0	111.5	M216 L221 N222	M216-Q218 VanDerWaalsContact C-N 3.34Å; M216-Q218 PolarHBondContact O-N 3.35Å; Q218-L221 PolarHBondContact O-N 3.28Å; Q218-N222 WeakPolarHBondContact O-CB 3.49Å; Q218-N222 PolarHBondContact O-N 3.4Å; Q218-N222 PolarHBondContact O-ND2 3.37Å
219	E	92.8	Very high	92.2	Very high	79 Å²	79	52.1 Å²	52.1	37%	0.369	27%	0.266	S	S	.	.	H	α-helix	trans	-67.6	-41.7	174.5	-64.8	-176.6	-159.3	0	0	110.7	Y211 M216 N222 T223	Y211-E219 HydrophobicContact CD1-CB 4.04Å; Y211-E219 HydrophobicContact CD2-CB 4.09Å; Y211-E219 HydrophobicContact CE1-CB 4.04Å; Y211-E219 WeakPolarHBondContact CE1-OE2 3.46Å; Y211-E219 HydrophobicContact CE2-CB 4.06Å; Y211-E219 HydrophobicContact CG-CB 4.09Å; Y211-E219 PolarHBondContact OH-OE2 3.45Å; M216-E219 HydrophobicContact CB-CB 4.48Å; M216-E219 VanDerWaalsContact CE-CD 3.41Å; M216-E219 VanDerWaalsContact CE-OE1 3.22Å; M216-E219 WeakPolarHBondContact CE-OE1 3.32Å; M216-E219 VanDerWaalsContact CE-OE2 3.31Å; M216-E219 WeakPolarHBondContact CE-OE2 3.39Å; M216-E219 PolarHBondContact O-N 2.92Å; M216-E219 VanDerWaalsContact O-N 3.16Å; E219-N222 PolarHBondContact O-N 3.1Å; E219-T223 WeakPolarHBondContact O-CG2 3.15Å; E219-T223 PolarHBondContact O-N 3.06Å; E219-T223 PolarHBondContact O-OG1 2.9Å; E219-T223 VanDerWaalsContact O-OG1 3.08Å
220	A	94	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.1	-52.3	170.8	0	0	0	0	0	112	T212 M216 N222 T223 Y224 I246	T212-A220 HydrophobicContact CG2-CB 3.57Å; M216-A220 PolarHBondContact O-N 3.15Å; A220-N222 VanDerWaalsContact C-N 3.33Å; A220-N222 PolarHBondContact O-N 2.84Å; A220-T223 WeakPolarHBondContact CA-OG1 3.31Å; A220-T223 PolarHBondContact O-N 3.17Å; A220-T223 PolarHBondContact O-OG1 2.98Å; A220-Y224 VanDerWaalsContact O-CD2 3.23Å; A220-Y224 WeakPolarHBondContact O-CD2 3.42Å; A220-Y224 PolarHBondContact O-N 2.92Å; A220-I246 HydrophobicContact CB-CD1 3.84Å
221	L	93.6	Very high	91	Very high	6 Å²	6	60.5 Å²	60.5	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-39.9	179.2	-75.1	167	0	0	0	112.5	Y217 Q218 Q225 M243 I246 Y247	Y217-L221 WeakPolarHBondContact O-CB 3.41Å; Y217-L221 VanDerWaalsContact O-CG 3.26Å; Y217-L221 WeakPolarHBondContact O-CG 3.3Å; Y217-L221 PolarHBondContact O-N 3.4Å; Q218-L221 PolarHBondContact O-N 3.28Å; L221-Q225 VanDerWaalsContact O-CB 3.29Å; L221-Q225 WeakPolarHBondContact O-CB 3.48Å; L221-Q225 PolarHBondContact O-N 3.36Å; L221-M243 HydrophobicContact CD2-CB 3.94Å; L221-M243 HydrophobicContact CD2-CE 3.93Å; L221-M243 HydrophobicContact CD2-CG 4.11Å; L221-I246 HydrophobicContact CD1-CG2 3.97Å; L221-I246 HydrophobicContact CD2-CB 4.24Å; L221-I246 HydrophobicContact CD2-CD1 3.98Å; L221-I246 HydrophobicContact CD2-CG2 4.19Å; L221-I246 HydrophobicContact CG-CB 4.48Å; L221-I246 HydrophobicContact CG-CD1 4.08Å; L221-I246 HydrophobicContact CG-CG2 3.92Å; L221-Y247 HydrophobicContact CD1-CE1 3.89Å; L221-Y247 HydrophobicContact CD1-CE2 4.19Å; L221-Y247 HydrophobicContact CD2-CD2 4.31Å; L221-Y247 HydrophobicContact CD2-CE2 3.7Å
222	N	94	Very high	90	Very high	93 Å²	93	65.8 Å²	65.8	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-45.5	175.4	-72.6	-24.2	0	0	0	111.7	Q218 E219 A220 Q225 T226	Q218-N222 WeakPolarHBondContact O-CB 3.49Å; Q218-N222 PolarHBondContact O-N 3.4Å; Q218-N222 PolarHBondContact O-ND2 3.37Å; E219-N222 PolarHBondContact O-N 3.1Å; A220-N222 VanDerWaalsContact C-N 3.33Å; A220-N222 PolarHBondContact O-N 2.84Å; N222-Q225 PolarHBondContact O-N 3.49Å; N222-T226 PolarHBondContact O-N 2.76Å; N222-T226 PolarHBondContact O-OG1 2.87Å
223	T	92.5	Very high	89.3	Confident	19 Å²	19	64.8 Å²	64.8	12%	0.117	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-43.1	176.4	52.4	0	0	0	0	112.5	L207 A208 Y211 E219 A220 Q225 T226 I227	L207-T223 HydrophobicContact CD2-CG2 4.13Å; A208-T223 WeakPolarHBondContact CA-OG1 3.4Å; A208-T223 VanDerWaalsContact CB-OG1 3.31Å; A208-T223 WeakPolarHBondContact CB-OG1 3.29Å; Y211-T223 HydrophobicContact CD2-CG2 4.13Å; Y211-T223 HydrophobicContact CE2-CG2 3.91Å; E219-T223 WeakPolarHBondContact O-CG2 3.15Å; E219-T223 PolarHBondContact O-N 3.06Å; E219-T223 PolarHBondContact O-OG1 2.9Å; E219-T223 VanDerWaalsContact O-OG1 3.08Å; A220-T223 WeakPolarHBondContact CA-OG1 3.31Å; A220-T223 PolarHBondContact O-N 3.17Å; A220-T223 PolarHBondContact O-OG1 2.98Å; T223-Q225 VanDerWaalsContact C-N 3.31Å; T223-Q225 PolarHBondContact O-N 3.05Å; T223-T226 WeakPolarHBondContact CA-OG1 3.31Å; T223-T226 PolarHBondContact O-N 2.9Å; T223-T226 PolarHBondContact O-OG1 3.41Å; T223-I227 WeakPolarHBondContact O-CG1 3.37Å; T223-I227 PolarHBondContact O-N 3.13Å
224	Y	93.5	Very high	88.4	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.008	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-41.3	171.3	-82.5	-61.1	0	0	0	112.1	F205 A208 N209 T212 A220 T226 I227 V228 L239 N242 M243 I246	F205-Y224 HydrophobicContact CD2-CE1 4.13Å; F205-Y224 HydrophobicContact CE2-CE1 4.21Å; A208-Y224 HydrophobicContact CB-CD1 4.17Å; A208-Y224 HydrophobicContact CB-CD2 3.9Å; A208-Y224 HydrophobicContact CB-CE1 3.95Å; A208-Y224 HydrophobicContact CB-CE2 3.64Å; A208-Y224 HydrophobicContact CB-CG 4.14Å; N209-Y224 PolarHBondContact OD1-OH 3.12Å; T212-Y224 HydrophobicContact CG2-CE2 4.26Å; A220-Y224 VanDerWaalsContact O-CD2 3.23Å; A220-Y224 WeakPolarHBondContact O-CD2 3.42Å; A220-Y224 PolarHBondContact O-N 2.92Å; Y224-T226 VanDerWaalsContact C-N 3.35Å; Y224-T226 PolarHBondContact O-N 3Å; Y224-I227 PolarHBondContact O-N 3.48Å; Y224-V228 WeakPolarHBondContact O-CG2 3.4Å; Y224-V228 PolarHBondContact O-N 3.02Å; Y224-L239 HydrophobicContact CD1-CB 4.32Å; Y224-L239 HydrophobicContact CD1-CD2 4.06Å; Y224-L239 HydrophobicContact CE1-CD2 3.92Å; Y224-N242 HydrophobicContact CE1-CB 3.93Å; Y224-N242 HydrophobicContact CE2-CB 4.21Å; Y224-N242 PolarHBondContact OH-ND2 2.56Å; Y224-M243 HydrophobicContact CD2-CG 4.41Å; Y224-M243 HydrophobicContact CG-CG 4.06Å; Y224-I246 HydrophobicContact CD2-CD1 3.85Å; Y224-I246 HydrophobicContact CE2-CD1 3.9Å
225	Q	92.2	Very high	87.9	Confident	79 Å²	79	68 Å²	68	37%	0.369	34%	0.34	S	S	.	.	H	α-helix	trans	-66.7	-34.4	177.7	-160.9	-175.7	20.7	0	0	112.3	L221 N222 T223 I227 V228 R229 M243	L221-Q225 VanDerWaalsContact O-CB 3.29Å; L221-Q225 WeakPolarHBondContact O-CB 3.48Å; L221-Q225 PolarHBondContact O-N 3.36Å; N222-Q225 PolarHBondContact O-N 3.49Å; T223-Q225 VanDerWaalsContact C-N 3.31Å; T223-Q225 PolarHBondContact O-N 3.05Å; Q225-I227 VanDerWaalsContact C-N 3.35Å; Q225-V228 PolarHBondContact O-N 3.39Å; Q225-R229 HydrophobicContact CG-CG 4.48Å; Q225-R229 WeakPolarHBondContact O-CB 3.38Å; Q225-R229 WeakPolarHBondContact O-CG 3.46Å; Q225-R229 PolarHBondContact O-N 3.45Å; Q225-R229 VanDerWaalsContact OE1-NH2 3.08Å; Q225-M243 HydrophobicContact CB-CE 4.48Å
226	T	89.2	Confident	87.6	Confident	72 Å²	72	67.7 Å²	67.7	44%	0.442	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-38	173	47.6	0	0	0	0	112.6	N222 T223 Y224	N222-T226 PolarHBondContact O-N 2.76Å; N222-T226 PolarHBondContact O-OG1 2.87Å; T223-T226 WeakPolarHBondContact CA-OG1 3.31Å; T223-T226 PolarHBondContact O-N 2.9Å; T223-T226 PolarHBondContact O-OG1 3.41Å; Y224-T226 VanDerWaalsContact C-N 3.35Å; Y224-T226 PolarHBondContact O-N 3Å
227	I	90	Very high	87.3	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67.4	-51.9	174.4	-53.9	163.6	0	0	0	109.5	Y201 L204 F205 T223 Y224 Q225 R229 N230 F233 L239	Y201-I227 HydrophobicContact CD2-CG2 3.81Å; Y201-I227 HydrophobicContact CE2-CG2 3.85Å; L204-I227 HydrophobicContact CB-CD1 3.79Å; L204-I227 HydrophobicContact CB-CG1 3.77Å; L204-I227 HydrophobicContact CD1-CG1 4.11Å; F205-I227 HydrophobicContact CB-CD1 4.47Å; T223-I227 WeakPolarHBondContact O-CG1 3.37Å; T223-I227 PolarHBondContact O-N 3.13Å; Y224-I227 PolarHBondContact O-N 3.48Å; Q225-I227 VanDerWaalsContact C-N 3.35Å; I227-R229 PolarHBondContact O-N 2.94Å; I227-N230 PolarHBondContact O-N 3.26Å; I227-F233 HydrophobicContact CB-CD2 4.3Å; I227-F233 HydrophobicContact CG2-CB 4.31Å; I227-F233 HydrophobicContact CG2-CD2 3.45Å; I227-F233 VanDerWaalsContact CG2-CD2 3.45Å; I227-F233 HydrophobicContact CG2-CE2 4.03Å; I227-F233 HydrophobicContact CG2-CG 4.15Å; I227-F233 WeakPolarHBondContact O-CD2 3.36Å; I227-L239 HydrophobicContact CB-CD1 4Å; I227-L239 HydrophobicContact CG2-CD1 3.34Å
228	V	88.6	Confident	87	Confident	39 Å²	39	66.1 Å²	66.1	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-24.1	-176.9	173.2	0	0	0	0	113.6	Y224 Q225 L239	Y224-V228 WeakPolarHBondContact O-CG2 3.4Å; Y224-V228 PolarHBondContact O-N 3.02Å; Q225-V228 PolarHBondContact O-N 3.39Å; V228-L239 HydrophobicContact CG2-CB 3.68Å; V228-L239 HydrophobicContact CG2-CD1 3.92Å; V228-L239 HydrophobicContact CG2-CG 4.49Å
229	R	88.1	Confident	86.9	Confident	172 Å²	172	60.8 Å²	60.8	65%	0.649	30%	0.3	S	S	*	.	H	α-helix	trans	-70.7	-29.5	173.2	-79.1	174.1	-169.1	179.1	9.3	113	Q225 I227 K231	Q225-R229 HydrophobicContact CG-CG 4.48Å; Q225-R229 WeakPolarHBondContact O-CB 3.38Å; Q225-R229 WeakPolarHBondContact O-CG 3.46Å; Q225-R229 PolarHBondContact O-N 3.45Å; Q225-R229 VanDerWaalsContact OE1-NH2 3.08Å; I227-R229 PolarHBondContact O-N 2.94Å; R229-K231 PolarHBondContact O-N 2.79Å
230	N	83.2	Confident	86.9	Confident	54 Å²	54	58 Å²	58	29%	0.289	29%	0.287	S	S	.	.			trans	-81.7	109	179	-176	5.4	0	0	0	110.2	I227 M232 F233	I227-N230 PolarHBondContact O-N 3.26Å; N230-M232 PolarHBondContact O-N 3.24Å; N230-M232 VanDerWaalsContact O-N 3.16Å; N230-M232 WeakPolarHBondContact OD1-CB 2.96Å; N230-M232 WeakPolarHBondContact OD1-CG 3.19Å; N230-M232 PolarHBondContact OD1-N 2.93Å; N230-M232 VanDerWaalsContact OD1-N 3.08Å; N230-F233 HydrophobicContact CB-CD2 3.62Å; N230-F233 HydrophobicContact CB-CE2 3.68Å; N230-F233 HydrophobicContact CB-CG 4.43Å; N230-F233 VanDerWaalsContact ND2-CE2 3.29Å; N230-F233 WeakPolarHBondContact ND2-CE2 3.43Å; N230-F233 VanDerWaalsContact ND2-CZ 3.31Å; N230-F233 WeakPolarHBondContact ND2-CZ 3.33Å; N230-F233 PolarHBondContact O-N 2.88Å
231	K	78.1	Confident	86.8	Confident	206 Å²	206	58.6 Å²	58.6	90%	0.896	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.5	179.8	-65.2	-176.2	-179.4	178.8	0	113.9	R229 F233	R229-K231 PolarHBondContact O-N 2.79Å; K231-F233 VanDerWaalsContact C-N 3.3Å
232	M	74.1	Confident	86.8	Confident	137 Å²	137	60.5 Å²	60.5	68%	0.675	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-22	178.1	-57.4	-61.8	-76.1	0	0	112.8	L197 N230	L197-M232 HydrophobicContact CD1-CB 4.28Å; L197-M232 HydrophobicContact CD1-CE 4.21Å; L197-M232 HydrophobicContact CD2-CB 4.28Å; N230-M232 PolarHBondContact O-N 3.24Å; N230-M232 VanDerWaalsContact O-N 3.16Å; N230-M232 WeakPolarHBondContact OD1-CB 2.96Å; N230-M232 WeakPolarHBondContact OD1-CG 3.19Å; N230-M232 PolarHBondContact OD1-N 2.93Å; N230-M232 VanDerWaalsContact OD1-N 3.08Å
233	F	78.2	Confident	86.7	Confident	21 Å²	21	56.6 Å²	56.6	9%	0.092	28%	0.279	C	S	.	.	S	Bend	trans	-83.5	121.8	-179.4	-60.3	-41.3	0	0	0	111.6	L197 T200 Y201 I227 N230 K231	L197-F233 HydrophobicContact CB-CE1 4.19Å; L197-F233 HydrophobicContact CD2-CE1 3.85Å; L197-F233 HydrophobicContact CD2-CZ 4.39Å; L197-F233 WeakPolarHBondContact O-CE1 3.23Å; T200-F233 HydrophobicContact CG2-CZ 4.22Å; Y201-F233 HydrophobicContact CD2-CB 4Å; Y201-F233 AromaticContact CD2-CD1 3.98Å; Y201-F233 HydrophobicContact CD2-CD1 3.98Å; Y201-F233 HydrophobicContact CD2-CD2 4.3Å; Y201-F233 AromaticContact CD2-CG 3.85Å; Y201-F233 HydrophobicContact CD2-CG 3.85Å; Y201-F233 HydrophobicContact CE2-CB 4.35Å; Y201-F233 HydrophobicContact CG-CD1 4.43Å; I227-F233 HydrophobicContact CB-CD2 4.3Å; I227-F233 HydrophobicContact CG2-CB 4.31Å; I227-F233 HydrophobicContact CG2-CD2 3.45Å; I227-F233 VanDerWaalsContact CG2-CD2 3.45Å; I227-F233 HydrophobicContact CG2-CE2 4.03Å; I227-F233 HydrophobicContact CG2-CG 4.15Å; I227-F233 WeakPolarHBondContact O-CD2 3.36Å; N230-F233 HydrophobicContact CB-CD2 3.62Å; N230-F233 HydrophobicContact CB-CE2 3.68Å; N230-F233 HydrophobicContact CB-CG 4.43Å; N230-F233 VanDerWaalsContact ND2-CE2 3.29Å; N230-F233 WeakPolarHBondContact ND2-CE2 3.43Å; N230-F233 VanDerWaalsContact ND2-CZ 3.31Å; N230-F233 WeakPolarHBondContact ND2-CZ 3.33Å; N230-F233 PolarHBondContact O-N 2.88Å; K231-F233 VanDerWaalsContact C-N 3.3Å
234	A	73.6	Confident	86.8	Confident	62 Å²	62	55.7 Å²	55.7	51%	0.512	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	161.9	172.3	0	0	0	0	0	112	A236	A234-A236 PolarHBondContact O-N 3.43Å
235	H	80.8	Confident	86.9	Confident	105 Å²	105	58.5 Å²	58.5	49%	0.486	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	29	172.7	-45.3	-57	0	0	0	117.1	G237 R238 L239	H235-G237 PolarHBondContact O-N 2.95Å; H235-R238 HydrophobicContact CB-CB 4.43Å; H235-R238 HydrophobicContact CB-CG 4.26Å; H235-R238 PolarHBondContact O-N 2.83Å; H235-L239 PolarHBondContact O-N 2.83Å
236	A	84.4	Confident	87	Confident	25 Å²	25	55.1 Å²	55.1	21%	0.207	27%	0.273	C	S	.	.	H	α-helix	trans	-46.4	-33.7	171.9	0	0	0	0	0	114.2	A234 R238 L239 K240	A234-A236 PolarHBondContact O-N 3.43Å; A236-R238 PolarHBondContact O-N 3.48Å; A236-L239 PolarHBondContact O-N 3.36Å; A236-K240 WeakPolarHBondContact O-CG 3.47Å; A236-K240 PolarHBondContact O-N 3.39Å; A236-K240 VanDerWaalsContact O-N 3.09Å
237	G	85.8	Confident	87.2	Confident	3 Å²	3	53.3 Å²	53.3	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-41.6	174.5	0	0	0	0	0	114	H235 K240 V241	H235-G237 PolarHBondContact O-N 2.95Å; G237-K240 PolarHBondContact O-N 2.88Å; G237-V241 WeakPolarHBondContact O-CG2 3.42Å; G237-V241 PolarHBondContact O-N 3.33Å
238	R	87.5	Confident	87.5	Confident	99 Å²	99	56.5 Å²	56.5	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-66.5	-39.8	177.7	-63.7	-175.3	-176	179.2	2	111.3	H235 A236 K240 V241 N242	H235-R238 HydrophobicContact CB-CB 4.43Å; H235-R238 HydrophobicContact CB-CG 4.26Å; H235-R238 PolarHBondContact O-N 2.83Å; A236-R238 PolarHBondContact O-N 3.48Å; R238-K240 VanDerWaalsContact C-N 3.34Å; R238-K240 PolarHBondContact O-N 2.88Å; R238-V241 WeakPolarHBondContact O-CB 3.45Å; R238-V241 PolarHBondContact O-N 3.21Å; R238-V241 VanDerWaalsContact O-N 3.14Å; R238-N242 PolarHBondContact O-N 3.45Å
239	L	90.9	Very high	87.6	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-38.5	176.7	-59.4	174.1	0	0	0	112	Y201 F205 Y224 I227 V228 H235 A236 V241 N242 M243	Y201-L239 HydrophobicContact CE2-CD1 4.25Å; F205-L239 HydrophobicContact CD2-CD2 3.73Å; F205-L239 HydrophobicContact CE2-CD2 3.89Å; Y224-L239 HydrophobicContact CD1-CB 4.32Å; Y224-L239 HydrophobicContact CD1-CD2 4.06Å; Y224-L239 HydrophobicContact CE1-CD2 3.92Å; I227-L239 HydrophobicContact CB-CD1 4Å; I227-L239 HydrophobicContact CG2-CD1 3.34Å; V228-L239 HydrophobicContact CG2-CB 3.68Å; V228-L239 HydrophobicContact CG2-CD1 3.92Å; V228-L239 HydrophobicContact CG2-CG 4.49Å; H235-L239 PolarHBondContact O-N 2.83Å; A236-L239 PolarHBondContact O-N 3.36Å; L239-V241 VanDerWaalsContact C-N 3.29Å; L239-V241 PolarHBondContact O-N 3.32Å; L239-N242 WeakPolarHBondContact O-CB 3.41Å; L239-N242 PolarHBondContact O-N 3.15Å; L239-M243 WeakPolarHBondContact O-CG 3.49Å; L239-M243 PolarHBondContact O-N 3.03Å
240	K	92.1	Very high	87.9	Confident	21 Å²	21	53.1 Å²	53.1	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-33	173.5	-70.5	-178.1	-171.8	172.7	0	113	A236 G237 R238 M243 G244 M262	A236-K240 WeakPolarHBondContact O-CG 3.47Å; A236-K240 PolarHBondContact O-N 3.39Å; A236-K240 VanDerWaalsContact O-N 3.09Å; G237-K240 PolarHBondContact O-N 2.88Å; R238-K240 VanDerWaalsContact C-N 3.34Å; R238-K240 PolarHBondContact O-N 2.88Å; K240-M243 WeakPolarHBondContact O-CB 3.49Å; K240-M243 PolarHBondContact O-N 2.93Å; K240-G244 PolarHBondContact O-N 3.33Å; K240-M262 HydrophobicContact CD-CB 3.87Å; K240-M262 HydrophobicContact CD-CE 4.36Å; K240-M262 WeakPolarHBondContact CD-O 3.39Å; K240-M262 PolarHBondContact NZ-O 3.01Å
241	V	93	Very high	88.3	Confident	13 Å²	13	58.2 Å²	58.2	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-42.2	172.7	178.6	0	0	0	0	110.3	G237 R238 L239 M243 G244 N245 F260 I278	G237-V241 WeakPolarHBondContact O-CG2 3.42Å; G237-V241 PolarHBondContact O-N 3.33Å; R238-V241 WeakPolarHBondContact O-CB 3.45Å; R238-V241 PolarHBondContact O-N 3.21Å; R238-V241 VanDerWaalsContact O-N 3.14Å; L239-V241 VanDerWaalsContact C-N 3.29Å; L239-V241 PolarHBondContact O-N 3.32Å; V241-M243 VanDerWaalsContact C-N 3.34Å; V241-M243 PolarHBondContact O-N 3.41Å; V241-G244 CarbonylContact O-C 3.56Å; V241-G244 WeakPolarHBondContact O-CA 3.45Å; V241-G244 PolarHBondContact O-N 2.62Å; V241-G244 VanDerWaalsContact O-N 3.08Å; V241-N245 PolarHBondContact O-N 3Å; V241-N245 PolarHBondContact O-OD1 3.23Å; V241-F260 HydrophobicContact CG1-CD1 4.1Å; V241-F260 HydrophobicContact CG1-CE1 4.07Å; V241-F260 WeakPolarHBondContact O-CE1 3.43Å; V241-I278 HydrophobicContact CG1-CG1 4.29Å; V241-I278 HydrophobicContact CG2-CD1 3.6Å; V241-I278 HydrophobicContact CG2-CG1 3.61Å; V241-I278 HydrophobicContact CG2-CG2 4.46Å
242	N	92.4	Very high	89	Confident	45 Å²	45	50.8 Å²	50.8	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-40.9	173.1	-69.9	11.4	0	0	0	112.1	Y224 R238 L239 G244 N245 I246	Y224-N242 HydrophobicContact CE1-CB 3.93Å; Y224-N242 HydrophobicContact CE2-CB 4.21Å; Y224-N242 PolarHBondContact OH-ND2 2.56Å; R238-N242 PolarHBondContact O-N 3.45Å; L239-N242 WeakPolarHBondContact O-CB 3.41Å; L239-N242 PolarHBondContact O-N 3.15Å; N242-G244 VanDerWaalsContact C-N 3.31Å; N242-G244 PolarHBondContact O-N 2.66Å; N242-N245 WeakPolarHBondContact O-CB 3.24Å; N242-N245 PolarHBondContact O-N 3.39Å; N242-I246 WeakPolarHBondContact O-CG1 3.43Å; N242-I246 PolarHBondContact O-N 3.34Å; N242-I246 VanDerWaalsContact O-N 3.09Å
243	M	93.4	Very high	90	Very high	11 Å²	11	46.3 Å²	46.3	5%	0.054	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-39.1	172	-62.6	177.6	76.3	0	0	112	L221 Y224 Q225 L239 K240 V241 I246 Y247 F259	L221-M243 HydrophobicContact CD2-CB 3.94Å; L221-M243 HydrophobicContact CD2-CE 3.93Å; L221-M243 HydrophobicContact CD2-CG 4.11Å; Y224-M243 HydrophobicContact CD2-CG 4.41Å; Y224-M243 HydrophobicContact CG-CG 4.06Å; Q225-M243 HydrophobicContact CB-CE 4.48Å; L239-M243 WeakPolarHBondContact O-CG 3.49Å; L239-M243 PolarHBondContact O-N 3.03Å; K240-M243 WeakPolarHBondContact O-CB 3.49Å; K240-M243 PolarHBondContact O-N 2.93Å; V241-M243 VanDerWaalsContact C-N 3.34Å; V241-M243 PolarHBondContact O-N 3.41Å; M243-I246 PolarHBondContact O-N 3.45Å; M243-Y247 WeakPolarHBondContact O-CD2 3.33Å; M243-Y247 PolarHBondContact O-N 3.24Å; M243-Y247 VanDerWaalsContact O-N 3.15Å; M243-F259 HydrophobicContact CB-CD1 3.97Å; M243-F259 HydrophobicContact CB-CE1 4.32Å; M243-F259 HydrophobicContact CB-CG 4.35Å; M243-F259 HydrophobicContact CE-CE1 3.74Å; M243-F259 HydrophobicContact CE-CZ 4.1Å; M243-F259 HydrophobicContact SD-CD1 4.36Å; M243-F259 HydrophobicContact SD-CE1 4.04Å
244	G	94	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-43.2	173.3	0	0	0	0	0	112.7	K240 V241 N242 I246 Y247 Y248 A256 F260	K240-G244 PolarHBondContact O-N 3.33Å; V241-G244 CarbonylContact O-C 3.56Å; V241-G244 WeakPolarHBondContact O-CA 3.45Å; V241-G244 PolarHBondContact O-N 2.62Å; V241-G244 VanDerWaalsContact O-N 3.08Å; N242-G244 VanDerWaalsContact C-N 3.31Å; N242-G244 PolarHBondContact O-N 2.66Å; G244-I246 VanDerWaalsContact C-N 3.32Å; G244-I246 PolarHBondContact O-N 2.68Å; G244-Y247 PolarHBondContact O-N 3.09Å; G244-Y248 PolarHBondContact O-N 2.67Å; G244-A256 WeakPolarHBondContact O-CB 3.5Å; G244-F260 VanDerWaalsContact C-CZ 3.41Å
245	N	94.5	Very high	91.8	Very high	62 Å²	62	50.9 Å²	50.9	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-60.2	-40.8	175.3	-65.7	-16	0	0	0	111.6	V241 N242 Y248 V249 F260 N281	V241-N245 PolarHBondContact O-N 3Å; V241-N245 PolarHBondContact O-OD1 3.23Å; N242-N245 WeakPolarHBondContact O-CB 3.24Å; N242-N245 PolarHBondContact O-N 3.39Å; N245-Y248 WeakPolarHBondContact O-CB 3.49Å; N245-Y248 PolarHBondContact O-N 2.7Å; N245-V249 WeakPolarHBondContact O-CG2 3.12Å; N245-V249 PolarHBondContact O-N 3.14Å; N245-F260 VanDerWaalsContact OD1-CE1 3.23Å; N245-F260 WeakPolarHBondContact OD1-CE1 3.44Å; N245-F260 WeakPolarHBondContact OD1-CZ 3.37Å; N245-N281 PolarHBondContact OD1-ND2 3.43Å
246	I	94.2	Very high	92.5	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.036	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-47.9	174.2	-64.4	167.2	0	0	0	111	T212 Y217 A220 L221 Y224 N242 M243 G244 Y248 V249 Q250	T212-I246 HydrophobicContact CG2-CD1 3.46Å; T212-I246 VanDerWaalsContact CG2-CD1 3.46Å; T212-I246 HydrophobicContact CG2-CG1 3.55Å; Y217-I246 HydrophobicContact CD1-CG2 3.77Å; Y217-I246 HydrophobicContact CG-CG2 4.02Å; A220-I246 HydrophobicContact CB-CD1 3.84Å; L221-I246 HydrophobicContact CD1-CG2 3.97Å; L221-I246 HydrophobicContact CD2-CB 4.24Å; L221-I246 HydrophobicContact CD2-CD1 3.98Å; L221-I246 HydrophobicContact CD2-CG2 4.19Å; L221-I246 HydrophobicContact CG-CB 4.48Å; L221-I246 HydrophobicContact CG-CD1 4.08Å; L221-I246 HydrophobicContact CG-CG2 3.92Å; Y224-I246 HydrophobicContact CD2-CD1 3.85Å; Y224-I246 HydrophobicContact CE2-CD1 3.9Å; N242-I246 WeakPolarHBondContact O-CG1 3.43Å; N242-I246 PolarHBondContact O-N 3.34Å; N242-I246 VanDerWaalsContact O-N 3.09Å; M243-I246 PolarHBondContact O-N 3.45Å; G244-I246 VanDerWaalsContact C-N 3.32Å; G244-I246 PolarHBondContact O-N 2.68Å; I246-Y248 VanDerWaalsContact C-N 3.28Å; I246-Y248 PolarHBondContact O-N 3.04Å; I246-V249 PolarHBondContact O-N 3.11Å; I246-Q250 WeakPolarHBondContact O-CG 3.47Å; I246-Q250 PolarHBondContact O-N 3.34Å
247	Y	95.4	Very high	93	Very high	34 Å²	34	45.2 Å²	45.2	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-31.3	177.7	-75.2	-61.4	0	0	0	112.9	L221 M243 G244 Q250 K251 N252 K255 F259	L221-Y247 HydrophobicContact CD1-CE1 3.89Å; L221-Y247 HydrophobicContact CD1-CE2 4.19Å; L221-Y247 HydrophobicContact CD2-CD2 4.31Å; L221-Y247 HydrophobicContact CD2-CE2 3.7Å; M243-Y247 WeakPolarHBondContact O-CD2 3.33Å; M243-Y247 PolarHBondContact O-N 3.24Å; M243-Y247 VanDerWaalsContact O-N 3.15Å; G244-Y247 PolarHBondContact O-N 3.09Å; Y247-Q250 PolarHBondContact O-N 2.84Å; Y247-K251 PolarHBondContact O-N 3.19Å; Y247-N252 HydrophobicContact CD1-CB 4.37Å; Y247-N252 CarbonylContact O-C 3.53Å; Y247-N252 WeakPolarHBondContact O-CA 3.47Å; Y247-N252 PolarHBondContact O-N 3.33Å; Y247-K255 HydrophobicContact CD1-CB 4Å; Y247-K255 HydrophobicContact CD1-CD 4.07Å; Y247-K255 HydrophobicContact CD2-CB 4.25Å; Y247-K255 HydrophobicContact CE1-CB 4.47Å; Y247-K255 HydrophobicContact CE1-CD 3.88Å; Y247-K255 HydrophobicContact CG-CB 3.88Å; Y247-F259 AromaticContact CD2-CD2 3.5Å; Y247-F259 HydrophobicContact CD2-CD2 3.5Å; Y247-F259 VanDerWaalsContact CD2-CD2 3.5Å; Y247-F259 AromaticContact CD2-CE2 3.7Å; Y247-F259 HydrophobicContact CD2-CE2 3.7Å; Y247-F259 HydrophobicContact CD2-CG 4.34Å; Y247-F259 AromaticContact CE2-CD2 3.51Å; Y247-F259 HydrophobicContact CE2-CD2 3.51Å; Y247-F259 AromaticContact CE2-CE2 3.18Å; Y247-F259 HydrophobicContact CE2-CE2 3.18Å; Y247-F259 HydrophobicContact CE2-CG 4.44Å; Y247-F259 AromaticContact CE2-CZ 3.87Å; Y247-F259 HydrophobicContact CE2-CZ 3.87Å
248	Y	94.6	Very high	93.4	Very high	67 Å²	67	51.7 Å²	51.7	26%	0.263	25%	0.246	S	C	.	.	H	α-helix	trans	-64.6	-46.6	173.1	-176.7	-86.3	0	0	0	111.4	G244 N245 I246 Q250 K251 Y253 I284 S285 K288	G244-Y248 PolarHBondContact O-N 2.67Å; N245-Y248 WeakPolarHBondContact O-CB 3.49Å; N245-Y248 PolarHBondContact O-N 2.7Å; I246-Y248 VanDerWaalsContact C-N 3.28Å; I246-Y248 PolarHBondContact O-N 3.04Å; Y248-Q250 VanDerWaalsContact C-N 3.3Å; Y248-Q250 PolarHBondContact O-N 3.05Å; Y248-K251 WeakPolarHBondContact O-CA 3.43Å; Y248-K251 PolarHBondContact O-N 3.32Å; Y248-Y253 AromaticContact CD2-CD1 3.62Å; Y248-Y253 HydrophobicContact CD2-CD1 3.62Å; Y248-Y253 AromaticContact CD2-CE1 3.86Å; Y248-Y253 HydrophobicContact CD2-CE1 3.86Å; Y248-Y253 AromaticContact CE2-CD1 3.81Å; Y248-Y253 HydrophobicContact CE2-CD1 3.81Å; Y248-Y253 AromaticContact CE2-CE1 3.77Å; Y248-Y253 HydrophobicContact CE2-CE1 3.77Å; Y248-Y253 HydrophobicContact CG-CD1 4.32Å; Y248-Y253 HydrophobicContact CG-CE1 4.33Å; Y248-I284 HydrophobicContact CE2-CG2 4.1Å; Y248-I284 WeakPolarHBondContact OH-CG2 3.35Å; Y248-S285 WeakPolarHBondContact CD2-OG 3.41Å; Y248-K288 HydrophobicContact CE2-CG 4.18Å; Y248-K288 WeakPolarHBondContact OH-CE 3.47Å
249	V	92.2	Very high	93.7	Very high	82 Å²	82	48.8 Å²	48.8	50%	0.497	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-35.7	175.5	175.6	0	0	0	0	111.7	Y217 N245 I246 K251	Y217-V249 HydrophobicContact CE1-CG1 4.1Å; Y217-V249 VanDerWaalsContact OH-CG1 3.29Å; Y217-V249 WeakPolarHBondContact OH-CG1 3.47Å; N245-V249 WeakPolarHBondContact O-CG2 3.12Å; N245-V249 PolarHBondContact O-N 3.14Å; I246-V249 PolarHBondContact O-N 3.11Å; V249-K251 PolarHBondContact O-N 3.45Å; V249-K251 VanDerWaalsContact O-N 3.09Å
250	Q	92.7	Very high	93.9	Very high	59 Å²	59	48.7 Å²	48.7	28%	0.276	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	4.6	170.4	-69.6	-178.4	-9.9	0	0	114.5	Y217 I246 Y247 Y248 N252	Y217-Q250 HydrophobicContact CD2-CG 4.14Å; Y217-Q250 HydrophobicContact CG-CG 4.34Å; I246-Q250 WeakPolarHBondContact O-CG 3.47Å; I246-Q250 PolarHBondContact O-N 3.34Å; Y247-Q250 PolarHBondContact O-N 2.84Å; Y248-Q250 VanDerWaalsContact C-N 3.3Å; Y248-Q250 PolarHBondContact O-N 3.05Å; Q250-N252 PolarHBondContact O-N 2.88Å; Q250-N252 VanDerWaalsContact O-N 3.14Å
251	K	92	Very high	94	Very high	161 Å²	161	53.4 Å²	53.4	70%	0.7	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	19.2	-174	-54.9	178.4	-179	178.2	0	113.9	Y247 Y248 V249 Y253	Y247-K251 PolarHBondContact O-N 3.19Å; Y248-K251 WeakPolarHBondContact O-CA 3.43Å; Y248-K251 PolarHBondContact O-N 3.32Å; V249-K251 PolarHBondContact O-N 3.45Å; V249-K251 VanDerWaalsContact O-N 3.09Å; K251-Y253 HydrophobicContact CB-CE2 4.36Å; K251-Y253 PolarHBondContact O-N 3.09Å
252	N	93.9	Very high	94	Very high	50 Å²	50	56 Å²	56	27%	0.267	27%	0.265	S	S	.	.			trans	-97.8	64.3	179.4	-159.3	-41.7	0	0	0	110.7	Y247 Q250 S254 K255 A256	Y247-N252 HydrophobicContact CD1-CB 4.37Å; Y247-N252 CarbonylContact O-C 3.53Å; Y247-N252 WeakPolarHBondContact O-CA 3.47Å; Y247-N252 PolarHBondContact O-N 3.33Å; Q250-N252 PolarHBondContact O-N 2.88Å; Q250-N252 VanDerWaalsContact O-N 3.14Å; N252-S254 VanDerWaalsContact C-N 3.29Å; N252-S254 PolarHBondContact O-N 2.82Å; N252-S254 PolarHBondContact OD1-OG 3.4Å; N252-K255 PolarHBondContact O-N 3.15Å; N252-K255 WeakPolarHBondContact OD1-CB 3.48Å; N252-K255 WeakPolarHBondContact OD1-CG 3.5Å; N252-K255 PolarHBondContact OD1-N 3.22Å; N252-A256 PolarHBondContact O-N 3.09Å
253	Y	94.8	Very high	94	Very high	43 Å²	43	53.9 Å²	53.9	17%	0.169	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-32.7	-170	-49.6	-63.2	0	0	0	113.7	Y248 K251 A256 I257 K288 L289	Y248-Y253 AromaticContact CD2-CD1 3.62Å; Y248-Y253 HydrophobicContact CD2-CD1 3.62Å; Y248-Y253 AromaticContact CD2-CE1 3.86Å; Y248-Y253 HydrophobicContact CD2-CE1 3.86Å; Y248-Y253 AromaticContact CE2-CD1 3.81Å; Y248-Y253 HydrophobicContact CE2-CD1 3.81Å; Y248-Y253 AromaticContact CE2-CE1 3.77Å; Y248-Y253 HydrophobicContact CE2-CE1 3.77Å; Y248-Y253 HydrophobicContact CG-CD1 4.32Å; Y248-Y253 HydrophobicContact CG-CE1 4.33Å; K251-Y253 HydrophobicContact CB-CE2 4.36Å; K251-Y253 PolarHBondContact O-N 3.09Å; Y253-A256 WeakPolarHBondContact O-CB 3.35Å; Y253-A256 PolarHBondContact O-N 3.49Å; Y253-I257 WeakPolarHBondContact O-CD1 3.46Å; Y253-I257 VanDerWaalsContact O-CG1 3.3Å; Y253-I257 WeakPolarHBondContact O-CG1 3.45Å; Y253-I257 PolarHBondContact O-N 3.4Å; Y253-K288 HydrophobicContact CD1-CB 3.97Å; Y253-K288 HydrophobicContact CD2-CB 3.93Å; Y253-K288 HydrophobicContact CE1-CB 3.79Å; Y253-K288 HydrophobicContact CE1-CG 4.04Å; Y253-K288 HydrophobicContact CE2-CB 3.74Å; Y253-K288 HydrophobicContact CG-CB 4.04Å; Y253-L289 HydrophobicContact CD2-CD2 4.08Å; Y253-L289 HydrophobicContact CD2-CG 4.35Å; Y253-L289 HydrophobicContact CG-CD2 4.49Å; Y253-L289 HydrophobicContact CG-CG 4.43Å
254	S	94.5	Very high	93.9	Very high	78 Å²	78	54.4 Å²	54.4	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-39.4	178.1	59.5	0	0	0	0	112.4	N252 K258	N252-S254 VanDerWaalsContact C-N 3.29Å; N252-S254 PolarHBondContact O-N 2.82Å; N252-S254 PolarHBondContact OD1-OG 3.4Å; S254-K258 PolarHBondContact O-N 3.07Å
255	K	93.9	Very high	93.7	Very high	101 Å²	101	60.6 Å²	60.6	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-68.2	-43.1	169.5	-71.2	-176.5	-174.7	177.6	0	111.1	Y247 N252 I257 K258 F259	Y247-K255 HydrophobicContact CD1-CB 4Å; Y247-K255 HydrophobicContact CD1-CD 4.07Å; Y247-K255 HydrophobicContact CD2-CB 4.25Å; Y247-K255 HydrophobicContact CE1-CB 4.47Å; Y247-K255 HydrophobicContact CE1-CD 3.88Å; Y247-K255 HydrophobicContact CG-CB 3.88Å; N252-K255 PolarHBondContact O-N 3.15Å; N252-K255 WeakPolarHBondContact OD1-CB 3.48Å; N252-K255 WeakPolarHBondContact OD1-CG 3.5Å; N252-K255 PolarHBondContact OD1-N 3.22Å; K255-I257 PolarHBondContact O-N 3.32Å; K255-K258 WeakPolarHBondContact O-CB 3.28Å; K255-K258 PolarHBondContact O-N 3.43Å; K255-K258 VanDerWaalsContact O-N 3.13Å; K255-F259 VanDerWaalsContact O-CD2 3.31Å; K255-F259 WeakPolarHBondContact O-CD2 3.36Å; K255-F259 PolarHBondContact O-N 3.36Å
256	A	95.3	Very high	93.5	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-54.3	-50.6	177.9	0	0	0	0	0	111.8	G244 N252 Y253 K258 F259 F260	G244-A256 WeakPolarHBondContact O-CB 3.5Å; N252-A256 PolarHBondContact O-N 3.09Å; Y253-A256 WeakPolarHBondContact O-CB 3.35Å; Y253-A256 PolarHBondContact O-N 3.49Å; A256-K258 VanDerWaalsContact C-N 3.33Å; A256-K258 PolarHBondContact O-N 3.42Å; A256-F259 PolarHBondContact O-N 3.47Å; A256-F259 VanDerWaalsContact O-N 3.1Å; A256-F260 HydrophobicContact CB-CD2 4.33Å; A256-F260 HydrophobicContact CB-CE2 3.82Å; A256-F260 HydrophobicContact CB-CZ 4.42Å; A256-F260 WeakPolarHBondContact O-CD2 3.3Å; A256-F260 VanDerWaalsContact O-CG 3.29Å; A256-F260 WeakPolarHBondContact O-CG 3.46Å; A256-F260 PolarHBondContact O-N 3.36Å
257	I	94.9	Very high	93.2	Very high	10 Å²	10	62 Å²	62	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-57.8	-42.3	176.6	-69	157.5	0	0	0	111.8	Y253 K255 F259 F260 R261 S285 F286 L289	Y253-I257 WeakPolarHBondContact O-CD1 3.46Å; Y253-I257 VanDerWaalsContact O-CG1 3.3Å; Y253-I257 WeakPolarHBondContact O-CG1 3.45Å; Y253-I257 PolarHBondContact O-N 3.4Å; K255-I257 PolarHBondContact O-N 3.32Å; I257-F259 VanDerWaalsContact C-N 3.35Å; I257-F259 PolarHBondContact O-N 2.9Å; I257-F260 PolarHBondContact O-N 2.65Å; I257-R261 HydrophobicContact CG2-CG 4.4Å; I257-R261 WeakPolarHBondContact O-CB 3.46Å; I257-R261 WeakPolarHBondContact O-CG 3.47Å; I257-R261 PolarHBondContact O-N 3.01Å; I257-S285 VanDerWaalsContact CG1-CB 3.42Å; I257-F286 HydrophobicContact CD1-CD1 3.73Å; I257-F286 HydrophobicContact CD1-CE1 3.65Å; I257-F286 HydrophobicContact CD1-CG 4.2Å; I257-F286 HydrophobicContact CD1-CZ 4.05Å; I257-F286 HydrophobicContact CG1-CZ 4.49Å; I257-F286 HydrophobicContact CG2-CE1 4.31Å; I257-F286 HydrophobicContact CG2-CE2 4.27Å; I257-F286 HydrophobicContact CG2-CZ 3.74Å; I257-L289 HydrophobicContact CD1-CD1 3.49Å; I257-L289 VanDerWaalsContact CD1-CD1 3.49Å
258	K	95.1	Very high	92.8	Very high	139 Å²	139	63.9 Å²	63.9	60%	0.604	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-44.8	175.9	-174.9	175.9	-179.3	174.9	0	111.5	S254 K255 A256 M262	S254-K258 PolarHBondContact O-N 3.07Å; K255-K258 WeakPolarHBondContact O-CB 3.28Å; K255-K258 PolarHBondContact O-N 3.43Å; K255-K258 VanDerWaalsContact O-N 3.13Å; A256-K258 VanDerWaalsContact C-N 3.33Å; A256-K258 PolarHBondContact O-N 3.42Å; K258-M262 HydrophobicContact CG-SD 4.07Å; K258-M262 WeakPolarHBondContact O-CB 3.31Å; K258-M262 WeakPolarHBondContact O-CG 3.41Å; K258-M262 PolarHBondContact O-N 3.03Å
259	F	94.2	Very high	92.3	Very high	39 Å²	39	66.5 Å²	66.5	17%	0.171	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-37	177.1	-82.5	-79.1	0	0	0	112.9	M243 Y247 K255 A256 I257 M262 G263	M243-F259 HydrophobicContact CB-CD1 3.97Å; M243-F259 HydrophobicContact CB-CE1 4.32Å; M243-F259 HydrophobicContact CB-CG 4.35Å; M243-F259 HydrophobicContact CE-CE1 3.74Å; M243-F259 HydrophobicContact CE-CZ 4.1Å; M243-F259 HydrophobicContact SD-CD1 4.36Å; M243-F259 HydrophobicContact SD-CE1 4.04Å; Y247-F259 AromaticContact CD2-CD2 3.5Å; Y247-F259 HydrophobicContact CD2-CD2 3.5Å; Y247-F259 VanDerWaalsContact CD2-CD2 3.5Å; Y247-F259 AromaticContact CD2-CE2 3.7Å; Y247-F259 HydrophobicContact CD2-CE2 3.7Å; Y247-F259 HydrophobicContact CD2-CG 4.34Å; Y247-F259 AromaticContact CE2-CD2 3.51Å; Y247-F259 HydrophobicContact CE2-CD2 3.51Å; Y247-F259 AromaticContact CE2-CE2 3.18Å; Y247-F259 HydrophobicContact CE2-CE2 3.18Å; Y247-F259 HydrophobicContact CE2-CG 4.44Å; Y247-F259 AromaticContact CE2-CZ 3.87Å; Y247-F259 HydrophobicContact CE2-CZ 3.87Å; K255-F259 VanDerWaalsContact O-CD2 3.31Å; K255-F259 WeakPolarHBondContact O-CD2 3.36Å; K255-F259 PolarHBondContact O-N 3.36Å; A256-F259 PolarHBondContact O-N 3.47Å; A256-F259 VanDerWaalsContact O-N 3.1Å; I257-F259 VanDerWaalsContact C-N 3.35Å; I257-F259 PolarHBondContact O-N 2.9Å; F259-M262 PolarHBondContact O-N 3.05Å; F259-G263 PolarHBondContact O-N 3.07Å
260	F	95.6	Very high	92.1	Very high	1 Å²	1	68.3 Å²	68.3	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-45.7	174.1	-63.5	-42.7	0	0	0	112.3	V241 G244 N245 A256 I257 G263 L264 I278 N281 I282	V241-F260 HydrophobicContact CG1-CD1 4.1Å; V241-F260 HydrophobicContact CG1-CE1 4.07Å; V241-F260 WeakPolarHBondContact O-CE1 3.43Å; G244-F260 VanDerWaalsContact C-CZ 3.41Å; N245-F260 VanDerWaalsContact OD1-CE1 3.23Å; N245-F260 WeakPolarHBondContact OD1-CE1 3.44Å; N245-F260 WeakPolarHBondContact OD1-CZ 3.37Å; A256-F260 HydrophobicContact CB-CD2 4.33Å; A256-F260 HydrophobicContact CB-CE2 3.82Å; A256-F260 HydrophobicContact CB-CZ 4.42Å; A256-F260 WeakPolarHBondContact O-CD2 3.3Å; A256-F260 VanDerWaalsContact O-CG 3.29Å; A256-F260 WeakPolarHBondContact O-CG 3.46Å; A256-F260 PolarHBondContact O-N 3.36Å; I257-F260 PolarHBondContact O-N 2.65Å; F260-G263 WeakPolarHBondContact O-CA 3.31Å; F260-G263 PolarHBondContact O-N 3.26Å; F260-G263 VanDerWaalsContact O-N 3.09Å; F260-L264 PolarHBondContact O-N 2.71Å; F260-I278 HydrophobicContact CB-CG2 4.14Å; F260-I278 WeakPolarHBondContact O-CG2 3.48Å; F260-N281 HydrophobicContact CD1-CB 4.35Å; F260-N281 HydrophobicContact CD2-CB 4.15Å; F260-N281 HydrophobicContact CE1-CB 4.1Å; F260-N281 HydrophobicContact CE2-CB 3.91Å; F260-N281 HydrophobicContact CG-CB 4.39Å; F260-N281 HydrophobicContact CZ-CB 3.89Å; F260-I282 HydrophobicContact CB-CD1 3.9Å; F260-I282 HydrophobicContact CB-CG1 3.45Å; F260-I282 VanDerWaalsContact CB-CG1 3.45Å; F260-I282 HydrophobicContact CD2-CG1 4.27Å; F260-I282 HydrophobicContact CG-CG1 4.23Å
261	R	94.4	Very high	91.8	Very high	119 Å²	119	69.3 Å²	69.3	45%	0.449	35%	0.345	S	S	.	.	H	α-helix	trans	-57.7	-50.1	173.1	-74	-178.7	174.1	175.3	-0.3	110.8	I257 G263 L264 D265 I282 F286 E294	I257-R261 HydrophobicContact CG2-CG 4.4Å; I257-R261 WeakPolarHBondContact O-CB 3.46Å; I257-R261 WeakPolarHBondContact O-CG 3.47Å; I257-R261 PolarHBondContact O-N 3.01Å; R261-G263 PolarHBondContact O-N 3.32Å; R261-G263 VanDerWaalsContact O-N 3.12Å; R261-L264 WeakPolarHBondContact O-CB 2.98Å; R261-L264 PolarHBondContact O-N 2.78Å; R261-L264 VanDerWaalsContact O-N 3.07Å; R261-D265 PolarHBondContact O-N 2.97Å; R261-I282 HydrophobicContact CG-CD1 4.17Å; R261-F286 VanDerWaalsContact NH2-CZ 3.34Å; R261-E294 IonicContact CZ-OE2 3.22Å; R261-E294 IonicContact NH2-OE2 2.7Å; R261-E294 PolarHBondContact NH2-OE2 2.77Å
262	M	92.2	Very high	91.6	Very high	68 Å²	68	67.3 Å²	67.3	34%	0.335	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-19.8	175.6	-70.6	173.8	64.3	0	0	114.7	K240 K258 F259 Q266	K240-M262 HydrophobicContact CD-CB 3.87Å; K240-M262 HydrophobicContact CD-CE 4.36Å; K240-M262 WeakPolarHBondContact CD-O 3.39Å; K240-M262 PolarHBondContact NZ-O 3.01Å; K258-M262 HydrophobicContact CG-SD 4.07Å; K258-M262 WeakPolarHBondContact O-CB 3.31Å; K258-M262 WeakPolarHBondContact O-CG 3.41Å; K258-M262 PolarHBondContact O-N 3.03Å; F259-M262 PolarHBondContact O-N 3.05Å; M262-Q266 WeakPolarHBondContact O-CG 3.47Å
263	G	91.4	Very high	91.3	Very high	0 Å²	0	70 Å²	70	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-82.3	-44.9	171.4	0	0	0	0	0	111.8	F259 F260 R261 D265 Q266 V267	F259-G263 PolarHBondContact O-N 3.07Å; F260-G263 WeakPolarHBondContact O-CA 3.31Å; F260-G263 PolarHBondContact O-N 3.26Å; F260-G263 VanDerWaalsContact O-N 3.09Å; R261-G263 PolarHBondContact O-N 3.32Å; R261-G263 VanDerWaalsContact O-N 3.12Å; G263-D265 VanDerWaalsContact C-N 3.32Å; G263-D265 PolarHBondContact O-N 3.26Å; G263-Q266 CarbonylContact O-C 3.59Å; G263-Q266 PolarHBondContact O-N 3.31Å; G263-V267 WeakPolarHBondContact O-CG2 3.33Å; G263-V267 PolarHBondContact O-N 3Å
264	L	91.6	Very high	91	Very high	22 Å²	22	70.7 Å²	70.7	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-58.2	-41.4	176.1	-172.9	67.6	0	0	0	112.1	F260 R261 Q266 V267 R275 I278 M279 I282	F260-L264 PolarHBondContact O-N 2.71Å; R261-L264 WeakPolarHBondContact O-CB 2.98Å; R261-L264 PolarHBondContact O-N 2.78Å; R261-L264 VanDerWaalsContact O-N 3.07Å; L264-Q266 PolarHBondContact O-N 2.86Å; L264-V267 PolarHBondContact O-N 3.41Å; L264-R275 HydrophobicContact CD1-CB 3.81Å; L264-R275 HydrophobicContact CD1-CG 4.04Å; L264-R275 PolarHBondContact O-NH1 3.46Å; L264-I278 HydrophobicContact CB-CG2 3.95Å; L264-I278 HydrophobicContact CD1-CB 4.33Å; L264-I278 HydrophobicContact CD1-CG2 4.28Å; L264-M279 HydrophobicContact CD1-CG 4.29Å; L264-M279 HydrophobicContact CD2-CG 4.22Å; L264-M279 HydrophobicContact CD2-SD 3.55Å; L264-M279 VanDerWaalsContact CD2-SD 3.55Å; L264-I282 HydrophobicContact CD2-CD1 4.41Å
265	D	91.2	Very high	90.8	Very high	131 Å²	131	69.3 Å²	69.3	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.3	176.6	-59.5	-27.4	0	0	0	112.7	R261 G263	R261-D265 PolarHBondContact O-N 2.97Å; G263-D265 VanDerWaalsContact C-N 3.32Å; G263-D265 PolarHBondContact O-N 3.26Å
266	Q	88.5	Confident	90.6	Very high	90 Å²	90	65 Å²	65	42%	0.421	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-7.6	-178.1	-73.5	-167.7	-34.3	0	0	114.2	M262 G263 L264 P268	M262-Q266 WeakPolarHBondContact O-CG 3.47Å; G263-Q266 CarbonylContact O-C 3.59Å; G263-Q266 PolarHBondContact O-N 3.31Å; L264-Q266 PolarHBondContact O-N 2.86Å; Q266-P268 WeakPolarHBondContact O-CD 3.42Å
267	V	87.8	Confident	90.4	Very high	8 Å²	8	71.3 Å²	71.3	5%	0.048	35%	0.348	C	S	.	.	S	Bend	trans	-91.8	116.5	175.7	170.3	0	0	0	0	108.9	G263 L264 H271 M274 R275 I278	G263-V267 WeakPolarHBondContact O-CG2 3.33Å; G263-V267 PolarHBondContact O-N 3Å; L264-V267 PolarHBondContact O-N 3.41Å; V267-H271 HydrophobicContact CG1-CB 3.97Å; V267-M274 HydrophobicContact CG1-CB 4.14Å; V267-M274 HydrophobicContact CG1-CG 3.92Å; V267-M274 HydrophobicContact CG2-CG 4.22Å; V267-R275 HydrophobicContact CB-CG 4.42Å; V267-R275 HydrophobicContact CG1-CG 3.81Å; V267-R275 PolarHBondContact O-NH1 2.95Å; V267-I278 HydrophobicContact CB-CD1 4.45Å; V267-I278 HydrophobicContact CG2-CD1 3.88Å
268	P	87.1	Confident	90.3	Very high	73 Å²	73	70.9 Å²	70.9	47%	0.474	35%	0.346	S	S	.	.			trans	-51.5	144.1	178.5	-29.2	35.4	0	0	0	113.3	Q266 T270 H271	Q266-P268 WeakPolarHBondContact O-CD 3.42Å; P268-T270 PolarHBondContact O-N 3.09Å; P268-H271 PolarHBondContact O-N 3.11Å
269	N	85.3	Confident	90.2	Very high	123 Å²	123	65.8 Å²	65.8	66%	0.658	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.7	179.7	-69.4	-11.7	0	0	0	113.7	H271 R275	N269-H271 VanDerWaalsContact C-N 3.27Å; N269-H271 PolarHBondContact O-N 3.44Å; N269-R275 PolarHBondContact OD1-NE 3.16Å; N269-R275 PolarHBondContact OD1-NH1 3.34Å
270	T	87.7	Confident	90.2	Very high	119 Å²	119	65.8 Å²	65.8	73%	0.73	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.2	171.9	52.5	0	0	0	0	113.1	P268 K272	P268-T270 PolarHBondContact O-N 3.09Å; T270-K272 PolarHBondContact O-N 3.39Å
271	H	86.7	Confident	90.1	Very high	80 Å²	80	68 Å²	68	37%	0.37	34%	0.337	S	S	.	.			trans	-92	60.7	-178.8	-64.2	-55	0	0	0	112.2	V267 P268 N269 L273 M274 R275	V267-H271 HydrophobicContact CG1-CB 3.97Å; P268-H271 PolarHBondContact O-N 3.11Å; N269-H271 VanDerWaalsContact C-N 3.27Å; N269-H271 PolarHBondContact O-N 3.44Å; H271-L273 PolarHBondContact O-N 2.78Å; H271-M274 HydrophobicContact CB-CB 4.09Å; H271-M274 WeakPolarHBondContact O-CB 3.39Å; H271-M274 PolarHBondContact O-N 3.12Å; H271-R275 PolarHBondContact O-N 2.81Å; H271-R275 VanDerWaalsContact O-N 3.14Å
272	K	87.8	Confident	90.1	Very high	120 Å²	120	62.6 Å²	62.6	52%	0.522	32%	0.317	S	S	.	.	H	α-helix	trans	-46.1	-56.1	-178.6	-72	-164.7	168.2	-141.3	0	113.6	T270 M274 R275 I276 E305	T270-K272 PolarHBondContact O-N 3.39Å; K272-M274 PolarHBondContact O-N 3.37Å; K272-M274 VanDerWaalsContact O-N 3.15Å; K272-R275 WeakPolarHBondContact O-CA 3.37Å; K272-R275 WeakPolarHBondContact O-CB 3.43Å; K272-R275 PolarHBondContact O-N 3.13Å; K272-I276 WeakPolarHBondContact O-CG1 3.38Å; K272-I276 PolarHBondContact O-N 2.67Å; K272-E305 IonicContact NZ-OE2 3.78Å; K272-E305 PolarHBondContact NZ-OE2 2.96Å
273	L	87.5	Confident	90.1	Very high	105 Å²	105	59.4 Å²	59.4	55%	0.55	30%	0.301	S	S	.	.	H	α-helix	trans	-53.7	-36.9	179.9	-60	178	0	0	0	113.5	H271 K277 E306	H271-L273 PolarHBondContact O-N 2.78Å; L273-K277 WeakPolarHBondContact O-CG 2.96Å; L273-K277 PolarHBondContact O-N 2.85Å; L273-K277 VanDerWaalsContact O-N 3.11Å; L273-E306 WeakPolarHBondContact CD2-OE1 3.23Å; L273-E306 VanDerWaalsContact CD2-OE2 3.25Å; L273-E306 WeakPolarHBondContact CD2-OE2 3.38Å
274	M	87.9	Confident	90.2	Very high	58 Å²	58	61.5 Å²	61.5	29%	0.286	31%	0.312	S	S	.	.	H	α-helix	trans	-72.1	-41.2	177.8	-176.8	63.6	70.4	0	0	111	V267 H271 K272 I276 K277 I278	V267-M274 HydrophobicContact CG1-CB 4.14Å; V267-M274 HydrophobicContact CG1-CG 3.92Å; V267-M274 HydrophobicContact CG2-CG 4.22Å; H271-M274 HydrophobicContact CB-CB 4.09Å; H271-M274 WeakPolarHBondContact O-CB 3.39Å; H271-M274 PolarHBondContact O-N 3.12Å; K272-M274 PolarHBondContact O-N 3.37Å; K272-M274 VanDerWaalsContact O-N 3.15Å; M274-I276 VanDerWaalsContact C-N 3.31Å; M274-I276 PolarHBondContact O-N 3.41Å; M274-K277 PolarHBondContact O-N 3.46Å; M274-I278 HydrophobicContact CG-CD1 4.1Å; M274-I278 WeakPolarHBondContact O-CD1 3.26Å; M274-I278 VanDerWaalsContact O-CG1 3.24Å; M274-I278 WeakPolarHBondContact O-CG1 3.44Å; M274-I278 PolarHBondContact O-N 2.9Å
275	R	90.8	Very high	90.3	Very high	49 Å²	49	60.4 Å²	60.4	19%	0.185	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-40.3	176.5	-64	177.1	63.1	76.1	5.6	111.1	L264 V267 N269 H271 K272 I278 M279	L264-R275 HydrophobicContact CD1-CB 3.81Å; L264-R275 HydrophobicContact CD1-CG 4.04Å; L264-R275 PolarHBondContact O-NH1 3.46Å; V267-R275 HydrophobicContact CB-CG 4.42Å; V267-R275 HydrophobicContact CG1-CG 3.81Å; V267-R275 PolarHBondContact O-NH1 2.95Å; N269-R275 PolarHBondContact OD1-NE 3.16Å; N269-R275 PolarHBondContact OD1-NH1 3.34Å; H271-R275 PolarHBondContact O-N 2.81Å; H271-R275 VanDerWaalsContact O-N 3.14Å; K272-R275 WeakPolarHBondContact O-CA 3.37Å; K272-R275 WeakPolarHBondContact O-CB 3.43Å; K272-R275 PolarHBondContact O-N 3.13Å; R275-I278 PolarHBondContact O-N 3Å; R275-M279 WeakPolarHBondContact O-CG 3.44Å; R275-M279 PolarHBondContact O-N 2.91Å
276	I	90.7	Very high	90.5	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-48.9	176	-69	161.6	0	0	0	111	K272 M274 I278 M279 Q280 I302 E305 E306	K272-I276 WeakPolarHBondContact O-CG1 3.38Å; K272-I276 PolarHBondContact O-N 2.67Å; M274-I276 VanDerWaalsContact C-N 3.31Å; M274-I276 PolarHBondContact O-N 3.41Å; I276-I278 VanDerWaalsContact C-N 3.29Å; I276-I278 PolarHBondContact O-N 3.26Å; I276-M279 CarbonylContact O-C 3.45Å; I276-M279 PolarHBondContact O-N 3.07Å; I276-M279 VanDerWaalsContact O-N 3.08Å; I276-Q280 WeakPolarHBondContact O-CG 3.4Å; I276-Q280 PolarHBondContact O-N 3.36Å; I276-I302 HydrophobicContact CG2-CG2 3.76Å; I276-E305 HydrophobicContact CD1-CB 4.24Å; I276-E306 HydrophobicContact CD1-CB 3.7Å; I276-E306 VanDerWaalsContact CD1-OE2 3.25Å; I276-E306 WeakPolarHBondContact CD1-OE2 3.24Å
277	K	91.1	Very high	90.8	Very high	133 Å²	133	52.3 Å²	52.3	58%	0.578	27%	0.267	S	S	*	.	H	α-helix	trans	-58.3	-37.4	174.5	-72.6	176.8	-178.8	-175.2	0	113.1	L273 M274 Q280 N281	L273-K277 WeakPolarHBondContact O-CG 2.96Å; L273-K277 PolarHBondContact O-N 2.85Å; L273-K277 VanDerWaalsContact O-N 3.11Å; M274-K277 PolarHBondContact O-N 3.46Å; K277-Q280 PolarHBondContact O-N 3.38Å; K277-N281 PolarHBondContact O-N 3.45Å; K277-N281 VanDerWaalsContact O-N 3.15Å
278	I	92.6	Very high	91	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-42	174.9	-63.4	164.7	0	0	0	111	V241 F260 L264 V267 M274 R275 I276 Q280 N281 I282	V241-I278 HydrophobicContact CG1-CG1 4.29Å; V241-I278 HydrophobicContact CG2-CD1 3.6Å; V241-I278 HydrophobicContact CG2-CG1 3.61Å; V241-I278 HydrophobicContact CG2-CG2 4.46Å; F260-I278 HydrophobicContact CB-CG2 4.14Å; F260-I278 WeakPolarHBondContact O-CG2 3.48Å; L264-I278 HydrophobicContact CB-CG2 3.95Å; L264-I278 HydrophobicContact CD1-CB 4.33Å; L264-I278 HydrophobicContact CD1-CG2 4.28Å; V267-I278 HydrophobicContact CB-CD1 4.45Å; V267-I278 HydrophobicContact CG2-CD1 3.88Å; M274-I278 HydrophobicContact CG-CD1 4.1Å; M274-I278 WeakPolarHBondContact O-CD1 3.26Å; M274-I278 VanDerWaalsContact O-CG1 3.24Å; M274-I278 WeakPolarHBondContact O-CG1 3.44Å; M274-I278 PolarHBondContact O-N 2.9Å; R275-I278 PolarHBondContact O-N 3Å; I276-I278 VanDerWaalsContact C-N 3.29Å; I276-I278 PolarHBondContact O-N 3.26Å; I278-Q280 VanDerWaalsContact C-N 3.34Å; I278-N281 PolarHBondContact O-N 3.35Å; I278-I282 HydrophobicContact CG2-CD1 4.07Å; I278-I282 WeakPolarHBondContact O-CG1 3.48Å; I278-I282 PolarHBondContact O-N 2.98Å
279	M	92.8	Very high	91.2	Very high	32 Å²	32	57.4 Å²	57.4	16%	0.158	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-36.6	175.5	-71.8	-68.9	-87.8	0	0	112.2	L264 R275 I276 I282 G283 Y301 I302	L264-M279 HydrophobicContact CD1-CG 4.29Å; L264-M279 HydrophobicContact CD2-CG 4.22Å; L264-M279 HydrophobicContact CD2-SD 3.55Å; L264-M279 VanDerWaalsContact CD2-SD 3.55Å; R275-M279 WeakPolarHBondContact O-CG 3.44Å; R275-M279 PolarHBondContact O-N 2.91Å; I276-M279 CarbonylContact O-C 3.45Å; I276-M279 PolarHBondContact O-N 3.07Å; I276-M279 VanDerWaalsContact O-N 3.08Å; M279-I282 PolarHBondContact O-N 3.33Å; M279-I282 HydrophobicContact SD-CD1 4.1Å; M279-G283 PolarHBondContact O-N 3.25Å; M279-Y301 HydrophobicContact CE-CD1 3.51Å; M279-Y301 HydrophobicContact CE-CE1 4.15Å; M279-Y301 HydrophobicContact CE-CG 4.21Å; M279-Y301 HydrophobicContact CG-CD1 4.33Å; M279-Y301 HydrophobicContact CG-CE1 4.42Å; M279-I302 HydrophobicContact CB-CD1 3.89Å; M279-I302 HydrophobicContact CB-CG1 3.9Å
280	Q	92.7	Very high	91.5	Very high	39 Å²	39	53.4 Å²	53.4	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-47.4	172.2	-73.4	178.7	-15.3	0	0	110.8	I276 K277 I278 I282 G283 I284 I302 D308 T311	I276-Q280 WeakPolarHBondContact O-CG 3.4Å; I276-Q280 PolarHBondContact O-N 3.36Å; K277-Q280 PolarHBondContact O-N 3.38Å; I278-Q280 VanDerWaalsContact C-N 3.34Å; Q280-I282 VanDerWaalsContact C-N 3.32Å; Q280-I282 PolarHBondContact O-N 3.5Å; Q280-G283 PolarHBondContact O-N 3.17Å; Q280-I284 WeakPolarHBondContact O-CB 3.27Å; Q280-I284 VanDerWaalsContact O-CG1 3.3Å; Q280-I284 WeakPolarHBondContact O-CG1 3.2Å; Q280-I284 PolarHBondContact O-N 3.32Å; Q280-I302 HydrophobicContact CB-CD1 4.39Å; Q280-I302 HydrophobicContact CG-CD1 3.74Å; Q280-D308 PolarHBondContact NE2-OD2 3.17Å; Q280-T311 HydrophobicContact CG-CG2 3.87Å
281	N	93.6	Very high	91.8	Very high	47 Å²	47	52 Å²	52	25%	0.251	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-37.4	176.1	-73.5	2.4	0	0	0	112.6	N245 F260 K277 I278 S285	N245-N281 PolarHBondContact OD1-ND2 3.43Å; F260-N281 HydrophobicContact CD1-CB 4.35Å; F260-N281 HydrophobicContact CD2-CB 4.15Å; F260-N281 HydrophobicContact CE1-CB 4.1Å; F260-N281 HydrophobicContact CE2-CB 3.91Å; F260-N281 HydrophobicContact CG-CB 4.39Å; F260-N281 HydrophobicContact CZ-CB 3.89Å; K277-N281 PolarHBondContact O-N 3.45Å; K277-N281 VanDerWaalsContact O-N 3.15Å; I278-N281 PolarHBondContact O-N 3.35Å; N281-S285 VanDerWaalsContact O-CB 3.32Å; N281-S285 WeakPolarHBondContact O-CB 3.38Å; N281-S285 PolarHBondContact O-N 3.18Å; N281-S285 PolarHBondContact O-OG 2.89Å
282	I	94.2	Very high	92.1	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-50.5	174.3	-70.4	167.8	0	0	0	110.6	F260 R261 L264 I278 M279 Q280 I284 S285 F286	F260-I282 HydrophobicContact CB-CD1 3.9Å; F260-I282 HydrophobicContact CB-CG1 3.45Å; F260-I282 VanDerWaalsContact CB-CG1 3.45Å; F260-I282 HydrophobicContact CD2-CG1 4.27Å; F260-I282 HydrophobicContact CG-CG1 4.23Å; R261-I282 HydrophobicContact CG-CD1 4.17Å; L264-I282 HydrophobicContact CD2-CD1 4.41Å; I278-I282 HydrophobicContact CG2-CD1 4.07Å; I278-I282 WeakPolarHBondContact O-CG1 3.48Å; I278-I282 PolarHBondContact O-N 2.98Å; M279-I282 PolarHBondContact O-N 3.33Å; M279-I282 HydrophobicContact SD-CD1 4.1Å; Q280-I282 VanDerWaalsContact C-N 3.32Å; Q280-I282 PolarHBondContact O-N 3.5Å; I282-I284 PolarHBondContact O-N 2.92Å; I282-S285 WeakPolarHBondContact O-CB 3.43Å; I282-S285 PolarHBondContact O-N 3.27Å; I282-F286 HydrophobicContact CG2-CD2 3.68Å; I282-F286 HydrophobicContact CG2-CE2 3.34Å; I282-F286 HydrophobicContact CG2-CZ 4.42Å; I282-F286 VanDerWaalsContact O-CD2 3.27Å; I282-F286 WeakPolarHBondContact O-CD2 3.34Å; I282-F286 PolarHBondContact O-N 3.37Å
283	G	93.2	Very high	92.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-48.1	178.9	0	0	0	0	0	112.5	M279 Q280 S285 F286 V287	M279-G283 PolarHBondContact O-N 3.25Å; Q280-G283 PolarHBondContact O-N 3.17Å; G283-S285 VanDerWaalsContact C-N 3.31Å; G283-S285 PolarHBondContact O-N 3.14Å; G283-F286 PolarHBondContact O-N 2.88Å; G283-F286 VanDerWaalsContact O-N 3.15Å; G283-V287 WeakPolarHBondContact O-CG2 3.19Å; G283-V287 PolarHBondContact O-N 2.89Å
284	I	93.6	Very high	92.6	Very high	44 Å²	44	47.1 Å²	47.1	23%	0.226	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-39.8	176.2	-66.4	166.8	0	0	0	111.2	Y248 Q280 I282 F286 V287 K288 F299	Y248-I284 HydrophobicContact CE2-CG2 4.1Å; Y248-I284 WeakPolarHBondContact OH-CG2 3.35Å; Q280-I284 WeakPolarHBondContact O-CB 3.27Å; Q280-I284 VanDerWaalsContact O-CG1 3.3Å; Q280-I284 WeakPolarHBondContact O-CG1 3.2Å; Q280-I284 PolarHBondContact O-N 3.32Å; I282-I284 PolarHBondContact O-N 2.92Å; I284-F286 VanDerWaalsContact C-N 3.33Å; I284-F286 PolarHBondContact O-N 3.4Å; I284-V287 PolarHBondContact O-N 3.19Å; I284-K288 WeakPolarHBondContact O-CG 3.44Å; I284-K288 PolarHBondContact O-N 2.82Å; I284-F299 HydrophobicContact CG1-CE1 4.5Å; I284-F299 HydrophobicContact CG1-CZ 4.3Å
285	S	94.2	Very high	92.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-36.6	176.2	-59.7	0	0	0	0	112.5	Y248 I257 N281 I282 G283 K288 L289	Y248-S285 WeakPolarHBondContact CD2-OG 3.41Å; I257-S285 VanDerWaalsContact CG1-CB 3.42Å; N281-S285 VanDerWaalsContact O-CB 3.32Å; N281-S285 WeakPolarHBondContact O-CB 3.38Å; N281-S285 PolarHBondContact O-N 3.18Å; N281-S285 PolarHBondContact O-OG 2.89Å; I282-S285 WeakPolarHBondContact O-CB 3.43Å; I282-S285 PolarHBondContact O-N 3.27Å; G283-S285 VanDerWaalsContact C-N 3.31Å; G283-S285 PolarHBondContact O-N 3.14Å; S285-K288 PolarHBondContact O-N 3.12Å; S285-L289 PolarHBondContact O-N 2.87Å; S285-L289 VanDerWaalsContact O-N 3.15Å
286	F	95.2	Very high	93	Very high	7 Å²	7	42.6 Å²	42.6	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-38.3	173.8	-78	-55.6	0	0	0	113	I257 R261 I282 G283 I284 K288 L289 G290 Q291 E294 A295	I257-F286 HydrophobicContact CD1-CD1 3.73Å; I257-F286 HydrophobicContact CD1-CE1 3.65Å; I257-F286 HydrophobicContact CD1-CG 4.2Å; I257-F286 HydrophobicContact CD1-CZ 4.05Å; I257-F286 HydrophobicContact CG1-CZ 4.49Å; I257-F286 HydrophobicContact CG2-CE1 4.31Å; I257-F286 HydrophobicContact CG2-CE2 4.27Å; I257-F286 HydrophobicContact CG2-CZ 3.74Å; R261-F286 VanDerWaalsContact NH2-CZ 3.34Å; I282-F286 HydrophobicContact CG2-CD2 3.68Å; I282-F286 HydrophobicContact CG2-CE2 3.34Å; I282-F286 HydrophobicContact CG2-CZ 4.42Å; I282-F286 VanDerWaalsContact O-CD2 3.27Å; I282-F286 WeakPolarHBondContact O-CD2 3.34Å; I282-F286 PolarHBondContact O-N 3.37Å; G283-F286 PolarHBondContact O-N 2.88Å; G283-F286 VanDerWaalsContact O-N 3.15Å; I284-F286 VanDerWaalsContact C-N 3.33Å; I284-F286 PolarHBondContact O-N 3.4Å; F286-K288 VanDerWaalsContact C-N 3.31Å; F286-K288 PolarHBondContact O-N 3.09Å; F286-L289 CarbonylContact O-C 3.52Å; F286-L289 PolarHBondContact O-N 2.9Å; F286-L289 VanDerWaalsContact O-N 3.13Å; F286-G290 PolarHBondContact O-N 2.76Å; F286-G290 VanDerWaalsContact O-N 3.13Å; F286-Q291 HydrophobicContact CB-CB 4.44Å; F286-Q291 HydrophobicContact CD1-CB 3.89Å; F286-Q291 PolarHBondContact O-N 3.13Å; F286-E294 HydrophobicContact CD1-CB 3.91Å; F286-E294 HydrophobicContact CD2-CB 3.81Å; F286-E294 HydrophobicContact CE1-CB 3.96Å; F286-E294 HydrophobicContact CE1-CG 4.42Å; F286-E294 WeakPolarHBondContact CE1-OE2 3.42Å; F286-E294 HydrophobicContact CE2-CB 3.86Å; F286-E294 HydrophobicContact CG-CB 3.85Å; F286-E294 HydrophobicContact CZ-CB 3.96Å; F286-E294 HydrophobicContact CZ-CG 4.44Å; F286-E294 WeakPolarHBondContact CZ-OE2 3.31Å; F286-A295 HydrophobicContact CB-CB 3.77Å
287	V	93.6	Very high	93.2	Very high	43 Å²	43	44.6 Å²	44.6	26%	0.261	24%	0.24	S	C	.	.	H	α-helix	trans	-58.6	-44.4	171.6	175.1	0	0	0	0	110.5	G283 I284 L289 G290 F292 A295 F299	G283-V287 WeakPolarHBondContact O-CG2 3.19Å; G283-V287 PolarHBondContact O-N 2.89Å; I284-V287 PolarHBondContact O-N 3.19Å; V287-L289 PolarHBondContact O-N 3.05Å; V287-G290 PolarHBondContact O-N 2.71Å; V287-F292 HydrophobicContact CG1-CE1 4.36Å; V287-A295 HydrophobicContact CG2-CB 3.75Å; V287-F299 HydrophobicContact CG2-CE2 3.87Å; V287-F299 HydrophobicContact CG2-CZ 4.27Å
288	K	92.3	Very high	93.3	Very high	118 Å²	118	38.6 Å²	38.6	51%	0.513	21%	0.214	S	C	.	.	H	α-helix	trans	-67.5	-19.4	176.8	-64.7	-62.6	-176.1	-176.2	0	114.4	Y248 Y253 I284 S285 F286	Y248-K288 HydrophobicContact CE2-CG 4.18Å; Y248-K288 WeakPolarHBondContact OH-CE 3.47Å; Y253-K288 HydrophobicContact CD1-CB 3.97Å; Y253-K288 HydrophobicContact CD2-CB 3.93Å; Y253-K288 HydrophobicContact CE1-CB 3.79Å; Y253-K288 HydrophobicContact CE1-CG 4.04Å; Y253-K288 HydrophobicContact CE2-CB 3.74Å; Y253-K288 HydrophobicContact CG-CB 4.04Å; I284-K288 WeakPolarHBondContact O-CG 3.44Å; I284-K288 PolarHBondContact O-N 2.82Å; S285-K288 PolarHBondContact O-N 3.12Å; F286-K288 VanDerWaalsContact C-N 3.31Å; F286-K288 PolarHBondContact O-N 3.09Å
289	L	92.3	Very high	93.4	Very high	71 Å²	71	38.6 Å²	38.6	37%	0.372	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6	170.5	-74.6	175.6	0	0	0	114	Y253 I257 S285 F286 V287 Q291	Y253-L289 HydrophobicContact CD2-CD2 4.08Å; Y253-L289 HydrophobicContact CD2-CG 4.35Å; Y253-L289 HydrophobicContact CG-CD2 4.49Å; Y253-L289 HydrophobicContact CG-CG 4.43Å; I257-L289 HydrophobicContact CD1-CD1 3.49Å; I257-L289 VanDerWaalsContact CD1-CD1 3.49Å; S285-L289 PolarHBondContact O-N 2.87Å; S285-L289 VanDerWaalsContact O-N 3.15Å; F286-L289 CarbonylContact O-C 3.52Å; F286-L289 PolarHBondContact O-N 2.9Å; F286-L289 VanDerWaalsContact O-N 3.13Å; V287-L289 PolarHBondContact O-N 3.05Å; L289-Q291 HydrophobicContact CB-CG 4.2Å; L289-Q291 PolarHBondContact O-N 3.49Å
290	G	91.2	Very high	93.4	Very high	39 Å²	39	40.1 Å²	40.1	40%	0.402	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	12.1	-171.9	0	0	0	0	0	114.5	F286 V287 F292	F286-G290 PolarHBondContact O-N 2.76Å; F286-G290 VanDerWaalsContact O-N 3.13Å; V287-G290 PolarHBondContact O-N 2.71Å; G290-F292 VanDerWaalsContact C-N 3.29Å; G290-F292 WeakPolarHBondContact O-CD2 3.46Å; G290-F292 VanDerWaalsContact O-CE2 3.28Å; G290-F292 WeakPolarHBondContact O-CE2 3.45Å; G290-F292 PolarHBondContact O-N 3.02Å; G290-F292 VanDerWaalsContact O-N 3.11Å
291	Q	93.4	Very high	93.3	Very high	88 Å²	88	42 Å²	42	41%	0.411	23%	0.227	S	C	.	.			trans	-89.3	61.8	-178.7	-70.6	-176.3	-45.9	0	0	111.2	F286 L289 S293 E294 A295	F286-Q291 HydrophobicContact CB-CB 4.44Å; F286-Q291 HydrophobicContact CD1-CB 3.89Å; F286-Q291 PolarHBondContact O-N 3.13Å; L289-Q291 HydrophobicContact CB-CG 4.2Å; L289-Q291 PolarHBondContact O-N 3.49Å; Q291-S293 VanDerWaalsContact C-N 3.26Å; Q291-S293 PolarHBondContact O-N 3.24Å; Q291-S293 VanDerWaalsContact O-N 3.15Å; Q291-E294 PolarHBondContact O-N 3.15Å; Q291-E294 VanDerWaalsContact O-N 3.14Å; Q291-A295 PolarHBondContact O-N 3.13Å
292	F	92.8	Very high	93.3	Very high	52 Å²	52	39.8 Å²	39.8	23%	0.228	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-29.7	-170.3	-55.4	-71	0	0	0	114.6	V287 G290 A295 I296 I321 K322	V287-F292 HydrophobicContact CG1-CE1 4.36Å; G290-F292 VanDerWaalsContact C-N 3.29Å; G290-F292 WeakPolarHBondContact O-CD2 3.46Å; G290-F292 VanDerWaalsContact O-CE2 3.28Å; G290-F292 WeakPolarHBondContact O-CE2 3.45Å; G290-F292 PolarHBondContact O-N 3.02Å; G290-F292 VanDerWaalsContact O-N 3.11Å; F292-A295 PolarHBondContact O-N 3.11Å; F292-I296 WeakPolarHBondContact O-CB 3.41Å; F292-I296 WeakPolarHBondContact O-CD1 3.36Å; F292-I296 WeakPolarHBondContact O-CG1 3.26Å; F292-I296 PolarHBondContact O-N 2.8Å; F292-I321 HydrophobicContact CD1-CD1 4.02Å; F292-I321 HydrophobicContact CD1-CG2 4.35Å; F292-I321 HydrophobicContact CD2-CG2 3.75Å; F292-I321 HydrophobicContact CE1-CD1 3.48Å; F292-I321 VanDerWaalsContact CE1-CD1 3.48Å; F292-I321 HydrophobicContact CE1-CG2 4.25Å; F292-I321 HydrophobicContact CE2-CG2 3.63Å; F292-I321 HydrophobicContact CG-CG2 4.12Å; F292-I321 HydrophobicContact CZ-CD1 3.84Å; F292-I321 HydrophobicContact CZ-CG2 3.89Å; F292-K322 HydrophobicContact CB-CD 4.49Å; F292-K322 HydrophobicContact CB-CG 4.41Å
293	S	93.2	Very high	93.1	Very high	73 Å²	73	40.7 Å²	40.7	51%	0.51	22%	0.22	S	C	.	.	H	α-helix	trans	-66.2	-38.6	177.5	-61	0	0	0	0	113.1	Q291 A297 K322	Q291-S293 VanDerWaalsContact C-N 3.26Å; Q291-S293 PolarHBondContact O-N 3.24Å; Q291-S293 VanDerWaalsContact O-N 3.15Å; S293-A297 PolarHBondContact O-N 3.08Å; S293-K322 PolarHBondContact OG-NZ 3.29Å
294	E	93.1	Very high	93	Very high	79 Å²	79	48.2 Å²	48.2	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-75.5	-34.2	175.1	-72.2	-171.2	-117.7	0	0	111.3	R261 F286 Q291 A297 A298	R261-E294 IonicContact CZ-OE2 3.22Å; R261-E294 IonicContact NH2-OE2 2.7Å; R261-E294 PolarHBondContact NH2-OE2 2.77Å; F286-E294 HydrophobicContact CD1-CB 3.91Å; F286-E294 HydrophobicContact CD2-CB 3.81Å; F286-E294 HydrophobicContact CE1-CB 3.96Å; F286-E294 HydrophobicContact CE1-CG 4.42Å; F286-E294 WeakPolarHBondContact CE1-OE2 3.42Å; F286-E294 HydrophobicContact CE2-CB 3.86Å; F286-E294 HydrophobicContact CG-CB 3.85Å; F286-E294 HydrophobicContact CZ-CB 3.96Å; F286-E294 HydrophobicContact CZ-CG 4.44Å; F286-E294 WeakPolarHBondContact CZ-OE2 3.31Å; Q291-E294 PolarHBondContact O-N 3.15Å; Q291-E294 VanDerWaalsContact O-N 3.14Å; E294-A297 PolarHBondContact O-N 2.98Å; E294-A298 PolarHBondContact O-N 2.93Å; E294-A298 VanDerWaalsContact O-N 3.14Å
295	A	94.2	Very high	92.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-45.4	172.7	0	0	0	0	0	112.3	F286 V287 Q291 F292 A298 F299	F286-A295 HydrophobicContact CB-CB 3.77Å; V287-A295 HydrophobicContact CG2-CB 3.75Å; Q291-A295 PolarHBondContact O-N 3.13Å; F292-A295 PolarHBondContact O-N 3.11Å; A295-A298 PolarHBondContact O-N 2.72Å; A295-F299 HydrophobicContact CB-CD2 4.41Å; A295-F299 HydrophobicContact CB-CE2 4.07Å; A295-F299 WeakPolarHBondContact O-CD2 3.32Å; A295-F299 WeakPolarHBondContact O-CG 3.47Å; A295-F299 PolarHBondContact O-N 3.36Å
296	I	94	Very high	92.3	Very high	11 Å²	11	53.6 Å²	53.6	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-50.1	177.3	-74.6	163.5	0	0	0	110.6	F292 A298 F299 E300 L315 C318 Y319 K322	F292-I296 WeakPolarHBondContact O-CB 3.41Å; F292-I296 WeakPolarHBondContact O-CD1 3.36Å; F292-I296 WeakPolarHBondContact O-CG1 3.26Å; F292-I296 PolarHBondContact O-N 2.8Å; I296-A298 VanDerWaalsContact C-N 3.25Å; I296-A298 PolarHBondContact O-N 3.17Å; I296-F299 PolarHBondContact O-N 3.29Å; I296-F299 VanDerWaalsContact O-N 3.11Å; I296-E300 HydrophobicContact CG2-CG 3.95Å; I296-E300 VanDerWaalsContact CG2-OE1 3.28Å; I296-E300 WeakPolarHBondContact CG2-OE1 3.42Å; I296-E300 WeakPolarHBondContact O-CB 3.4Å; I296-E300 WeakPolarHBondContact O-CG 3.22Å; I296-E300 PolarHBondContact O-N 2.96Å; I296-L315 HydrophobicContact CB-CD1 4.47Å; I296-L315 HydrophobicContact CG1-CD1 4.37Å; I296-L315 HydrophobicContact CG2-CD1 4.11Å; I296-C318 HydrophobicContact CD1-CB 3.93Å; I296-C318 HydrophobicContact CG1-CB 3.47Å; I296-C318 VanDerWaalsContact CG1-CB 3.47Å; I296-Y319 HydrophobicContact CD1-CD1 3.86Å; I296-Y319 HydrophobicContact CD1-CE1 4.01Å; I296-Y319 HydrophobicContact CG1-CD1 4.35Å; I296-Y319 HydrophobicContact CG1-CE1 4.23Å; I296-Y319 HydrophobicContact CG2-CE1 3.67Å; I296-K322 HydrophobicContact CD1-CD 3.4Å; I296-K322 VanDerWaalsContact CD1-CD 3.4Å; I296-K322 HydrophobicContact CD1-CG 4.22Å
297	A	94	Very high	91.9	Very high	54 Å²	54	56.6 Å²	56.6	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-36.1	179	0	0	0	0	0	112.6	S293 E294 Y301	S293-A297 PolarHBondContact O-N 3.08Å; E294-A297 PolarHBondContact O-N 2.98Å; A297-Y301 WeakPolarHBondContact O-CB 3.48Å; A297-Y301 PolarHBondContact O-N 3.23Å
298	A	93	Very high	91.7	Very high	6 Å²	6	56.8 Å²	56.8	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-43.6	174.4	0	0	0	0	0	112.5	E294 A295 I296 I302	E294-A298 PolarHBondContact O-N 2.93Å; E294-A298 VanDerWaalsContact O-N 3.14Å; A295-A298 PolarHBondContact O-N 2.72Å; I296-A298 VanDerWaalsContact C-N 3.25Å; I296-A298 PolarHBondContact O-N 3.17Å; A298-I302 VanDerWaalsContact O-CD1 3.31Å; A298-I302 WeakPolarHBondContact O-CD1 3.22Å; A298-I302 VanDerWaalsContact O-CG1 3.27Å; A298-I302 WeakPolarHBondContact O-CG1 3.45Å; A298-I302 PolarHBondContact O-N 3.24Å; A298-I302 VanDerWaalsContact O-N 3.14Å
299	F	94.3	Very high	91.6	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-73.9	-35.9	179.1	-62.4	-46.6	0	0	0	113.3	I284 V287 A295 I296 Y301 I302 M303 N314 L315	I284-F299 HydrophobicContact CG1-CE1 4.5Å; I284-F299 HydrophobicContact CG1-CZ 4.3Å; V287-F299 HydrophobicContact CG2-CE2 3.87Å; V287-F299 HydrophobicContact CG2-CZ 4.27Å; A295-F299 HydrophobicContact CB-CD2 4.41Å; A295-F299 HydrophobicContact CB-CE2 4.07Å; A295-F299 WeakPolarHBondContact O-CD2 3.32Å; A295-F299 WeakPolarHBondContact O-CG 3.47Å; A295-F299 PolarHBondContact O-N 3.36Å; I296-F299 PolarHBondContact O-N 3.29Å; I296-F299 VanDerWaalsContact O-N 3.11Å; F299-Y301 VanDerWaalsContact C-N 3.34Å; F299-I302 HydrophobicContact CD1-CD1 4.14Å; F299-I302 PolarHBondContact O-N 3.03Å; F299-M303 WeakPolarHBondContact O-CB 3.49Å; F299-M303 WeakPolarHBondContact O-CG 3.4Å; F299-M303 PolarHBondContact O-N 3Å; F299-N314 HydrophobicContact CD2-CB 4.24Å; F299-N314 HydrophobicContact CE1-CB 4.16Å; F299-N314 HydrophobicContact CE2-CB 3.84Å; F299-N314 HydrophobicContact CZ-CB 3.8Å; F299-L315 HydrophobicContact CB-CB 4.04Å; F299-L315 HydrophobicContact CB-CD1 4.03Å
300	E	92.8	Very high	91.5	Very high	64 Å²	64	52.9 Å²	52.9	30%	0.299	28%	0.279	S	S	.	.	H	α-helix	trans	-57.9	-45.6	170.4	-76.1	174.5	170.2	0	0	110.7	I296 M303 Q304 L315 Y319	I296-E300 HydrophobicContact CG2-CG 3.95Å; I296-E300 VanDerWaalsContact CG2-OE1 3.28Å; I296-E300 WeakPolarHBondContact CG2-OE1 3.42Å; I296-E300 WeakPolarHBondContact O-CB 3.4Å; I296-E300 WeakPolarHBondContact O-CG 3.22Å; I296-E300 PolarHBondContact O-N 2.96Å; E300-M303 PolarHBondContact O-N 2.86Å; E300-Q304 VanDerWaalsContact O-CG 3.32Å; E300-Q304 WeakPolarHBondContact O-CG 3.47Å; E300-Q304 PolarHBondContact O-N 2.73Å; E300-L315 HydrophobicContact CG-CD1 4.04Å; E300-Y319 PolarHBondContact OE1-OH 3.14Å
301	Y	92.2	Very high	91.6	Very high	79 Å²	79	51.1 Å²	51.1	31%	0.31	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-43	176.1	176.4	-106.6	0	0	0	112.4	M279 A297 F299 Q304 E305	M279-Y301 HydrophobicContact CE-CD1 3.51Å; M279-Y301 HydrophobicContact CE-CE1 4.15Å; M279-Y301 HydrophobicContact CE-CG 4.21Å; M279-Y301 HydrophobicContact CG-CD1 4.33Å; M279-Y301 HydrophobicContact CG-CE1 4.42Å; A297-Y301 WeakPolarHBondContact O-CB 3.48Å; A297-Y301 PolarHBondContact O-N 3.23Å; F299-Y301 VanDerWaalsContact C-N 3.34Å; Y301-Q304 PolarHBondContact O-N 2.97Å; Y301-E305 HydrophobicContact CE1-CG 4.33Å; Y301-E305 HydrophobicContact CE2-CG 3.83Å; Y301-E305 PolarHBondContact O-N 3.39Å; Y301-E305 PolarHBondContact OH-OE1 3.39Å
302	I	92.2	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-47.7	178.3	-64	154.6	0	0	0	110.8	I276 M279 Q280 A298 F299 Q304 E305 E306 T311	I276-I302 HydrophobicContact CG2-CG2 3.76Å; M279-I302 HydrophobicContact CB-CD1 3.89Å; M279-I302 HydrophobicContact CB-CG1 3.9Å; Q280-I302 HydrophobicContact CB-CD1 4.39Å; Q280-I302 HydrophobicContact CG-CD1 3.74Å; A298-I302 VanDerWaalsContact O-CD1 3.31Å; A298-I302 WeakPolarHBondContact O-CD1 3.22Å; A298-I302 VanDerWaalsContact O-CG1 3.27Å; A298-I302 WeakPolarHBondContact O-CG1 3.45Å; A298-I302 PolarHBondContact O-N 3.24Å; A298-I302 VanDerWaalsContact O-N 3.14Å; F299-I302 HydrophobicContact CD1-CD1 4.14Å; F299-I302 PolarHBondContact O-N 3.03Å; I302-Q304 PolarHBondContact O-N 3.35Å; I302-Q304 VanDerWaalsContact O-N 3.1Å; I302-E305 PolarHBondContact O-N 3.13Å; I302-E306 CarbonylContact O-C 3.59Å; I302-E306 PolarHBondContact O-N 3.21Å; I302-E306 VanDerWaalsContact O-O 3.06Å; I302-T311 HydrophobicContact CD1-CG2 4.45Å; I302-T311 HydrophobicContact CG2-CG2 3.8Å
303	M	90.7	Very high	91.5	Very high	25 Å²	25	45.9 Å²	45.9	12%	0.123	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-19.5	178.6	-75.2	-65.9	-64	0	0	114.1	F299 E300 P307 T311 G312 L315 Q334 V338	F299-M303 WeakPolarHBondContact O-CB 3.49Å; F299-M303 WeakPolarHBondContact O-CG 3.4Å; F299-M303 PolarHBondContact O-N 3Å; E300-M303 PolarHBondContact O-N 2.86Å; M303-P307 HydrophobicContact CE-CB 4.33Å; M303-T311 PolarHBondContact SD-OG1 3.48Å; M303-T311 VanDerWaalsContact SD-OG1 3.38Å; M303-G312 PolarHBondContact SD-N 2.93Å; M303-L315 HydrophobicContact CG-CD2 4.17Å; M303-Q334 HydrophobicContact CE-CB 3.75Å; M303-V338 HydrophobicContact CE-CG2 4.35Å
304	Q	90.4	Very high	91.5	Very high	158 Å²	158	44.3 Å²	44.3	74%	0.738	22%	0.223	S	C	*	.	H	α-helix	trans	-86	-29.4	174.9	-72.1	170.8	17.6	0	0	113.6	E300 Y301 I302	E300-Q304 VanDerWaalsContact O-CG 3.32Å; E300-Q304 WeakPolarHBondContact O-CG 3.47Å; E300-Q304 PolarHBondContact O-N 2.73Å; Y301-Q304 PolarHBondContact O-N 2.97Å; I302-Q304 PolarHBondContact O-N 3.35Å; I302-Q304 VanDerWaalsContact O-N 3.1Å
305	E	86.9	Confident	91.5	Very high	76 Å²	76	40.9 Å²	40.9	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-93.6	-42	-178.9	-69.6	-96.7	-166	0	0	112.6	K272 I276 Y301 I302	K272-E305 IonicContact NZ-OE2 3.78Å; K272-E305 PolarHBondContact NZ-OE2 2.96Å; I276-E305 HydrophobicContact CD1-CB 4.24Å; Y301-E305 HydrophobicContact CE1-CG 4.33Å; Y301-E305 HydrophobicContact CE2-CG 3.83Å; Y301-E305 PolarHBondContact O-N 3.39Å; Y301-E305 PolarHBondContact OH-OE1 3.39Å; I302-E305 PolarHBondContact O-N 3.13Å
306	E	86.8	Confident	91.5	Very high	81 Å²	81	40.9 Å²	40.9	38%	0.379	21%	0.207	S	C	.	.	S	Bend	trans	-148.7	98.8	179.2	-171	177.4	-172.6	0	0	108.5	L273 I276 I302 D308	L273-E306 WeakPolarHBondContact CD2-OE1 3.23Å; L273-E306 VanDerWaalsContact CD2-OE2 3.25Å; L273-E306 WeakPolarHBondContact CD2-OE2 3.38Å; I276-E306 HydrophobicContact CD1-CB 3.7Å; I276-E306 VanDerWaalsContact CD1-OE2 3.25Å; I276-E306 WeakPolarHBondContact CD1-OE2 3.24Å; I302-E306 CarbonylContact O-C 3.59Å; I302-E306 PolarHBondContact O-N 3.21Å; I302-E306 VanDerWaalsContact O-O 3.06Å; E306-D308 PolarHBondContact O-N 2.97Å
307	P	87.5	Confident	91.4	Very high	71 Å²	71	42.2 Å²	42.2	46%	0.461	22%	0.216	S	C	.	.			trans	-64.9	125.6	178.3	26.2	-33.1	0	0	0	110.3	M303 V338	M303-P307 HydrophobicContact CE-CB 4.33Å; P307-V338 HydrophobicContact CB-CG2 4.13Å; P307-V338 WeakPolarHBondContact O-CG1 3.38Å
308	D	88.5	Confident	91.3	Very high	46 Å²	46	39.7 Å²	39.7	25%	0.246	20%	0.195	C	C	.	.			trans	-134.1	138.5	-177.7	164.8	27.8	0	0	0	109.2	Q280 E306 K310 T311 G312	Q280-D308 PolarHBondContact NE2-OD2 3.17Å; E306-D308 PolarHBondContact O-N 2.97Å; D308-K310 VanDerWaalsContact C-N 3.26Å; D308-K310 PolarHBondContact O-N 3.13Å; D308-K310 PolarHBondContact OD1-N 3.47Å; D308-K310 VanDerWaalsContact OD1-N 3.17Å; D308-T311 HydrophobicContact CB-CG2 4.34Å; D308-T311 WeakPolarHBondContact CB-OG1 3.49Å; D308-T311 PolarHBondContact O-N 3.33Å; D308-T311 PolarHBondContact O-OG1 2.72Å; D308-G312 PolarHBondContact O-N 2.9Å
309	T	89.9	Confident	91.4	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-34.4	-175.6	59.3	0	0	0	0	111.6	F313 L335 V338 L340 A380	T309-F313 WeakPolarHBondContact O-CB 3.44Å; T309-F313 PolarHBondContact O-N 3.32Å; T309-L335 HydrophobicContact CG2-CD1 4.3Å; T309-L335 WeakPolarHBondContact O-CD1 3.13Å; T309-V338 HydrophobicContact CG2-CB 3.93Å; T309-V338 HydrophobicContact CG2-CG1 3.74Å; T309-V338 HydrophobicContact CG2-CG2 4.39Å; T309-L340 HydrophobicContact CG2-CD2 4.18Å; T309-A380 HydrophobicContact CG2-CB 3.82Å
310	K	91	Very high	91.3	Very high	99 Å²	99	43.3 Å²	43.3	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-68.6	-38.1	176.3	-175.3	176.9	-177.4	174	0	112.2	D308 N314 F383	D308-K310 VanDerWaalsContact C-N 3.26Å; D308-K310 PolarHBondContact O-N 3.13Å; D308-K310 PolarHBondContact OD1-N 3.47Å; D308-K310 VanDerWaalsContact OD1-N 3.17Å; K310-N314 PolarHBondContact O-N 3.31Å; K310-N314 VanDerWaalsContact O-N 3.14Å; K310-N314 PolarHBondContact O-ND2 2.87Å; K310-F383 HydrophobicContact CB-CE2 3.99Å; K310-F383 HydrophobicContact CB-CZ 4.23Å; K310-F383 HydrophobicContact CG-CE2 4.41Å; K310-F383 HydrophobicContact CG-CZ 4.16Å
311	T	91.6	Very high	91.2	Very high	2 Å²	2	44 Å²	44	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-76.6	-38.3	178.8	55.7	0	0	0	0	111.4	Q280 I302 M303 D308 F313 N314 L315	Q280-T311 HydrophobicContact CG-CG2 3.87Å; I302-T311 HydrophobicContact CD1-CG2 4.45Å; I302-T311 HydrophobicContact CG2-CG2 3.8Å; M303-T311 PolarHBondContact SD-OG1 3.48Å; M303-T311 VanDerWaalsContact SD-OG1 3.38Å; D308-T311 HydrophobicContact CB-CG2 4.34Å; D308-T311 WeakPolarHBondContact CB-OG1 3.49Å; D308-T311 PolarHBondContact O-N 3.33Å; D308-T311 PolarHBondContact O-OG1 2.72Å; T311-F313 PolarHBondContact O-N 2.95Å; T311-N314 PolarHBondContact O-N 3.08Å; T311-L315 WeakPolarHBondContact O-CB 3.13Å; T311-L315 PolarHBondContact O-N 2.96Å
312	G	92	Very high	91.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-45.7	170.7	0	0	0	0	0	112.6	M303 D308 L315 I316	M303-G312 PolarHBondContact SD-N 2.93Å; D308-G312 PolarHBondContact O-N 2.9Å; G312-L315 PolarHBondContact O-N 3.45Å; G312-I316 WeakPolarHBondContact O-CG1 3.21Å; G312-I316 PolarHBondContact O-N 2.98Å
313	F	93.3	Very high	90.9	Very high	30 Å²	30	55.3 Å²	55.3	13%	0.132	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-46.6	174	-180	-100.9	0	0	0	112.8	T309 T311 L315 I316 V317 F383 M386 A387 I390	T309-F313 WeakPolarHBondContact O-CB 3.44Å; T309-F313 PolarHBondContact O-N 3.32Å; T311-F313 PolarHBondContact O-N 2.95Å; F313-L315 VanDerWaalsContact C-N 3.31Å; F313-L315 PolarHBondContact O-N 3.32Å; F313-I316 WeakPolarHBondContact O-CB 3.48Å; F313-I316 PolarHBondContact O-N 2.98Å; F313-V317 HydrophobicContact CD1-CG2 4.37Å; F313-V317 HydrophobicContact CE1-CG2 3.92Å; F313-V317 HydrophobicContact CE2-CG2 4.34Å; F313-V317 HydrophobicContact CZ-CG2 3.9Å; F313-V317 WeakPolarHBondContact O-CG2 3.45Å; F313-V317 PolarHBondContact O-N 2.99Å; F313-F383 HydrophobicContact CB-CB 4.21Å; F313-F383 HydrophobicContact CB-CD1 3.92Å; F313-F383 HydrophobicContact CB-CG 4.2Å; F313-F383 AromaticContact CD1-CD1 3.84Å; F313-F383 HydrophobicContact CD1-CD1 3.84Å; F313-F383 HydrophobicContact CD1-CE1 4.1Å; F313-F383 HydrophobicContact CD2-CB 4.44Å; F313-F383 HydrophobicContact CD2-CD1 4.15Å; F313-F383 WeakPolarHBondContact CD2-O 3.41Å; F313-F383 HydrophobicContact CE1-CD1 4.42Å; F313-F383 HydrophobicContact CG-CB 4.44Å; F313-F383 AromaticContact CG-CD1 3.68Å; F313-F383 HydrophobicContact CG-CD1 3.68Å; F313-F383 HydrophobicContact CG-CE1 4.37Å; F313-F383 HydrophobicContact CG-CG 4.37Å; F313-M386 HydrophobicContact CE2-CB 3.64Å; F313-M386 HydrophobicContact CZ-CB 4.15Å; F313-M386 HydrophobicContact CZ-CE 4.4Å; F313-A387 HydrophobicContact CD2-CB 4.12Å; F313-I390 HydrophobicContact CE2-CD1 4.03Å; F313-I390 HydrophobicContact CZ-CD1 4.04Å
314	N	93.1	Very high	90.9	Very high	39 Å²	39	56.7 Å²	56.7	21%	0.209	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-36.2	177.8	-76.6	-56.4	0	0	0	112.7	F299 K310 T311 V317 C318	F299-N314 HydrophobicContact CD2-CB 4.24Å; F299-N314 HydrophobicContact CE1-CB 4.16Å; F299-N314 HydrophobicContact CE2-CB 3.84Å; F299-N314 HydrophobicContact CZ-CB 3.8Å; K310-N314 PolarHBondContact O-N 3.31Å; K310-N314 VanDerWaalsContact O-N 3.14Å; K310-N314 PolarHBondContact O-ND2 2.87Å; T311-N314 PolarHBondContact O-N 3.08Å; N314-V317 PolarHBondContact O-N 2.81Å; N314-C318 PolarHBondContact O-N 3.3Å; N314-C318 VanDerWaalsContact O-N 3.07Å; N314-C318 PolarHBondContact O-SG 3.34Å
315	L	93.4	Very high	90.9	Very high	7 Å²	7	55.4 Å²	55.4	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-45.3	175	-179.8	61.3	0	0	0	111.3	I296 F299 E300 M303 T311 G312 F313 V317 C318 Y319 A331	I296-L315 HydrophobicContact CB-CD1 4.47Å; I296-L315 HydrophobicContact CG1-CD1 4.37Å; I296-L315 HydrophobicContact CG2-CD1 4.11Å; F299-L315 HydrophobicContact CB-CB 4.04Å; F299-L315 HydrophobicContact CB-CD1 4.03Å; E300-L315 HydrophobicContact CG-CD1 4.04Å; M303-L315 HydrophobicContact CG-CD2 4.17Å; T311-L315 WeakPolarHBondContact O-CB 3.13Å; T311-L315 PolarHBondContact O-N 2.96Å; G312-L315 PolarHBondContact O-N 3.45Å; F313-L315 VanDerWaalsContact C-N 3.31Å; F313-L315 PolarHBondContact O-N 3.32Å; L315-V317 PolarHBondContact O-N 3.22Å; L315-C318 PolarHBondContact O-N 2.95Å; L315-Y319 HydrophobicContact CD1-CD2 4.16Å; L315-Y319 HydrophobicContact CD1-CE1 4.36Å; L315-Y319 HydrophobicContact CD1-CE2 3.5Å; L315-Y319 HydrophobicContact CD2-CE2 3.97Å; L315-Y319 HydrophobicContact CG-CD2 3.97Å; L315-Y319 HydrophobicContact CG-CE2 3.44Å; L315-Y319 VanDerWaalsContact CG-CE2 3.44Å; L315-Y319 WeakPolarHBondContact O-CD2 3.48Å; L315-Y319 PolarHBondContact O-N 3.38Å; L315-A331 HydrophobicContact CD2-CB 4.34Å; L315-A331 HydrophobicContact CG-CB 4.37Å
316	I	93.2	Very high	91.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-55.8	-49.9	173.4	-76.9	167.1	0	0	0	111.4	G312 F313 C318 Y319 F320 A331 F332 L335 A387 I391	G312-I316 WeakPolarHBondContact O-CG1 3.21Å; G312-I316 PolarHBondContact O-N 2.98Å; F313-I316 WeakPolarHBondContact O-CB 3.48Å; F313-I316 PolarHBondContact O-N 2.98Å; I316-C318 VanDerWaalsContact C-N 3.27Å; I316-C318 PolarHBondContact O-N 3.13Å; I316-Y319 PolarHBondContact O-N 3.12Å; I316-Y319 VanDerWaalsContact O-N 3.13Å; I316-F320 WeakPolarHBondContact O-CB 3.32Å; I316-F320 PolarHBondContact O-N 3.28Å; I316-A331 HydrophobicContact CD1-CB 4.46Å; I316-A331 HydrophobicContact CG1-CB 3.57Å; I316-F332 HydrophobicContact CD1-CB 4.34Å; I316-F332 HydrophobicContact CD1-CD2 4.25Å; I316-L335 HydrophobicContact CD1-CB 4.28Å; I316-L335 HydrophobicContact CD1-CD2 3.77Å; I316-A387 HydrophobicContact CD1-CB 3.88Å; I316-A387 HydrophobicContact CG2-CB 4.43Å; I316-I391 HydrophobicContact CB-CD1 4.28Å; I316-I391 HydrophobicContact CD1-CD1 3.91Å; I316-I391 HydrophobicContact CG1-CD1 4.06Å; I316-I391 HydrophobicContact CG2-CD1 3.28Å; I316-I391 HydrophobicContact CG2-CG1 3.59Å
317	V	92.7	Very high	91.4	Very high	39 Å²	39	58.3 Å²	58.3	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-60.2	-38.8	179	172.4	0	0	0	0	111.1	F313 N314 L315 F320 I321 I390	F313-V317 HydrophobicContact CD1-CG2 4.37Å; F313-V317 HydrophobicContact CE1-CG2 3.92Å; F313-V317 HydrophobicContact CE2-CG2 4.34Å; F313-V317 HydrophobicContact CZ-CG2 3.9Å; F313-V317 WeakPolarHBondContact O-CG2 3.45Å; F313-V317 PolarHBondContact O-N 2.99Å; N314-V317 PolarHBondContact O-N 2.81Å; L315-V317 PolarHBondContact O-N 3.22Å; V317-F320 PolarHBondContact O-N 3.41Å; V317-I321 HydrophobicContact CG1-CD1 4.14Å; V317-I321 WeakPolarHBondContact O-CG1 3.41Å; V317-I321 PolarHBondContact O-N 3.4Å; V317-I321 VanDerWaalsContact O-N 3.11Å; V317-I390 HydrophobicContact CG2-CD1 4.34Å
318	C	92.7	Very high	91.6	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.007	25%	0.25	C	C	.	.	H	α-helix	trans	-67.3	-38.7	175.6	-65.1	0	0	0	0	113	I296 N314 L315 I316 I321 K322	I296-C318 HydrophobicContact CD1-CB 3.93Å; I296-C318 HydrophobicContact CG1-CB 3.47Å; I296-C318 VanDerWaalsContact CG1-CB 3.47Å; N314-C318 PolarHBondContact O-N 3.3Å; N314-C318 VanDerWaalsContact O-N 3.07Å; N314-C318 PolarHBondContact O-SG 3.34Å; L315-C318 PolarHBondContact O-N 2.95Å; I316-C318 VanDerWaalsContact C-N 3.27Å; I316-C318 PolarHBondContact O-N 3.13Å; C318-I321 PolarHBondContact O-N 3.24Å; C318-K322 PolarHBondContact O-N 3.1Å; C318-K322 VanDerWaalsContact O-N 3.15Å
319	Y	93.4	Very high	91.8	Very high	8 Å²	8	55.1 Å²	55.1	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-68.8	-36	174.6	-69.3	-45.3	0	0	0	113.1	I296 E300 L315 I316 K322 R323 D324 K327 A331	I296-Y319 HydrophobicContact CD1-CD1 3.86Å; I296-Y319 HydrophobicContact CD1-CE1 4.01Å; I296-Y319 HydrophobicContact CG1-CD1 4.35Å; I296-Y319 HydrophobicContact CG1-CE1 4.23Å; I296-Y319 HydrophobicContact CG2-CE1 3.67Å; E300-Y319 PolarHBondContact OE1-OH 3.14Å; L315-Y319 HydrophobicContact CD1-CD2 4.16Å; L315-Y319 HydrophobicContact CD1-CE1 4.36Å; L315-Y319 HydrophobicContact CD1-CE2 3.5Å; L315-Y319 HydrophobicContact CD2-CE2 3.97Å; L315-Y319 HydrophobicContact CG-CD2 3.97Å; L315-Y319 HydrophobicContact CG-CE2 3.44Å; L315-Y319 VanDerWaalsContact CG-CE2 3.44Å; L315-Y319 WeakPolarHBondContact O-CD2 3.48Å; L315-Y319 PolarHBondContact O-N 3.38Å; I316-Y319 PolarHBondContact O-N 3.12Å; I316-Y319 VanDerWaalsContact O-N 3.13Å; Y319-K322 CarbonylContact O-C 3.56Å; Y319-K322 PolarHBondContact O-N 3.42Å; Y319-R323 PolarHBondContact O-N 2.78Å; Y319-D324 PolarHBondContact O-N 3.15Å; Y319-D324 VanDerWaalsContact O-N 3.17Å; Y319-K327 HydrophobicContact CD1-CB 3.64Å; Y319-K327 HydrophobicContact CD1-CD 3.92Å; Y319-K327 HydrophobicContact CD1-CG 4.44Å; Y319-K327 HydrophobicContact CD2-CB 3.87Å; Y319-K327 WeakPolarHBondContact CD2-O 3.33Å; Y319-K327 HydrophobicContact CE1-CB 3.64Å; Y319-K327 HydrophobicContact CE1-CD 3.36Å; Y319-K327 HydrophobicContact CE1-CG 4.11Å; Y319-K327 HydrophobicContact CE2-CB 3.85Å; Y319-K327 HydrophobicContact CG-CB 3.75Å; Y319-A331 HydrophobicContact CD2-CB 3.74Å; Y319-A331 HydrophobicContact CE2-CB 3.76Å
320	F	92.3	Very high	91.9	Very high	76 Å²	76	61 Å²	61	33%	0.333	27%	0.271	S	S	.	.	H	α-helix	trans	-59	-46.8	173.1	178.6	-92.2	0	0	0	111.5	I316 V317 K322 R323 M328 I390 V394	I316-F320 WeakPolarHBondContact O-CB 3.32Å; I316-F320 PolarHBondContact O-N 3.28Å; V317-F320 PolarHBondContact O-N 3.41Å; F320-K322 VanDerWaalsContact C-N 3.29Å; F320-K322 PolarHBondContact O-N 3.19Å; F320-R323 WeakPolarHBondContact O-CA 3.37Å; F320-R323 PolarHBondContact O-N 3.3Å; F320-M328 WeakPolarHBondContact CA-SD 3.35Å; F320-M328 HydrophobicContact CB-SD 3.8Å; F320-M328 HydrophobicContact CD2-SD 3.94Å; F320-M328 HydrophobicContact CG-SD 4.35Å; F320-I390 HydrophobicContact CB-CG2 4.24Å; F320-I390 HydrophobicContact CD1-CG2 4.16Å; F320-I390 HydrophobicContact CD2-CG2 3.45Å; F320-I390 VanDerWaalsContact CD2-CG2 3.45Å; F320-I390 HydrophobicContact CE1-CG2 4.39Å; F320-I390 HydrophobicContact CE2-CG2 3.7Å; F320-I390 WeakPolarHBondContact CE2-O 3.37Å; F320-I390 HydrophobicContact CG-CG2 3.69Å; F320-I390 HydrophobicContact CZ-CG2 4.17Å; F320-V394 HydrophobicContact CD2-CG2 4.41Å; F320-V394 HydrophobicContact CE2-CB 4.24Å; F320-V394 HydrophobicContact CE2-CG2 3.61Å; F320-V394 HydrophobicContact CZ-CG2 4.36Å
321	I	91.4	Very high	91.9	Very high	77 Å²	77	56.4 Å²	56.4	40%	0.395	25%	0.251	S	S	.	.	H	α-helix	trans	-62.5	-36.4	176.2	-65.8	166.4	0	0	0	111.5	F292 V317 C318 R323	F292-I321 HydrophobicContact CD1-CD1 4.02Å; F292-I321 HydrophobicContact CD1-CG2 4.35Å; F292-I321 HydrophobicContact CD2-CG2 3.75Å; F292-I321 HydrophobicContact CE1-CD1 3.48Å; F292-I321 VanDerWaalsContact CE1-CD1 3.48Å; F292-I321 HydrophobicContact CE1-CG2 4.25Å; F292-I321 HydrophobicContact CE2-CG2 3.63Å; F292-I321 HydrophobicContact CG-CG2 4.12Å; F292-I321 HydrophobicContact CZ-CD1 3.84Å; F292-I321 HydrophobicContact CZ-CG2 3.89Å; V317-I321 HydrophobicContact CG1-CD1 4.14Å; V317-I321 WeakPolarHBondContact O-CG1 3.41Å; V317-I321 PolarHBondContact O-N 3.4Å; V317-I321 VanDerWaalsContact O-N 3.11Å; C318-I321 PolarHBondContact O-N 3.24Å; I321-R323 VanDerWaalsContact C-N 3.28Å; I321-R323 PolarHBondContact O-N 3Å
322	K	90.4	Very high	92	Very high	106 Å²	106	56.3 Å²	56.3	46%	0.461	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.2	173.1	-66.5	-168.1	73.6	169.5	0	114.6	F292 S293 I296 C318 Y319 F320 D324	F292-K322 HydrophobicContact CB-CD 4.49Å; F292-K322 HydrophobicContact CB-CG 4.41Å; S293-K322 PolarHBondContact OG-NZ 3.29Å; I296-K322 HydrophobicContact CD1-CD 3.4Å; I296-K322 VanDerWaalsContact CD1-CD 3.4Å; I296-K322 HydrophobicContact CD1-CG 4.22Å; C318-K322 PolarHBondContact O-N 3.1Å; C318-K322 VanDerWaalsContact O-N 3.15Å; Y319-K322 CarbonylContact O-C 3.56Å; Y319-K322 PolarHBondContact O-N 3.42Å; F320-K322 VanDerWaalsContact C-N 3.29Å; F320-K322 PolarHBondContact O-N 3.19Å; K322-D324 PolarHBondContact O-N 3.28Å
323	R	88.6	Confident	92	Very high	212 Å²	212	58.7 Å²	58.7	80%	0.8	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	28.4	-178.1	-57.4	-175.2	175.5	-163	-3.1	115	Y319 F320 I321 R325	Y319-R323 PolarHBondContact O-N 2.78Å; F320-R323 WeakPolarHBondContact O-CA 3.37Å; F320-R323 PolarHBondContact O-N 3.3Å; I321-R323 VanDerWaalsContact C-N 3.28Å; I321-R323 PolarHBondContact O-N 3Å; R323-R325 PolarHBondContact O-N 3.16Å
324	D	90.3	Very high	91.8	Very high	53 Å²	53	59.3 Å²	59.3	28%	0.283	26%	0.264	S	S	.	.			trans	-87.3	93	-179.7	-169.1	-28.6	0	0	0	110.9	Y319 K322 N326 K327 M328	Y319-D324 PolarHBondContact O-N 3.15Å; Y319-D324 VanDerWaalsContact O-N 3.17Å; K322-D324 PolarHBondContact O-N 3.28Å; D324-N326 VanDerWaalsContact C-N 3.33Å; D324-N326 PolarHBondContact O-N 3.23Å; D324-N326 PolarHBondContact OD1-N 3.24Å; D324-K327 HydrophobicContact CB-CB 4.15Å; D324-K327 HydrophobicContact CB-CG 4.45Å; D324-K327 PolarHBondContact O-N 3.43Å; D324-K327 PolarHBondContact OD1-N 3.01Å; D324-K327 VanDerWaalsContact OD1-N 3.14Å; D324-K327 WeakPolarHBondContact OD2-CD 3.37Å; D324-K327 WeakPolarHBondContact OD2-CE 3.38Å; D324-K327 WeakPolarHBondContact OD2-CG 3.4Å; D324-K327 IonicContact OD2-NZ 2.75Å; D324-M328 WeakPolarHBondContact O-CG 3.47Å; D324-M328 PolarHBondContact O-N 3.38Å
325	R	90	Very high	91.8	Very high	131 Å²	131	57.4 Å²	57.4	49%	0.494	25%	0.254	S	S	.	.	H	α-helix	trans	-56	-42.7	-177.1	-72.3	176.7	165.5	170.3	-5.7	113.7	R323 M328 K329 V394 I395	R323-R325 PolarHBondContact O-N 3.16Å; R325-M328 HydrophobicContact CG-CE 4.24Å; R325-M328 PolarHBondContact O-N 2.88Å; R325-K329 PolarHBondContact O-N 3.03Å; R325-V394 PolarHBondContact NE-O 2.64Å; R325-V394 PolarHBondContact NH2-O 2.88Å; R325-I395 VanDerWaalsContact CD-O 3.27Å; R325-I395 WeakPolarHBondContact CD-O 3.49Å; R325-I395 PolarHBondContact NE-O 3.49Å
326	N	91.5	Very high	91.6	Very high	128 Å²	128	57.7 Å²	57.7	68%	0.684	26%	0.256	S	S	*	.	H	α-helix	trans	-70.5	-39.3	-176	-67.9	-20.7	0	0	0	110.8	D324 K329 Y330	D324-N326 VanDerWaalsContact C-N 3.33Å; D324-N326 PolarHBondContact O-N 3.23Å; D324-N326 PolarHBondContact OD1-N 3.24Å; N326-K329 PolarHBondContact O-N 3.27Å; N326-Y330 PolarHBondContact O-N 2.88Å
327	K	91.9	Very high	91.3	Very high	90 Å²	90	66 Å²	66	39%	0.391	29%	0.287	S	S	.	.	H	α-helix	trans	-72.7	-30.9	175.3	-64.7	-170.8	-167.4	-175	0	113.3	Y319 D324 Y330 A331	Y319-K327 HydrophobicContact CD1-CB 3.64Å; Y319-K327 HydrophobicContact CD1-CD 3.92Å; Y319-K327 HydrophobicContact CD1-CG 4.44Å; Y319-K327 HydrophobicContact CD2-CB 3.87Å; Y319-K327 WeakPolarHBondContact CD2-O 3.33Å; Y319-K327 HydrophobicContact CE1-CB 3.64Å; Y319-K327 HydrophobicContact CE1-CD 3.36Å; Y319-K327 HydrophobicContact CE1-CG 4.11Å; Y319-K327 HydrophobicContact CE2-CB 3.85Å; Y319-K327 HydrophobicContact CG-CB 3.75Å; D324-K327 HydrophobicContact CB-CB 4.15Å; D324-K327 HydrophobicContact CB-CG 4.45Å; D324-K327 PolarHBondContact O-N 3.43Å; D324-K327 PolarHBondContact OD1-N 3.01Å; D324-K327 VanDerWaalsContact OD1-N 3.14Å; D324-K327 WeakPolarHBondContact OD2-CD 3.37Å; D324-K327 WeakPolarHBondContact OD2-CE 3.38Å; D324-K327 WeakPolarHBondContact OD2-CG 3.4Å; D324-K327 IonicContact OD2-NZ 2.75Å; K327-Y330 PolarHBondContact O-N 3.22Å; K327-A331 VanDerWaalsContact O-CB 3.23Å; K327-A331 WeakPolarHBondContact O-CB 3.39Å; K327-A331 PolarHBondContact O-N 2.92Å
328	M	92.4	Very high	91	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-48.9	168.8	-75	-172.3	-73.7	0	0	111.8	F320 D324 R325 Y330 A331 F332 I391 V394	F320-M328 WeakPolarHBondContact CA-SD 3.35Å; F320-M328 HydrophobicContact CB-SD 3.8Å; F320-M328 HydrophobicContact CD2-SD 3.94Å; F320-M328 HydrophobicContact CG-SD 4.35Å; D324-M328 WeakPolarHBondContact O-CG 3.47Å; D324-M328 PolarHBondContact O-N 3.38Å; R325-M328 HydrophobicContact CG-CE 4.24Å; R325-M328 PolarHBondContact O-N 2.88Å; M328-Y330 PolarHBondContact O-N 3.43Å; M328-A331 PolarHBondContact O-N 3.5Å; M328-F332 WeakPolarHBondContact O-CB 3.4Å; M328-F332 PolarHBondContact O-N 2.81Å; M328-I391 HydrophobicContact CB-CG2 4.29Å; M328-V394 HydrophobicContact CE-CG1 3.86Å
329	K	92.1	Very high	90.3	Very high	51 Å²	51	68.3 Å²	68.3	22%	0.222	30%	0.298	C	S	.	.	H	α-helix	trans	-54.4	-51	173.7	-76.4	-165.7	179.1	-162.6	0	111.6	R325 N326 A331 F332 Q333 I395 E396 W405	R325-K329 PolarHBondContact O-N 3.03Å; N326-K329 PolarHBondContact O-N 3.27Å; K329-A331 PolarHBondContact O-N 2.87Å; K329-F332 PolarHBondContact O-N 3.06Å; K329-Q333 WeakPolarHBondContact O-CG 3.41Å; K329-Q333 PolarHBondContact O-N 3.1Å; K329-I395 HydrophobicContact CD-CG2 4.21Å; K329-I395 HydrophobicContact CG-CD1 3.76Å; K329-I395 HydrophobicContact CG-CG1 4.29Å; K329-I395 HydrophobicContact CG-CG2 4.1Å; K329-E396 WeakPolarHBondContact CE-OE1 3.47Å; K329-E396 IonicContact NZ-OE1 3.96Å; K329-E396 PolarHBondContact NZ-OE1 3.48Å; K329-W405 HydrophobicContact CB-CH2 3.69Å; K329-W405 HydrophobicContact CB-CZ2 3.76Å; K329-W405 HydrophobicContact CD-CH2 4.29Å; K329-W405 HydrophobicContact CD-CZ2 3.67Å; K329-W405 HydrophobicContact CG-CH2 3.67Å; K329-W405 HydrophobicContact CG-CZ2 3.59Å; K329-W405 HydrophobicContact CG-CZ3 4.18Å
330	Y	92.1	Very high	89.4	Confident	132 Å²	132	68.8 Å²	68.8	52%	0.518	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-45.7	-179.3	-179.9	-100	0	0	0	112.4	N326 K327 M328 F332 Q333 Q334	N326-Y330 PolarHBondContact O-N 2.88Å; K327-Y330 PolarHBondContact O-N 3.22Å; M328-Y330 PolarHBondContact O-N 3.43Å; Y330-F332 PolarHBondContact O-N 3.36Å; Y330-Q333 PolarHBondContact O-N 3.01Å; Y330-Q334 HydrophobicContact CD1-CG 4.2Å; Y330-Q334 HydrophobicContact CE1-CG 3.81Å; Y330-Q334 VanDerWaalsContact CE2-NE2 3.26Å; Y330-Q334 VanDerWaalsContact CZ-NE2 3.26Å; Y330-Q334 WeakPolarHBondContact O-CG 3.35Å; Y330-Q334 PolarHBondContact O-N 2.97Å; Y330-Q334 PolarHBondContact OH-NE2 3.47Å
331	A	91.8	Very high	88.4	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-37.1	179.9	0	0	0	0	0	112.8	L315 I316 Y319 K327 M328 K329 Q334 L335	L315-A331 HydrophobicContact CD2-CB 4.34Å; L315-A331 HydrophobicContact CG-CB 4.37Å; I316-A331 HydrophobicContact CD1-CB 4.46Å; I316-A331 HydrophobicContact CG1-CB 3.57Å; Y319-A331 HydrophobicContact CD2-CB 3.74Å; Y319-A331 HydrophobicContact CE2-CB 3.76Å; K327-A331 VanDerWaalsContact O-CB 3.23Å; K327-A331 WeakPolarHBondContact O-CB 3.39Å; K327-A331 PolarHBondContact O-N 2.92Å; M328-A331 PolarHBondContact O-N 3.5Å; K329-A331 PolarHBondContact O-N 2.87Å; A331-Q334 PolarHBondContact O-N 2.99Å; A331-L335 WeakPolarHBondContact O-CB 3.39Å; A331-L335 PolarHBondContact O-N 2.84Å
332	F	93	Very high	87.2	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-41.6	172.9	-169.2	-106.5	0	0	0	111.5	I316 M328 K329 Y330 Q334 L335 L336 I384 A387 A388 I391 W405 C406 V410	I316-F332 HydrophobicContact CD1-CB 4.34Å; I316-F332 HydrophobicContact CD1-CD2 4.25Å; M328-F332 WeakPolarHBondContact O-CB 3.4Å; M328-F332 PolarHBondContact O-N 2.81Å; K329-F332 PolarHBondContact O-N 3.06Å; Y330-F332 PolarHBondContact O-N 3.36Å; F332-Q334 VanDerWaalsContact C-N 3.34Å; F332-Q334 PolarHBondContact O-N 3.11Å; F332-L335 WeakPolarHBondContact O-CB 3.33Å; F332-L335 PolarHBondContact O-N 3.41Å; F332-L336 HydrophobicContact CD1-CD1 3.93Å; F332-L336 HydrophobicContact CE1-CD1 3.63Å; F332-L336 HydrophobicContact CE1-CG 4.28Å; F332-L336 HydrophobicContact CZ-CD1 4.26Å; F332-L336 WeakPolarHBondContact O-CG 3.14Å; F332-L336 PolarHBondContact O-N 3.06Å; F332-I384 HydrophobicContact CE2-CG2 4.36Å; F332-I384 HydrophobicContact CZ-CG2 4.37Å; F332-A387 HydrophobicContact CD2-CB 4.01Å; F332-A387 HydrophobicContact CE2-CB 4.01Å; F332-A388 HydrophobicContact CE2-CB 4.09Å; F332-A388 HydrophobicContact CZ-CB 4.1Å; F332-I391 HydrophobicContact CB-CD1 4.08Å; F332-I391 HydrophobicContact CD2-CD1 3.82Å; F332-I391 HydrophobicContact CG-CD1 4.25Å; F332-W405 HydrophobicContact CB-CZ3 4.43Å; F332-W405 HydrophobicContact CD1-CH2 4.17Å; F332-W405 AromaticContact CD1-CZ3 3.7Å; F332-W405 HydrophobicContact CD1-CZ3 3.7Å; F332-W405 HydrophobicContact CE1-CZ3 4.4Å; F332-W405 HydrophobicContact CG-CZ3 4.38Å; F332-C406 HydrophobicContact CE1-CB 4.07Å; F332-C406 HydrophobicContact CZ-CB 4.2Å; F332-V410 HydrophobicContact CE1-CG2 4.21Å; F332-V410 HydrophobicContact CZ-CG2 3.98Å
333	Q	92.3	Very high	85.6	Confident	51 Å²	51	70.2 Å²	70.2	24%	0.238	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-33.7	173.3	-70.9	175.2	-12.2	0	0	113.2	K329 Y330 R337 W405 H409	K329-Q333 WeakPolarHBondContact O-CG 3.41Å; K329-Q333 PolarHBondContact O-N 3.1Å; Y330-Q333 PolarHBondContact O-N 3.01Å; Q333-R337 VanDerWaalsContact O-CG 3.3Å; Q333-R337 WeakPolarHBondContact O-CG 3.46Å; Q333-R337 PolarHBondContact O-N 3.33Å; Q333-W405 HydrophobicContact CG-CH2 4.29Å; Q333-W405 HydrophobicContact CG-CZ2 4.47Å; Q333-H409 PolarHBondContact NE2-NE2 2.98Å
334	Q	90.1	Very high	84.2	Confident	43 Å²	43	64 Å²	64	20%	0.201	30%	0.295	C	S	.	.	H	α-helix	trans	-71	-36.5	171.8	-61	-49.7	-40	0	0	112	M303 Y330 A331 F332 L336 R337	M303-Q334 HydrophobicContact CE-CB 3.75Å; Y330-Q334 HydrophobicContact CD1-CG 4.2Å; Y330-Q334 HydrophobicContact CE1-CG 3.81Å; Y330-Q334 VanDerWaalsContact CE2-NE2 3.26Å; Y330-Q334 VanDerWaalsContact CZ-NE2 3.26Å; Y330-Q334 WeakPolarHBondContact O-CG 3.35Å; Y330-Q334 PolarHBondContact O-N 2.97Å; Y330-Q334 PolarHBondContact OH-NE2 3.47Å; A331-Q334 PolarHBondContact O-N 2.99Å; F332-Q334 VanDerWaalsContact C-N 3.34Å; F332-Q334 PolarHBondContact O-N 3.11Å; Q334-L336 VanDerWaalsContact C-N 3.34Å; Q334-L336 PolarHBondContact O-N 2.86Å; Q334-R337 PolarHBondContact O-N 3.19Å
335	L	91.4	Very high	82.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-39.7	176.2	-179.9	63.5	0	0	0	112	T309 I316 A331 F332 R337 V338 I384 A387	T309-L335 HydrophobicContact CG2-CD1 4.3Å; T309-L335 WeakPolarHBondContact O-CD1 3.13Å; I316-L335 HydrophobicContact CD1-CB 4.28Å; I316-L335 HydrophobicContact CD1-CD2 3.77Å; A331-L335 WeakPolarHBondContact O-CB 3.39Å; A331-L335 PolarHBondContact O-N 2.84Å; F332-L335 WeakPolarHBondContact O-CB 3.33Å; F332-L335 PolarHBondContact O-N 3.41Å; L335-R337 VanDerWaalsContact C-N 3.25Å; L335-R337 PolarHBondContact O-N 3.19Å; L335-V338 VanDerWaalsContact O-CG2 3.31Å; L335-V338 WeakPolarHBondContact O-CG2 3.26Å; L335-V338 PolarHBondContact O-N 3.35Å; L335-I384 HydrophobicContact CD2-CG1 4.01Å; L335-I384 HydrophobicContact CG-CG1 4.03Å; L335-A387 HydrophobicContact CD2-CB 3.87Å
336	L	89.4	Confident	81.1	Confident	12 Å²	12	65.3 Å²	65.3	6%	0.063	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.6	176.6	-66.6	174	0	0	0	114.1	F332 Q334 I384 H409 V410 Y415	F332-L336 HydrophobicContact CD1-CD1 3.93Å; F332-L336 HydrophobicContact CE1-CD1 3.63Å; F332-L336 HydrophobicContact CE1-CG 4.28Å; F332-L336 HydrophobicContact CZ-CD1 4.26Å; F332-L336 WeakPolarHBondContact O-CG 3.14Å; F332-L336 PolarHBondContact O-N 3.06Å; Q334-L336 VanDerWaalsContact C-N 3.34Å; Q334-L336 PolarHBondContact O-N 2.86Å; L336-I384 HydrophobicContact CD2-CD1 4.19Å; L336-I384 HydrophobicContact CD2-CG1 4.39Å; L336-I384 HydrophobicContact CD2-CG2 3.88Å; L336-H409 HydrophobicContact CD1-CB 3.79Å; L336-V410 HydrophobicContact CD1-CG2 4.18Å; L336-V410 HydrophobicContact CD2-CG2 3.87Å; L336-Y415 HydrophobicContact CD2-CD2 4.33Å
337	R	87.8	Confident	79.7	Confident	175 Å²	175	66.6 Å²	66.6	66%	0.66	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-1.8	174.7	-71.8	171.4	180	-167.3	-1	113.3	Q333 Q334 L335 D339	Q333-R337 VanDerWaalsContact O-CG 3.3Å; Q333-R337 WeakPolarHBondContact O-CG 3.46Å; Q333-R337 PolarHBondContact O-N 3.33Å; Q334-R337 PolarHBondContact O-N 3.19Å; L335-R337 VanDerWaalsContact C-N 3.25Å; L335-R337 PolarHBondContact O-N 3.19Å; R337-D339 PolarHBondContact O-N 3.07Å; R337-D339 VanDerWaalsContact O-N 3.07Å
338	V	85.3	Confident	78.3	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.03	29%	0.291	C	S	.	.			trans	-74.3	99.7	176.4	-171.6	0	0	0	0	108.5	M303 P307 T309 L335 Y415	M303-V338 HydrophobicContact CE-CG2 4.35Å; P307-V338 HydrophobicContact CB-CG2 4.13Å; P307-V338 WeakPolarHBondContact O-CG1 3.38Å; T309-V338 HydrophobicContact CG2-CB 3.93Å; T309-V338 HydrophobicContact CG2-CG1 3.74Å; T309-V338 HydrophobicContact CG2-CG2 4.39Å; L335-V338 VanDerWaalsContact O-CG2 3.31Å; L335-V338 WeakPolarHBondContact O-CG2 3.26Å; L335-V338 PolarHBondContact O-N 3.35Å; V338-Y415 PolarHBondContact O-OH 2.87Å
339	D	78.4	Confident	76.8	Confident	83 Å²	83	68 Å²	68	44%	0.444	31%	0.314	S	S	.	.			trans	-70.5	130.9	167.7	-175.6	-3.4	0	0	0	109.4	R337 H341	R337-D339 PolarHBondContact O-N 3.07Å; R337-D339 VanDerWaalsContact O-N 3.07Å; D339-H341 WeakPolarHBondContact OD1-CA 3.38Å; D339-H341 PolarHBondContact OD1-N 2.69Å; D339-H341 IonicContact OD1-ND1 2.85Å; D339-H341 PolarHBondContact OD1-ND1 3.02Å; D339-H341 IonicContact OD2-CE1 2.74Å; D339-H341 PolarHBondContact OD2-CE1 3.21Å; D339-H341 IonicContact OD2-ND1 3.82Å; D339-H341 PolarHBondContact OD2-ND1 3.01Å
340	L	75.6	Confident	75.1	Confident	18 Å²	18	72.2 Å²	72.2	9%	0.094	33%	0.334	C	S	.	.			trans	-89.1	-13.4	178.9	-66.2	166.3	0	0	0	112.6	T309 L342 K376 A380 Y415	T309-L340 HydrophobicContact CG2-CD2 4.18Å; L340-L342 HydrophobicContact CB-CB 4.29Å; L340-L342 HydrophobicContact CB-CD1 3.74Å; L340-L342 HydrophobicContact CB-CG 3.72Å; L340-L342 HydrophobicContact CD1-CD1 4.06Å; L340-L342 HydrophobicContact CG-CD1 4.46Å; L340-K376 HydrophobicContact CD2-CG 4.33Å; L340-K376 PolarHBondContact O-NZ 3.2Å; L340-A380 HydrophobicContact CD1-CB 3.65Å; L340-A380 HydrophobicContact CD2-CB 4.04Å; L340-A380 HydrophobicContact CG-CB 4.39Å; L340-Y415 HydrophobicContact CD1-CE1 3.97Å; L340-Y415 WeakPolarHBondContact CD1-OH 3.25Å; L340-Y415 WeakPolarHBondContact CG-OH 3.25Å
341	H	70.6	Confident	73.4	Confident	156 Å²	156	71.7 Å²	71.7	72%	0.722	34%	0.336	S	S	*	.	S	Bend	trans	52.7	51.4	-168.3	-53.5	-41.4	0	0	0	112	D339	D339-H341 WeakPolarHBondContact OD1-CA 3.38Å; D339-H341 PolarHBondContact OD1-N 2.69Å; D339-H341 IonicContact OD1-ND1 2.85Å; D339-H341 PolarHBondContact OD1-ND1 3.02Å; D339-H341 IonicContact OD2-CE1 2.74Å; D339-H341 PolarHBondContact OD2-CE1 3.21Å; D339-H341 IonicContact OD2-ND1 3.82Å; D339-H341 PolarHBondContact OD2-ND1 3.01Å
342	L	66.5	Low	71.7	Confident	21 Å²	21	77.5 Å²	77.5	11%	0.11	37%	0.367	C	S	.	.			trans	-119.7	0.7	-177.2	-65.3	-179.2	0	0	0	113.8	L340 D344 E373 K376 K377	L340-L342 HydrophobicContact CB-CB 4.29Å; L340-L342 HydrophobicContact CB-CD1 3.74Å; L340-L342 HydrophobicContact CB-CG 3.72Å; L340-L342 HydrophobicContact CD1-CD1 4.06Å; L340-L342 HydrophobicContact CG-CD1 4.46Å; L342-D344 PolarHBondContact O-N 3.32Å; L342-E373 HydrophobicContact CD2-CB 3.92Å; L342-E373 HydrophobicContact CD2-CG 3.67Å; L342-K376 HydrophobicContact CD1-CB 4.23Å; L342-K376 HydrophobicContact CD1-CD 4.21Å; L342-K376 HydrophobicContact CD1-CG 4.36Å; L342-K377 HydrophobicContact CD1-CB 4.11Å
343	D	57.5	Low	70.1	Confident	113 Å²	113	85.5 Å²	85.5	60%	0.604	41%	0.41	S	S	*	.			trans	-79	15.6	-164.7	-62.2	-6.9	0	0	0	114	E345	D343-E345 PolarHBondContact O-N 2.98Å
344	D	58	Low	69	Low	80 Å²	80	88 Å²	88	43%	0.428	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-70.5	39.9	168.3	-94.1	13.3	0	0	0	111.4	L342 D346 R347 Y348	L342-D344 PolarHBondContact O-N 3.32Å; D344-D346 PolarHBondContact O-N 3.31Å; D344-R347 HydrophobicContact CB-CB 3.89Å; D344-R347 WeakPolarHBondContact O-CB 3.49Å; D344-R347 PolarHBondContact O-N 3.18Å; D344-R347 IonicContact OD2-CZ 3.7Å; D344-R347 IonicContact OD2-NE 2.69Å; D344-R347 IonicContact OD2-NH1 2.71Å; D344-R347 PolarHBondContact OD2-NH1 2.92Å; D344-Y348 WeakPolarHBondContact O-CD2 3.45Å; D344-Y348 VanDerWaalsContact O-CE2 3.25Å; D344-Y348 WeakPolarHBondContact O-CE2 3.49Å
345	E	58.6	Low	68.1	Low	101 Å²	101	94 Å²	94	47%	0.472	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-56	-40.4	169.4	-74.2	-80.7	116.3	0	0	110	D343 R347 Y348 L349 R370	D343-E345 PolarHBondContact O-N 2.98Å; E345-R347 PolarHBondContact O-N 3.05Å; E345-R347 VanDerWaalsContact O-N 3.12Å; E345-Y348 PolarHBondContact O-N 3.4Å; E345-L349 PolarHBondContact O-N 2.98Å; E345-R370 IonicContact OE1-CZ 3.75Å; E345-R370 IonicContact OE1-NH1 2.71Å; E345-R370 IonicContact OE1-NH2 3.81Å; E345-R370 PolarHBondContact OE1-NH2 3.01Å
346	D	57.3	Low	67.1	Low	112 Å²	112	101.2 Å²	101.2	60%	0.599	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-51.9	-31.8	173.1	-73.7	-10.7	0	0	0	113.1	D344 Y348 L349 H351	D344-D346 PolarHBondContact O-N 3.31Å; D346-Y348 PolarHBondContact O-N 3.25Å; D346-L349 PolarHBondContact O-N 3.44Å; D346-H351 PolarHBondContact O-NE2 3.46Å
347	R	61.4	Low	66.2	Low	154 Å²	154	105.6 Å²	105.6	58%	0.581	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.2	178.3	-160.3	-176.7	-155.6	148.8	-0.8	113.4	D344 E345	D344-R347 HydrophobicContact CB-CB 3.89Å; D344-R347 WeakPolarHBondContact O-CB 3.49Å; D344-R347 PolarHBondContact O-N 3.18Å; D344-R347 IonicContact OD2-CZ 3.7Å; D344-R347 IonicContact OD2-NE 2.69Å; D344-R347 IonicContact OD2-NH1 2.71Å; D344-R347 PolarHBondContact OD2-NH1 2.92Å; E345-R347 PolarHBondContact O-N 3.05Å; E345-R347 VanDerWaalsContact O-N 3.12Å
348	Y	61.9	Low	65.3	Low	28 Å²	28	99.1 Å²	99.1	11%	0.11	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-111.2	0.9	-179.9	-49.9	-79.9	0	0	0	113	D344 E345 D346 I364 R370 E373	D344-Y348 WeakPolarHBondContact O-CD2 3.45Å; D344-Y348 VanDerWaalsContact O-CE2 3.25Å; D344-Y348 WeakPolarHBondContact O-CE2 3.49Å; E345-Y348 PolarHBondContact O-N 3.4Å; D346-Y348 PolarHBondContact O-N 3.25Å; Y348-I364 HydrophobicContact CD1-CG2 3.67Å; Y348-I364 HydrophobicContact CE1-CG2 3.4Å; Y348-R370 HydrophobicContact CE1-CG 4.29Å; Y348-E373 PolarHBondContact OH-OE2 3.45Å; Y348-E373 VanDerWaalsContact OH-OE2 3.11Å
349	L	61	Low	64.5	Low	93 Å²	93	104.3 Å²	104.3	49%	0.487	51%	0.506	S	S	.	.	S	Bend	trans	-75.6	142.6	172.6	-92.8	121.5	0	0	0	111	E345 D346 H351	E345-L349 PolarHBondContact O-N 2.98Å; D346-L349 PolarHBondContact O-N 3.44Å; L349-H351 PolarHBondContact O-N 3.14Å; L349-H351 VanDerWaalsContact O-N 3.08Å
350	Q	57.2	Low	64.2	Low	139 Å²	139	104.1 Å²	104.1	65%	0.65	50%	0.504	S	S	*	.			trans	-67.4	106.3	175.8	-65.8	-179.6	-67.1	0	0	109.5	D358 L361	Q350-D358 WeakPolarHBondContact CG-OD1 3.37Å; Q350-D358 VanDerWaalsContact NE2-CG 3.26Å; Q350-D358 PolarHBondContact NE2-OD1 3.49Å; Q350-L361 HydrophobicContact CG-CD1 4.06Å
351	H	56	Low	64	Low	121 Å²	121	103.4 Å²	103.4	56%	0.56	50%	0.5	S	S	*	.			trans	-91.7	-7.6	-173.9	-91.1	-51.8	0	0	0	115.5	D346 L349	D346-H351 PolarHBondContact O-NE2 3.46Å; L349-H351 PolarHBondContact O-N 3.14Å; L349-H351 VanDerWaalsContact O-N 3.08Å
352	N	55.8	Low	64	Low	122 Å²	122	101.8 Å²	101.8	65%	0.652	49%	0.493	S	S	*	.	S	Bend	trans	-162.4	166.5	172.7	-82.1	-54.2	0	0	0	111.2	D354	N352-D354 PolarHBondContact O-N 2.89Å
353	D	60.4	Low	64.2	Low	169 Å²	169	105.9 Å²	105.9	90%	0.904	52%	0.519	S	S	*	.	S	Bend	trans	-64.2	15.2	173.1	-69.9	-44.5	0	0	0	115.1	K355	D353-K355 PolarHBondContact O-N 2.89Å; D353-K355 VanDerWaalsContact O-N 3.08Å
354	D	68.2	Low	64.9	Low	104 Å²	104	103.6 Å²	103.6	56%	0.556	51%	0.506	S	S	*	.			trans	-77.8	93.5	-179.3	-94.1	-32.2	0	0	0	110.8	N352 Q356 Y357 D358	N352-D354 PolarHBondContact O-N 2.89Å; D354-Q356 PolarHBondContact O-N 3.29Å; D354-Y357 WeakPolarHBondContact O-CA 3.46Å; D354-Y357 VanDerWaalsContact O-CB 3.28Å; D354-Y357 WeakPolarHBondContact O-CB 3.36Å; D354-Y357 PolarHBondContact O-N 3.47Å; D354-D358 PolarHBondContact O-N 3.43Å; D354-D358 VanDerWaalsContact O-N 3.11Å
355	K	71.9	Confident	65.4	Low	168 Å²	168	103.8 Å²	103.8	73%	0.73	50%	0.504	S	S	*	.	H	α-helix	trans	-50.9	-27.2	175.7	-62.9	-176.8	179.2	-177.6	0	114.7	D353 L359	D353-K355 PolarHBondContact O-N 2.89Å; D353-K355 VanDerWaalsContact O-N 3.08Å; K355-L359 PolarHBondContact O-N 3.43Å
356	Q	71	Confident	66.1	Low	151 Å²	151	104.4 Å²	104.4	71%	0.706	51%	0.511	S	S	*	.	H	α-helix	trans	-73.5	-32.8	175	-175.4	172.1	-9.1	0	0	112	D354 I360	D354-Q356 PolarHBondContact O-N 3.29Å; Q356-I360 WeakPolarHBondContact O-CD1 3.45Å; Q356-I360 VanDerWaalsContact O-CG1 3.32Å; Q356-I360 WeakPolarHBondContact O-CG1 3.2Å; Q356-I360 PolarHBondContact O-N 3.01Å
357	Y	69.6	Low	67.3	Low	105 Å²	105	102.8 Å²	102.8	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-71.5	-36.5	172.5	-159.3	-99.6	0	0	0	111.1	D354 I360 L361	D354-Y357 WeakPolarHBondContact O-CA 3.46Å; D354-Y357 VanDerWaalsContact O-CB 3.28Å; D354-Y357 WeakPolarHBondContact O-CB 3.36Å; D354-Y357 PolarHBondContact O-N 3.47Å; Y357-I360 CarbonylContact O-C 3.43Å; Y357-I360 WeakPolarHBondContact O-CB 3.39Å; Y357-I360 PolarHBondContact O-N 3.09Å; Y357-I360 VanDerWaalsContact O-N 3.13Å; Y357-L361 HydrophobicContact CD1-CD1 3.66Å; Y357-L361 HydrophobicContact CD1-CG 3.94Å; Y357-L361 HydrophobicContact CE1-CD1 3.84Å; Y357-L361 HydrophobicContact CE1-CD2 4.17Å; Y357-L361 HydrophobicContact CE1-CG 3.94Å; Y357-L361 WeakPolarHBondContact O-CG 3.38Å; Y357-L361 PolarHBondContact O-N 3.14Å
358	D	68.4	Low	68.4	Low	39 Å²	39	103.3 Å²	103.3	21%	0.209	51%	0.511	C	S	.	.	H	α-helix	trans	-58.8	-47	172.5	-65.9	-31	0	0	0	112.6	Q350 D354 I360 L361 E362	Q350-D358 WeakPolarHBondContact CG-OD1 3.37Å; Q350-D358 VanDerWaalsContact NE2-CG 3.26Å; Q350-D358 PolarHBondContact NE2-OD1 3.49Å; D354-D358 PolarHBondContact O-N 3.43Å; D354-D358 VanDerWaalsContact O-N 3.11Å; D358-I360 VanDerWaalsContact C-N 3.26Å; D358-I360 PolarHBondContact O-N 3.36Å; D358-L361 CarbonylContact O-C 3.5Å; D358-L361 WeakPolarHBondContact O-CA 3.4Å; D358-L361 WeakPolarHBondContact O-CB 3.47Å; D358-L361 PolarHBondContact O-N 3.43Å; D358-L361 VanDerWaalsContact O-N 3.1Å; D358-E362 PolarHBondContact O-N 3.05Å
359	L	70.1	Confident	69.4	Low	113 Å²	113	106.7 Å²	106.7	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-59.3	-36.5	173.9	-87.3	152.9	0	0	0	112.5	K355 V363	K355-L359 PolarHBondContact O-N 3.43Å; L359-V363 WeakPolarHBondContact O-CG2 3.46Å; L359-V363 PolarHBondContact O-N 2.98Å
360	I	72.3	Confident	70.3	Confident	79 Å²	79	103.3 Å²	103.3	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-70.5	-39.7	174.8	-69	165.4	0	0	0	110.5	Q356 Y357 D358 V363 I364	Q356-I360 WeakPolarHBondContact O-CD1 3.45Å; Q356-I360 VanDerWaalsContact O-CG1 3.32Å; Q356-I360 WeakPolarHBondContact O-CG1 3.2Å; Q356-I360 PolarHBondContact O-N 3.01Å; Y357-I360 CarbonylContact O-C 3.43Å; Y357-I360 WeakPolarHBondContact O-CB 3.39Å; Y357-I360 PolarHBondContact O-N 3.09Å; Y357-I360 VanDerWaalsContact O-N 3.13Å; D358-I360 VanDerWaalsContact C-N 3.26Å; D358-I360 PolarHBondContact O-N 3.36Å; I360-V363 PolarHBondContact O-N 3.5Å; I360-I364 HydrophobicContact CG2-CD1 3.56Å; I360-I364 HydrophobicContact CG2-CG1 4.25Å; I360-I364 WeakPolarHBondContact O-CB 3.4Å; I360-I364 VanDerWaalsContact O-CG1 3.24Å; I360-I364 WeakPolarHBondContact O-CG1 3.33Å; I360-I364 PolarHBondContact O-N 2.94Å
361	L	71.3	Confident	71.5	Confident	4 Å²	4	101 Å²	101	2%	0.021	50%	0.5	C	S	.	.	H	α-helix	trans	-62.3	-42.8	174.7	-76.2	169.8	0	0	0	111.8	Q350 Y357 D358 V363 I364 Q365	Q350-L361 HydrophobicContact CG-CD1 4.06Å; Y357-L361 HydrophobicContact CD1-CD1 3.66Å; Y357-L361 HydrophobicContact CD1-CG 3.94Å; Y357-L361 HydrophobicContact CE1-CD1 3.84Å; Y357-L361 HydrophobicContact CE1-CD2 4.17Å; Y357-L361 HydrophobicContact CE1-CG 3.94Å; Y357-L361 WeakPolarHBondContact O-CG 3.38Å; Y357-L361 PolarHBondContact O-N 3.14Å; D358-L361 CarbonylContact O-C 3.5Å; D358-L361 WeakPolarHBondContact O-CA 3.4Å; D358-L361 WeakPolarHBondContact O-CB 3.47Å; D358-L361 PolarHBondContact O-N 3.43Å; D358-L361 VanDerWaalsContact O-N 3.1Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.06Å; L361-I364 PolarHBondContact O-N 3.4Å; L361-Q365 WeakPolarHBondContact O-CB 3.42Å; L361-Q365 WeakPolarHBondContact O-CG 3.38Å; L361-Q365 PolarHBondContact O-N 3.23Å
362	E	69	Low	72.9	Confident	121 Å²	121	102.5 Å²	102.5	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-39.8	175.3	-74.1	-174	164.9	0	0	112.6	D358 N366	D358-E362 PolarHBondContact O-N 3.05Å; E362-N366 PolarHBondContact O-ND2 3.11Å
363	V	72	Confident	74.2	Confident	107 Å²	107	98 Å²	98	65%	0.648	48%	0.477	S	S	*	.	H	α-helix	trans	-66.4	-46.2	174.4	172.7	0	0	0	0	110.6	L359 I360 L361 Q365 N366 D367	L359-V363 WeakPolarHBondContact O-CG2 3.46Å; L359-V363 PolarHBondContact O-N 2.98Å; I360-V363 PolarHBondContact O-N 3.5Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.06Å; V363-Q365 PolarHBondContact O-N 2.91Å; V363-N366 PolarHBondContact O-N 3.49Å; V363-D367 PolarHBondContact O-N 2.91Å
364	I	72.1	Confident	75.3	Confident	65 Å²	65	94.5 Å²	94.5	33%	0.333	45%	0.454	S	S	.	.	H	α-helix	trans	-66.4	-35.5	-179.8	-73.4	174.9	0	0	0	112.2	Y348 I360 L361 N366 D367 R370	Y348-I364 HydrophobicContact CD1-CG2 3.67Å; Y348-I364 HydrophobicContact CE1-CG2 3.4Å; I360-I364 HydrophobicContact CG2-CD1 3.56Å; I360-I364 HydrophobicContact CG2-CG1 4.25Å; I360-I364 WeakPolarHBondContact O-CB 3.4Å; I360-I364 VanDerWaalsContact O-CG1 3.24Å; I360-I364 WeakPolarHBondContact O-CG1 3.33Å; I360-I364 PolarHBondContact O-N 2.94Å; L361-I364 PolarHBondContact O-N 3.4Å; I364-N366 PolarHBondContact O-N 3.31Å; I364-D367 WeakPolarHBondContact O-CB 3.38Å; I364-D367 PolarHBondContact O-N 3.35Å; I364-D367 VanDerWaalsContact O-N 3.16Å; I364-R370 WeakPolarHBondContact O-CB 3.06Å
365	Q	68.3	Low	76.2	Confident	84 Å²	84	96.2 Å²	96.2	39%	0.393	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-24.3	177.5	-80.4	177.3	24.4	0	0	113.2	L361 V363 K374	L361-Q365 WeakPolarHBondContact O-CB 3.42Å; L361-Q365 WeakPolarHBondContact O-CG 3.38Å; L361-Q365 PolarHBondContact O-N 3.23Å; V363-Q365 PolarHBondContact O-N 2.91Å; Q365-K374 PolarHBondContact O-NZ 2.71Å; Q365-K374 VanDerWaalsContact O-NZ 3.13Å
366	N	73.4	Confident	76.9	Confident	115 Å²	115	91.7 Å²	91.7	62%	0.615	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-2.3	179.4	-68.5	-57.4	0	0	0	113.8	E362 V363 I364 Q371	E362-N366 PolarHBondContact O-ND2 3.11Å; V363-N366 PolarHBondContact O-N 3.49Å; I364-N366 PolarHBondContact O-N 3.31Å; N366-Q371 PolarHBondContact O-NE2 3.11Å
367	D	82.7	Confident	77.7	Confident	77 Å²	77	87.5 Å²	87.5	41%	0.412	42%	0.416	S	S	.	.	S	Bend	trans	-61.9	151.9	-178.5	-178.2	33.8	0	0	0	113.2	V363 I364 L369 R370 Q371	V363-D367 PolarHBondContact O-N 2.91Å; I364-D367 WeakPolarHBondContact O-CB 3.38Å; I364-D367 PolarHBondContact O-N 3.35Å; I364-D367 VanDerWaalsContact O-N 3.16Å; D367-L369 PolarHBondContact O-N 3.3Å; D367-L369 WeakPolarHBondContact OD2-CB 3.24Å; D367-R370 PolarHBondContact O-N 3.41Å; D367-R370 VanDerWaalsContact O-N 3.14Å; D367-Q371 WeakPolarHBondContact O-CG 3.41Å; D367-Q371 PolarHBondContact O-N 2.74Å
368	E	83.8	Confident	78.6	Confident	165 Å²	165	85.9 Å²	85.9	77%	0.771	42%	0.417	S	S	*	.	H	α-helix	trans	-56.8	-36.1	178.7	-65.9	-169.1	169.7	0	0	111.8	Y372	E368-Y372 WeakPolarHBondContact O-CB 3.3Å; E368-Y372 PolarHBondContact O-N 2.69Å
369	L	82.9	Confident	79.6	Confident	99 Å²	99	89.2 Å²	89.2	52%	0.518	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-50.4	176.1	-175.3	62.6	0	0	0	111.2	D367 Q371 Y372 E373	D367-L369 PolarHBondContact O-N 3.3Å; D367-L369 WeakPolarHBondContact OD2-CB 3.24Å; L369-Q371 VanDerWaalsContact C-N 3.28Å; L369-Q371 PolarHBondContact O-N 2.87Å; L369-Y372 CarbonylContact O-C 3.52Å; L369-Y372 WeakPolarHBondContact O-CA 3.39Å; L369-Y372 WeakPolarHBondContact O-CB 3.13Å; L369-Y372 PolarHBondContact O-N 2.87Å; L369-E373 WeakPolarHBondContact O-CG 3.3Å; L369-E373 PolarHBondContact O-N 3.02Å
370	R	79.4	Confident	80.5	Confident	22 Å²	22	83.9 Å²	83.9	8%	0.083	40%	0.404	C	S	.	.	H	α-helix	trans	-65	-32.9	179.3	-171.7	54.3	167.4	166.8	4.6	111.9	E345 Y348 I364 D367 E373 K374	E345-R370 IonicContact OE1-CZ 3.75Å; E345-R370 IonicContact OE1-NH1 2.71Å; E345-R370 IonicContact OE1-NH2 3.81Å; E345-R370 PolarHBondContact OE1-NH2 3.01Å; Y348-R370 HydrophobicContact CE1-CG 4.29Å; I364-R370 WeakPolarHBondContact O-CB 3.06Å; D367-R370 PolarHBondContact O-N 3.41Å; D367-R370 VanDerWaalsContact O-N 3.14Å; R370-E373 VanDerWaalsContact CD-OE2 3.25Å; R370-E373 WeakPolarHBondContact CD-OE2 3.38Å; R370-E373 IonicContact CZ-OE2 3.82Å; R370-E373 IonicContact NH1-OE2 2.82Å; R370-E373 PolarHBondContact NH1-OE2 3.04Å; R370-K374 HydrophobicContact CG-CD 4.38Å; R370-K374 WeakPolarHBondContact O-CB 3.44Å; R370-K374 VanDerWaalsContact O-CG 3.26Å; R370-K374 WeakPolarHBondContact O-CG 3.2Å; R370-K374 PolarHBondContact O-N 3.32Å
371	Q	82.5	Confident	81.4	Confident	90 Å²	90	81.5 Å²	81.5	42%	0.421	39%	0.391	S	S	.	.	H	α-helix	trans	-64.6	-41.4	169.8	-69.4	-175.8	37.3	0	0	112.2	N366 D367 L369 K375	N366-Q371 PolarHBondContact O-NE2 3.11Å; D367-Q371 WeakPolarHBondContact O-CG 3.41Å; D367-Q371 PolarHBondContact O-N 2.74Å; L369-Q371 VanDerWaalsContact C-N 3.28Å; L369-Q371 PolarHBondContact O-N 2.87Å; Q371-K375 WeakPolarHBondContact O-CB 3.22Å; Q371-K375 VanDerWaalsContact O-CG 3.25Å; Q371-K375 WeakPolarHBondContact O-CG 2.78Å; Q371-K375 PolarHBondContact O-N 2.72Å
372	Y	85.2	Confident	82.3	Confident	154 Å²	154	84 Å²	84	60%	0.604	40%	0.404	S	S	*	.	H	α-helix	trans	-65.2	-43.3	175.6	176.4	-96.6	0	0	0	112.1	E368 L369 K375 K376	E368-Y372 WeakPolarHBondContact O-CB 3.3Å; E368-Y372 PolarHBondContact O-N 2.69Å; L369-Y372 CarbonylContact O-C 3.52Å; L369-Y372 WeakPolarHBondContact O-CA 3.39Å; L369-Y372 WeakPolarHBondContact O-CB 3.13Å; L369-Y372 PolarHBondContact O-N 2.87Å; Y372-K375 PolarHBondContact O-N 2.96Å; Y372-K376 WeakPolarHBondContact O-CB 3.04Å; Y372-K376 PolarHBondContact O-N 3.2Å
373	E	84.6	Confident	83.4	Confident	27 Å²	27	79.6 Å²	79.6	13%	0.126	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-51.3	174	-67.8	178.7	173.9	0	0	111.8	L342 Y348 L369 R370 K375 K376 K377	L342-E373 HydrophobicContact CD2-CB 3.92Å; L342-E373 HydrophobicContact CD2-CG 3.67Å; Y348-E373 PolarHBondContact OH-OE2 3.45Å; Y348-E373 VanDerWaalsContact OH-OE2 3.11Å; L369-E373 WeakPolarHBondContact O-CG 3.3Å; L369-E373 PolarHBondContact O-N 3.02Å; R370-E373 VanDerWaalsContact CD-OE2 3.25Å; R370-E373 WeakPolarHBondContact CD-OE2 3.38Å; R370-E373 IonicContact CZ-OE2 3.82Å; R370-E373 IonicContact NH1-OE2 2.82Å; R370-E373 PolarHBondContact NH1-OE2 3.04Å; E373-K375 VanDerWaalsContact C-N 3.32Å; E373-K375 PolarHBondContact O-N 2.69Å; E373-K376 WeakPolarHBondContact O-CB 3.35Å; E373-K376 PolarHBondContact O-N 3Å; E373-K376 VanDerWaalsContact O-N 3.07Å; E373-K377 PolarHBondContact O-N 3.03Å
374	K	83.2	Confident	84.4	Confident	95 Å²	95	74.5 Å²	74.5	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-55.5	-46.4	175.4	-75.7	169.4	177.4	170.4	0	111.1	Q365 R370 K376 K377 V378	Q365-K374 PolarHBondContact O-NZ 2.71Å; Q365-K374 VanDerWaalsContact O-NZ 3.13Å; R370-K374 HydrophobicContact CG-CD 4.38Å; R370-K374 WeakPolarHBondContact O-CB 3.44Å; R370-K374 VanDerWaalsContact O-CG 3.26Å; R370-K374 WeakPolarHBondContact O-CG 3.2Å; R370-K374 PolarHBondContact O-N 3.32Å; K374-K376 VanDerWaalsContact C-N 3.34Å; K374-K376 PolarHBondContact O-N 3.46Å; K374-K377 PolarHBondContact O-N 3.18Å; K374-V378 WeakPolarHBondContact O-CB 3.46Å; K374-V378 VanDerWaalsContact O-CG2 3.32Å; K374-V378 WeakPolarHBondContact O-CG2 3.1Å; K374-V378 PolarHBondContact O-N 2.93Å
375	K	87.4	Confident	85.3	Confident	140 Å²	140	73.1 Å²	73.1	61%	0.609	34%	0.344	S	S	*	.	H	α-helix	trans	-60.9	-39.8	175.6	-76.1	170.2	-179.8	173.8	0	112.3	Q371 Y372 E373 Q379	Q371-K375 WeakPolarHBondContact O-CB 3.22Å; Q371-K375 VanDerWaalsContact O-CG 3.25Å; Q371-K375 WeakPolarHBondContact O-CG 2.78Å; Q371-K375 PolarHBondContact O-N 2.72Å; Y372-K375 PolarHBondContact O-N 2.96Å; E373-K375 VanDerWaalsContact C-N 3.32Å; E373-K375 PolarHBondContact O-N 2.69Å; K375-Q379 WeakPolarHBondContact O-CB 3.47Å; K375-Q379 PolarHBondContact O-N 3.24Å
376	K	86.7	Confident	86.4	Confident	74 Å²	74	72.5 Å²	72.5	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-42.8	177.3	-169.9	-173	173.2	-156.6	0	112	L340 L342 Y372 E373 K374 Q379 A380	L340-K376 HydrophobicContact CD2-CG 4.33Å; L340-K376 PolarHBondContact O-NZ 3.2Å; L342-K376 HydrophobicContact CD1-CB 4.23Å; L342-K376 HydrophobicContact CD1-CD 4.21Å; L342-K376 HydrophobicContact CD1-CG 4.36Å; Y372-K376 WeakPolarHBondContact O-CB 3.04Å; Y372-K376 PolarHBondContact O-N 3.2Å; E373-K376 WeakPolarHBondContact O-CB 3.35Å; E373-K376 PolarHBondContact O-N 3Å; E373-K376 VanDerWaalsContact O-N 3.07Å; K374-K376 VanDerWaalsContact C-N 3.34Å; K374-K376 PolarHBondContact O-N 3.46Å; K376-Q379 PolarHBondContact O-N 2.87Å; K376-A380 PolarHBondContact O-N 3.09Å
377	K	86.8	Confident	87.3	Confident	62 Å²	62	67 Å²	67	27%	0.27	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-55.5	172.9	-179	174.1	172.2	176.8	0	110.6	L342 E373 K374 Q379 A380 E381 E417	L342-K377 HydrophobicContact CD1-CB 4.11Å; E373-K377 PolarHBondContact O-N 3.03Å; K374-K377 PolarHBondContact O-N 3.18Å; K377-Q379 VanDerWaalsContact C-N 3.28Å; K377-Q379 PolarHBondContact O-N 3.38Å; K377-A380 WeakPolarHBondContact O-CB 3.46Å; K377-A380 PolarHBondContact O-N 2.89Å; K377-E381 WeakPolarHBondContact CE-OE1 3.13Å; K377-E381 HydrophobicContact CG-CG 4.43Å; K377-E381 WeakPolarHBondContact CG-OE1 3.28Å; K377-E381 WeakPolarHBondContact O-CG 3.47Å; K377-E381 PolarHBondContact O-N 2.62Å; K377-E417 WeakPolarHBondContact CE-OE2 3.18Å; K377-E417 IonicContact NZ-OE2 3.72Å; K377-E417 PolarHBondContact NZ-OE2 3.29Å
378	V	87.6	Confident	87.8	Confident	72 Å²	72	63.3 Å²	63.3	44%	0.436	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-36.4	178.3	171.4	0	0	0	0	112.4	K374 N382	K374-V378 WeakPolarHBondContact O-CB 3.46Å; K374-V378 VanDerWaalsContact O-CG2 3.32Å; K374-V378 WeakPolarHBondContact O-CG2 3.1Å; K374-V378 PolarHBondContact O-N 2.93Å; V378-N382 WeakPolarHBondContact CG1-ND2 3.32Å; V378-N382 WeakPolarHBondContact O-CB 3.31Å; V378-N382 PolarHBondContact O-N 2.94Å; V378-N382 PolarHBondContact O-ND2 3.36Å
379	Q	89.3	Confident	88.1	Confident	109 Å²	109	59.4 Å²	59.4	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-65.7	-43.7	174.9	177.2	168.6	61.9	0	0	112.2	K375 K376 K377 N382 F383	K375-Q379 WeakPolarHBondContact O-CB 3.47Å; K375-Q379 PolarHBondContact O-N 3.24Å; K376-Q379 PolarHBondContact O-N 2.87Å; K377-Q379 VanDerWaalsContact C-N 3.28Å; K377-Q379 PolarHBondContact O-N 3.38Å; Q379-N382 PolarHBondContact O-N 3.06Å; Q379-F383 HydrophobicContact CG-CD2 3.93Å; Q379-F383 HydrophobicContact CG-CE2 3.45Å; Q379-F383 VanDerWaalsContact CG-CE2 3.45Å; Q379-F383 HydrophobicContact CG-CZ 4.2Å; Q379-F383 WeakPolarHBondContact O-CD2 3.19Å; Q379-F383 PolarHBondContact O-N 2.96Å
380	A	90.2	Very high	88.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-47	175.2	0	0	0	0	0	112	T309 L340 K376 K377 N382 F383 I384 Y415	T309-A380 HydrophobicContact CG2-CB 3.82Å; L340-A380 HydrophobicContact CD1-CB 3.65Å; L340-A380 HydrophobicContact CD2-CB 4.04Å; L340-A380 HydrophobicContact CG-CB 4.39Å; K376-A380 PolarHBondContact O-N 3.09Å; K377-A380 WeakPolarHBondContact O-CB 3.46Å; K377-A380 PolarHBondContact O-N 2.89Å; A380-N382 VanDerWaalsContact C-N 3.32Å; A380-N382 PolarHBondContact O-N 3.25Å; A380-F383 PolarHBondContact O-N 3.27Å; A380-F383 VanDerWaalsContact O-N 3.13Å; A380-I384 WeakPolarHBondContact O-CG1 3.23Å; A380-I384 PolarHBondContact O-N 3.14Å; A380-Y415 HydrophobicContact CB-CE1 4.24Å
381	E	90	Very high	89.1	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-44.8	176.3	-66.9	175.6	-170.8	0	0	111.8	K377 F383 I384 K385 I418	K377-E381 WeakPolarHBondContact CE-OE1 3.13Å; K377-E381 HydrophobicContact CG-CG 4.43Å; K377-E381 WeakPolarHBondContact CG-OE1 3.28Å; K377-E381 WeakPolarHBondContact O-CG 3.47Å; K377-E381 PolarHBondContact O-N 2.62Å; E381-F383 VanDerWaalsContact C-N 3.35Å; E381-F383 PolarHBondContact O-N 3.06Å; E381-I384 PolarHBondContact O-N 3.29Å; E381-K385 WeakPolarHBondContact O-CB 3.45Å; E381-K385 VanDerWaalsContact O-CG 3.29Å; E381-K385 WeakPolarHBondContact O-CG 3.11Å; E381-K385 PolarHBondContact O-N 3.37Å; E381-K385 IonicContact OE2-NZ 3.05Å; E381-I418 HydrophobicContact CB-CD1 3.74Å; E381-I418 HydrophobicContact CB-CG1 4.23Å; E381-I418 HydrophobicContact CG-CD1 3.68Å; E381-I418 HydrophobicContact CG-CG1 3.96Å
382	N	90.8	Very high	89.4	Confident	56 Å²	56	51.9 Å²	51.9	30%	0.299	24%	0.238	S	C	.	.	H	α-helix	trans	-61.9	-40.4	176.2	-84.1	-59.1	0	0	0	112.1	V378 Q379 A380 K385 M386	V378-N382 WeakPolarHBondContact CG1-ND2 3.32Å; V378-N382 WeakPolarHBondContact O-CB 3.31Å; V378-N382 PolarHBondContact O-N 2.94Å; V378-N382 PolarHBondContact O-ND2 3.36Å; Q379-N382 PolarHBondContact O-N 3.06Å; A380-N382 VanDerWaalsContact C-N 3.32Å; A380-N382 PolarHBondContact O-N 3.25Å; N382-K385 PolarHBondContact O-N 3.39Å; N382-M386 WeakPolarHBondContact O-CB 3.28Å; N382-M386 WeakPolarHBondContact O-CE 3.49Å; N382-M386 VanDerWaalsContact O-CG 3.25Å; N382-M386 WeakPolarHBondContact O-CG 3.27Å; N382-M386 PolarHBondContact O-N 3.43Å
383	F	92	Very high	89.6	Confident	28 Å²	28	47.5 Å²	47.5	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-40.1	173.8	-74	-49.6	0	0	0	112.3	K310 F313 Q379 A380 E381 M386 A387	K310-F383 HydrophobicContact CB-CE2 3.99Å; K310-F383 HydrophobicContact CB-CZ 4.23Å; K310-F383 HydrophobicContact CG-CE2 4.41Å; K310-F383 HydrophobicContact CG-CZ 4.16Å; F313-F383 HydrophobicContact CB-CB 4.21Å; F313-F383 HydrophobicContact CB-CD1 3.92Å; F313-F383 HydrophobicContact CB-CG 4.2Å; F313-F383 AromaticContact CD1-CD1 3.84Å; F313-F383 HydrophobicContact CD1-CD1 3.84Å; F313-F383 HydrophobicContact CD1-CE1 4.1Å; F313-F383 HydrophobicContact CD2-CB 4.44Å; F313-F383 HydrophobicContact CD2-CD1 4.15Å; F313-F383 WeakPolarHBondContact CD2-O 3.41Å; F313-F383 HydrophobicContact CE1-CD1 4.42Å; F313-F383 HydrophobicContact CG-CB 4.44Å; F313-F383 AromaticContact CG-CD1 3.68Å; F313-F383 HydrophobicContact CG-CD1 3.68Å; F313-F383 HydrophobicContact CG-CE1 4.37Å; F313-F383 HydrophobicContact CG-CG 4.37Å; Q379-F383 HydrophobicContact CG-CD2 3.93Å; Q379-F383 HydrophobicContact CG-CE2 3.45Å; Q379-F383 VanDerWaalsContact CG-CE2 3.45Å; Q379-F383 HydrophobicContact CG-CZ 4.2Å; Q379-F383 WeakPolarHBondContact O-CD2 3.19Å; Q379-F383 PolarHBondContact O-N 2.96Å; A380-F383 PolarHBondContact O-N 3.27Å; A380-F383 VanDerWaalsContact O-N 3.13Å; E381-F383 VanDerWaalsContact C-N 3.35Å; E381-F383 PolarHBondContact O-N 3.06Å; F383-M386 HydrophobicContact CD1-CE 3.65Å; F383-M386 HydrophobicContact CE1-CE 4.1Å; F383-A387 WeakPolarHBondContact O-CB 3.32Å; F383-A387 PolarHBondContact O-N 2.95Å
384	I	92.5	Very high	89.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-47.1	176.5	-66.3	162.7	0	0	0	110.9	F332 L335 L336 A380 E381 M386 A387 A388 V410 Y415 I418	F332-I384 HydrophobicContact CE2-CG2 4.36Å; F332-I384 HydrophobicContact CZ-CG2 4.37Å; L335-I384 HydrophobicContact CD2-CG1 4.01Å; L335-I384 HydrophobicContact CG-CG1 4.03Å; L336-I384 HydrophobicContact CD2-CD1 4.19Å; L336-I384 HydrophobicContact CD2-CG1 4.39Å; L336-I384 HydrophobicContact CD2-CG2 3.88Å; A380-I384 WeakPolarHBondContact O-CG1 3.23Å; A380-I384 PolarHBondContact O-N 3.14Å; E381-I384 PolarHBondContact O-N 3.29Å; I384-M386 PolarHBondContact O-N 2.76Å; I384-A387 WeakPolarHBondContact O-CB 3.39Å; I384-A387 PolarHBondContact O-N 3.05Å; I384-A388 WeakPolarHBondContact O-CB 3.42Å; I384-A388 PolarHBondContact O-N 3.4Å; I384-V410 HydrophobicContact CG2-CG2 4.33Å; I384-Y415 HydrophobicContact CD1-CD1 3.64Å; I384-Y415 HydrophobicContact CD1-CD2 3.58Å; I384-Y415 HydrophobicContact CD1-CE1 3.76Å; I384-Y415 HydrophobicContact CD1-CE2 3.72Å; I384-Y415 HydrophobicContact CD1-CG 3.54Å; I384-I418 HydrophobicContact CB-CD1 4.06Å; I384-I418 HydrophobicContact CD1-CD1 4.04Å; I384-I418 HydrophobicContact CG2-CD1 4.04Å
385	K	91	Very high	90	Very high	36 Å²	36	44 Å²	44	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-47.4	175.5	-71.6	169.4	-179	175.2	0	111.5	E381 N382 A388 K389 I418 D421	E381-K385 WeakPolarHBondContact O-CB 3.45Å; E381-K385 VanDerWaalsContact O-CG 3.29Å; E381-K385 WeakPolarHBondContact O-CG 3.11Å; E381-K385 PolarHBondContact O-N 3.37Å; E381-K385 IonicContact OE2-NZ 3.05Å; N382-K385 PolarHBondContact O-N 3.39Å; K385-A388 PolarHBondContact O-N 2.96Å; K385-K389 WeakPolarHBondContact O-CG 3.49Å; K385-K389 PolarHBondContact O-N 3.45Å; K385-K389 VanDerWaalsContact O-N 3.08Å; K385-I418 HydrophobicContact CD-CG2 4.35Å; K385-I418 HydrophobicContact CG-CG2 3.65Å; K385-D421 WeakPolarHBondContact CE-OD2 3.06Å; K385-D421 IonicContact NZ-OD2 2.67Å; K385-D421 PolarHBondContact NZ-OD2 3.39Å
386	M	91.9	Very high	89.9	Confident	71 Å²	71	40.3 Å²	40.3	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-65.4	-40.8	176.3	-71.8	-173.4	-63.4	0	0	112.5	F313 N382 F383 I384 K389 I390	F313-M386 HydrophobicContact CE2-CB 3.64Å; F313-M386 HydrophobicContact CZ-CB 4.15Å; F313-M386 HydrophobicContact CZ-CE 4.4Å; N382-M386 WeakPolarHBondContact O-CB 3.28Å; N382-M386 WeakPolarHBondContact O-CE 3.49Å; N382-M386 VanDerWaalsContact O-CG 3.25Å; N382-M386 WeakPolarHBondContact O-CG 3.27Å; N382-M386 PolarHBondContact O-N 3.43Å; F383-M386 HydrophobicContact CD1-CE 3.65Å; F383-M386 HydrophobicContact CE1-CE 4.1Å; I384-M386 PolarHBondContact O-N 2.76Å; M386-K389 PolarHBondContact O-N 2.71Å; M386-I390 WeakPolarHBondContact O-CD1 3.48Å; M386-I390 VanDerWaalsContact O-CG1 3.3Å; M386-I390 WeakPolarHBondContact O-CG1 3.3Å; M386-I390 PolarHBondContact O-N 3Å; M386-I390 VanDerWaalsContact O-N 3.1Å
387	A	93	Very high	89.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-50.3	175.7	0	0	0	0	0	111.1	F313 I316 F332 L335 F383 I384 K389 I390 I391	F313-A387 HydrophobicContact CD2-CB 4.12Å; I316-A387 HydrophobicContact CD1-CB 3.88Å; I316-A387 HydrophobicContact CG2-CB 4.43Å; F332-A387 HydrophobicContact CD2-CB 4.01Å; F332-A387 HydrophobicContact CE2-CB 4.01Å; L335-A387 HydrophobicContact CD2-CB 3.87Å; F383-A387 WeakPolarHBondContact O-CB 3.32Å; F383-A387 PolarHBondContact O-N 2.95Å; I384-A387 WeakPolarHBondContact O-CB 3.39Å; I384-A387 PolarHBondContact O-N 3.05Å; A387-K389 PolarHBondContact O-N 3.03Å; A387-I390 PolarHBondContact O-N 3.35Å; A387-I391 HydrophobicContact CB-CD1 4.2Å; A387-I391 VanDerWaalsContact O-CB 3.25Å; A387-I391 WeakPolarHBondContact O-CB 3.18Å; A387-I391 VanDerWaalsContact O-CD1 3.31Å; A387-I391 WeakPolarHBondContact O-CD1 3.45Å; A387-I391 WeakPolarHBondContact O-CG1 3.42Å; A387-I391 PolarHBondContact O-N 3.07Å
388	A	93	Very high	89.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-45.4	178.2	0	0	0	0	0	112	F332 I384 K385 I390 I391 A392 C406 L422	F332-A388 HydrophobicContact CE2-CB 4.09Å; F332-A388 HydrophobicContact CZ-CB 4.1Å; I384-A388 WeakPolarHBondContact O-CB 3.42Å; I384-A388 PolarHBondContact O-N 3.4Å; K385-A388 PolarHBondContact O-N 2.96Å; A388-I390 PolarHBondContact O-N 3.19Å; A388-I391 PolarHBondContact O-N 3.09Å; A388-A392 WeakPolarHBondContact O-CB 3.4Å; A388-A392 PolarHBondContact O-N 3.08Å; A388-C406 HydrophobicContact CB-CB 4.26Å; A388-L422 HydrophobicContact CB-CD1 4.18Å; A388-L422 HydrophobicContact CB-CD2 3.49Å; A388-L422 VanDerWaalsContact CB-CD2 3.49Å
389	K	90.4	Very high	89.7	Confident	83 Å²	83	41.4 Å²	41.4	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-58.4	-42.1	176.5	-75.3	178	-177.3	-173.4	0	113.9	K385 M386 A387 P393 D425	K385-K389 WeakPolarHBondContact O-CG 3.49Å; K385-K389 PolarHBondContact O-N 3.45Å; K385-K389 VanDerWaalsContact O-N 3.08Å; M386-K389 PolarHBondContact O-N 2.71Å; A387-K389 PolarHBondContact O-N 3.03Å; K389-P393 VanDerWaalsContact O-CD 3.28Å; K389-P393 WeakPolarHBondContact O-CD 3.27Å; K389-D425 WeakPolarHBondContact CE-OD1 3.49Å; K389-D425 WeakPolarHBondContact CE-OD2 3.3Å; K389-D425 IonicContact NZ-OD1 2.62Å; K389-D425 PolarHBondContact NZ-OD1 2.81Å; K389-D425 IonicContact NZ-OD2 3.49Å; K389-D425 PolarHBondContact NZ-OD2 3.39Å; K389-D425 VanDerWaalsContact NZ-OD2 3.08Å
390	I	90.7	Very high	89.7	Confident	53 Å²	53	37.3 Å²	37.3	27%	0.272	20%	0.201	S	C	.	.	H	α-helix	trans	-70.4	-42.1	179.1	-69	165.6	0	0	0	110.6	F313 V317 F320 M386 A387 A388	F313-I390 HydrophobicContact CE2-CD1 4.03Å; F313-I390 HydrophobicContact CZ-CD1 4.04Å; V317-I390 HydrophobicContact CG2-CD1 4.34Å; F320-I390 HydrophobicContact CB-CG2 4.24Å; F320-I390 HydrophobicContact CD1-CG2 4.16Å; F320-I390 HydrophobicContact CD2-CG2 3.45Å; F320-I390 VanDerWaalsContact CD2-CG2 3.45Å; F320-I390 HydrophobicContact CE1-CG2 4.39Å; F320-I390 HydrophobicContact CE2-CG2 3.7Å; F320-I390 WeakPolarHBondContact CE2-O 3.37Å; F320-I390 HydrophobicContact CG-CG2 3.69Å; F320-I390 HydrophobicContact CZ-CG2 4.17Å; M386-I390 WeakPolarHBondContact O-CD1 3.48Å; M386-I390 VanDerWaalsContact O-CG1 3.3Å; M386-I390 WeakPolarHBondContact O-CG1 3.3Å; M386-I390 PolarHBondContact O-N 3Å; M386-I390 VanDerWaalsContact O-N 3.1Å; A387-I390 PolarHBondContact O-N 3.35Å; A388-I390 PolarHBondContact O-N 3.19Å
391	I	91.3	Very high	89.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-83.7	-41.8	-168.2	-67.2	166.3	0	0	0	112.5	I316 M328 F332 A387 A388 V394 I395	I316-I391 HydrophobicContact CB-CD1 4.28Å; I316-I391 HydrophobicContact CD1-CD1 3.91Å; I316-I391 HydrophobicContact CG1-CD1 4.06Å; I316-I391 HydrophobicContact CG2-CD1 3.28Å; I316-I391 HydrophobicContact CG2-CG1 3.59Å; M328-I391 HydrophobicContact CB-CG2 4.29Å; F332-I391 HydrophobicContact CB-CD1 4.08Å; F332-I391 HydrophobicContact CD2-CD1 3.82Å; F332-I391 HydrophobicContact CG-CD1 4.25Å; A387-I391 HydrophobicContact CB-CD1 4.2Å; A387-I391 VanDerWaalsContact O-CB 3.25Å; A387-I391 WeakPolarHBondContact O-CB 3.18Å; A387-I391 VanDerWaalsContact O-CD1 3.31Å; A387-I391 WeakPolarHBondContact O-CD1 3.45Å; A387-I391 WeakPolarHBondContact O-CG1 3.42Å; A387-I391 PolarHBondContact O-N 3.07Å; A388-I391 PolarHBondContact O-N 3.09Å; I391-V394 PolarHBondContact O-N 3.23Å; I391-I395 HydrophobicContact CG2-CD1 3.13Å; I391-I395 HydrophobicContact CG2-CG1 3.3Å; I391-I395 PolarHBondContact O-N 3.05Å; I391-I395 VanDerWaalsContact O-N 3.11Å
392	A	89.8	Confident	89.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-54.7	-41.4	-171.3	0	0	0	0	0	114.5	A388 V394 G402 Y403	A388-A392 WeakPolarHBondContact O-CB 3.4Å; A388-A392 PolarHBondContact O-N 3.08Å; A392-V394 PolarHBondContact O-N 3.08Å; A392-G402 WeakPolarHBondContact O-CA 3.46Å; A392-Y403 HydrophobicContact CB-CD1 4.22Å; A392-Y403 HydrophobicContact CB-CD2 3.54Å; A392-Y403 HydrophobicContact CB-CE1 4.34Å; A392-Y403 HydrophobicContact CB-CE2 3.65Å; A392-Y403 HydrophobicContact CB-CG 3.82Å
393	P	88.3	Confident	89.7	Confident	62 Å²	62	36.1 Å²	36.1	40%	0.403	20%	0.197	S	C	.	.	H	α-helix	trans	-68.7	-12.1	177.4	-20.7	34.4	0	0	0	115.3	K389 F399	K389-P393 VanDerWaalsContact O-CD 3.28Å; K389-P393 WeakPolarHBondContact O-CD 3.27Å; P393-F399 HydrophobicContact CB-CB 4.43Å
394	V	88.9	Confident	89.7	Confident	43 Å²	43	37.5 Å²	37.5	26%	0.261	21%	0.206	S	C	.	.	H	α-helix	trans	-117.9	-24.4	-169.1	-179.1	0	0	0	0	113.7	F320 R325 M328 I391 A392	F320-V394 HydrophobicContact CD2-CG2 4.41Å; F320-V394 HydrophobicContact CE2-CB 4.24Å; F320-V394 HydrophobicContact CE2-CG2 3.61Å; F320-V394 HydrophobicContact CZ-CG2 4.36Å; R325-V394 PolarHBondContact NE-O 2.64Å; R325-V394 PolarHBondContact NH2-O 2.88Å; M328-V394 HydrophobicContact CE-CG1 3.86Å; I391-V394 PolarHBondContact O-N 3.23Å; A392-V394 PolarHBondContact O-N 3.08Å
395	I	87.6	Confident	89.8	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-63.2	175.2	-74.9	-177.8	0	0	0	111	R325 K329 I391 W405	R325-I395 VanDerWaalsContact CD-O 3.27Å; R325-I395 WeakPolarHBondContact CD-O 3.49Å; R325-I395 PolarHBondContact NE-O 3.49Å; K329-I395 HydrophobicContact CD-CG2 4.21Å; K329-I395 HydrophobicContact CG-CD1 3.76Å; K329-I395 HydrophobicContact CG-CG1 4.29Å; K329-I395 HydrophobicContact CG-CG2 4.1Å; I391-I395 HydrophobicContact CG2-CD1 3.13Å; I391-I395 HydrophobicContact CG2-CG1 3.3Å; I391-I395 PolarHBondContact O-N 3.05Å; I391-I395 VanDerWaalsContact O-N 3.11Å; I395-W405 HydrophobicContact CD1-CD2 4.35Å; I395-W405 HydrophobicContact CD1-CE3 3.56Å; I395-W405 HydrophobicContact CD1-CH2 4.38Å; I395-W405 HydrophobicContact CD1-CZ3 3.58Å
396	E	86.5	Confident	89.8	Confident	62 Å²	62	37.8 Å²	37.8	29%	0.29	21%	0.206	S	C	.	.	S	Bend	trans	-97.3	-178.7	-170.3	-66.5	-53.4	150.8	0	0	111	K329 N398 T401	K329-E396 WeakPolarHBondContact CE-OE1 3.47Å; K329-E396 IonicContact NZ-OE1 3.96Å; K329-E396 PolarHBondContact NZ-OE1 3.48Å; E396-N398 VanDerWaalsContact C-N 3.29Å; E396-T401 WeakPolarHBondContact CB-OG1 3.5Å
397	S	82.6	Confident	89.8	Confident	104 Å²	104	34.5 Å²	34.5	73%	0.727	19%	0.19	S	C	*	.	S	Bend	trans	-67.8	-30.7	172.9	60.2	0	0	0	0	113
398	N	87.1	Confident	89.7	Confident	91 Å²	91	38.6 Å²	38.6	49%	0.487	21%	0.212	S	C	.	.	S	Bend	trans	-126.1	140.7	-173.6	-58.8	31.7	0	0	0	108.7	E396 S400 T401 G402	E396-N398 VanDerWaalsContact C-N 3.29Å; N398-S400 VanDerWaalsContact C-N 3.28Å; N398-S400 PolarHBondContact O-N 3.3Å; N398-T401 PolarHBondContact O-N 3.2Å; N398-T401 PolarHBondContact O-OG1 3.11Å; N398-T401 VanDerWaalsContact O-OG1 3.07Å; N398-G402 PolarHBondContact O-N 3.3Å
399	F	87.1	Confident	89.7	Confident	36 Å²	36	41.9 Å²	41.9	16%	0.158	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-39.3	175.4	67.5	-78.2	0	0	0	111.8	P393 T401 G402 Y403 M429 F430 Q433	P393-F399 HydrophobicContact CB-CB 4.43Å; F399-T401 PolarHBondContact O-N 3.48Å; F399-G402 PolarHBondContact O-N 3.33Å; F399-Y403 HydrophobicContact CD2-CD2 4.48Å; F399-Y403 WeakPolarHBondContact O-CD2 3.47Å; F399-Y403 PolarHBondContact O-N 3.15Å; F399-M429 HydrophobicContact CD2-CB 3.99Å; F399-M429 HydrophobicContact CE2-CB 4.16Å; F399-F430 HydrophobicContact CE1-CE1 4.43Å; F399-F430 AromaticContact CE2-CD1 3.71Å; F399-F430 HydrophobicContact CE2-CD1 3.71Å; F399-F430 HydrophobicContact CE2-CD2 4.26Å; F399-F430 AromaticContact CE2-CE1 3.63Å; F399-F430 HydrophobicContact CE2-CE1 3.63Å; F399-F430 HydrophobicContact CE2-CE2 4.21Å; F399-F430 HydrophobicContact CE2-CG 4.02Å; F399-F430 AromaticContact CE2-CZ 3.89Å; F399-F430 HydrophobicContact CE2-CZ 3.89Å; F399-F430 AromaticContact CZ-CD1 3.42Å; F399-F430 HydrophobicContact CZ-CD1 3.42Å; F399-F430 VanDerWaalsContact CZ-CD1 3.42Å; F399-F430 AromaticContact CZ-CE1 3.31Å; F399-F430 HydrophobicContact CZ-CE1 3.31Å; F399-F430 HydrophobicContact CZ-CG 4.17Å; F399-F430 HydrophobicContact CZ-CZ 4.01Å; F399-Q433 VanDerWaalsContact CD1-NE2 3.32Å; F399-Q433 VanDerWaalsContact CE1-CD 3.47Å
400	S	88.2	Confident	89.7	Confident	23 Å²	23	38 Å²	38	16%	0.161	21%	0.21	C	C	.	.	H	α-helix	trans	-53.6	-55.2	178	178.9	0	0	0	0	111.6	N398 G402 Y403 D404 K426	N398-S400 VanDerWaalsContact C-N 3.28Å; N398-S400 PolarHBondContact O-N 3.3Å; S400-G402 VanDerWaalsContact C-N 3.25Å; S400-G402 PolarHBondContact O-N 3.01Å; S400-Y403 WeakPolarHBondContact O-CB 3.27Å; S400-Y403 PolarHBondContact O-N 3.24Å; S400-D404 VanDerWaalsContact C-OD2 3.32Å; S400-D404 PolarHBondContact O-N 3.32Å; S400-D404 PolarHBondContact OG-OD2 3.25Å; S400-D404 VanDerWaalsContact OG-OD2 3.11Å; S400-K426 WeakPolarHBondContact OG-CE 3.48Å; S400-K426 PolarHBondContact OG-NZ 3.28Å
401	T	90.3	Very high	89.6	Confident	61 Å²	61	40 Å²	40	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-67.1	-28.3	-177.4	52.9	0	0	0	0	112.4	E396 N398 F399 W405	E396-T401 WeakPolarHBondContact CB-OG1 3.5Å; N398-T401 PolarHBondContact O-N 3.2Å; N398-T401 PolarHBondContact O-OG1 3.11Å; N398-T401 VanDerWaalsContact O-OG1 3.07Å; F399-T401 PolarHBondContact O-N 3.48Å; T401-W405 WeakPolarHBondContact O-CB 3.41Å; T401-W405 PolarHBondContact O-N 3.42Å
402	G	91.1	Very high	89.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-39.5	169.5	0	0	0	0	0	113.6	A392 N398 F399 S400 C406	A392-G402 WeakPolarHBondContact O-CA 3.46Å; N398-G402 PolarHBondContact O-N 3.3Å; F399-G402 PolarHBondContact O-N 3.33Å; S400-G402 VanDerWaalsContact C-N 3.25Å; S400-G402 PolarHBondContact O-N 3.01Å; G402-C406 PolarHBondContact O-N 3.29Å; G402-C406 VanDerWaalsContact O-N 3.09Å; G402-C406 PolarHBondContact O-SG 3.41Å; G402-C406 VanDerWaalsContact O-SG 3.32Å
403	Y	91.4	Very high	89.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-46.5	171.8	-89.2	-83.1	0	0	0	110.7	A392 F399 S400 W405 C406 I407 D425 K426 M429	A392-Y403 HydrophobicContact CB-CD1 4.22Å; A392-Y403 HydrophobicContact CB-CD2 3.54Å; A392-Y403 HydrophobicContact CB-CE1 4.34Å; A392-Y403 HydrophobicContact CB-CE2 3.65Å; A392-Y403 HydrophobicContact CB-CG 3.82Å; F399-Y403 HydrophobicContact CD2-CD2 4.48Å; F399-Y403 WeakPolarHBondContact O-CD2 3.47Å; F399-Y403 PolarHBondContact O-N 3.15Å; S400-Y403 WeakPolarHBondContact O-CB 3.27Å; S400-Y403 PolarHBondContact O-N 3.24Å; Y403-W405 VanDerWaalsContact C-N 3.3Å; Y403-W405 PolarHBondContact O-N 3.42Å; Y403-C406 WeakPolarHBondContact O-CB 3.4Å; Y403-C406 PolarHBondContact O-N 3.32Å; Y403-I407 WeakPolarHBondContact O-CB 3.27Å; Y403-I407 VanDerWaalsContact O-CD1 3.32Å; Y403-I407 WeakPolarHBondContact O-CD1 3.13Å; Y403-I407 WeakPolarHBondContact O-CG1 3.4Å; Y403-I407 PolarHBondContact O-N 3.35Å; Y403-D425 HydrophobicContact CE1-CB 4.14Å; Y403-K426 HydrophobicContact CD1-CB 4.03Å; Y403-K426 HydrophobicContact CD2-CB 4.46Å; Y403-K426 HydrophobicContact CD2-CG 4.32Å; Y403-K426 HydrophobicContact CG-CB 3.95Å; Y403-K426 HydrophobicContact CG-CG 4.01Å; Y403-M429 HydrophobicContact CE2-CB 4.33Å; Y403-M429 HydrophobicContact CE2-CG 3.65Å; Y403-M429 WeakPolarHBondContact OH-CG 3.36Å
404	D	91.8	Very high	89.1	Confident	57 Å²	57	48.2 Å²	48.2	31%	0.305	26%	0.261	S	S	.	.	H	α-helix	trans	-55.8	-45.5	177.8	-64.1	-42	0	0	0	110.8	S400 C406 I407 D408 K426	S400-D404 VanDerWaalsContact C-OD2 3.32Å; S400-D404 PolarHBondContact O-N 3.32Å; S400-D404 PolarHBondContact OG-OD2 3.25Å; S400-D404 VanDerWaalsContact OG-OD2 3.11Å; D404-C406 PolarHBondContact O-N 2.97Å; D404-I407 PolarHBondContact O-N 3.29Å; D404-D408 PolarHBondContact O-N 3.32Å; D404-K426 IonicContact OD1-NZ 3.95Å; D404-K426 PolarHBondContact OD1-NZ 3.28Å; D404-K426 IonicContact OD2-NZ 2.64Å; D404-K426 PolarHBondContact OD2-NZ 2.84Å
405	W	92.9	Very high	88.8	Confident	43 Å²	43	46.8 Å²	46.8	16%	0.163	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-43.6	173.5	-176.3	84.6	0	0	0	113.3	K329 F332 Q333 I395 T401 Y403 H409	K329-W405 HydrophobicContact CB-CH2 3.69Å; K329-W405 HydrophobicContact CB-CZ2 3.76Å; K329-W405 HydrophobicContact CD-CH2 4.29Å; K329-W405 HydrophobicContact CD-CZ2 3.67Å; K329-W405 HydrophobicContact CG-CH2 3.67Å; K329-W405 HydrophobicContact CG-CZ2 3.59Å; K329-W405 HydrophobicContact CG-CZ3 4.18Å; F332-W405 HydrophobicContact CB-CZ3 4.43Å; F332-W405 HydrophobicContact CD1-CH2 4.17Å; F332-W405 AromaticContact CD1-CZ3 3.7Å; F332-W405 HydrophobicContact CD1-CZ3 3.7Å; F332-W405 HydrophobicContact CE1-CZ3 4.4Å; F332-W405 HydrophobicContact CG-CZ3 4.38Å; Q333-W405 HydrophobicContact CG-CH2 4.29Å; Q333-W405 HydrophobicContact CG-CZ2 4.47Å; I395-W405 HydrophobicContact CD1-CD2 4.35Å; I395-W405 HydrophobicContact CD1-CE3 3.56Å; I395-W405 HydrophobicContact CD1-CH2 4.38Å; I395-W405 HydrophobicContact CD1-CZ3 3.58Å; T401-W405 WeakPolarHBondContact O-CB 3.41Å; T401-W405 PolarHBondContact O-N 3.42Å; Y403-W405 VanDerWaalsContact C-N 3.3Å; Y403-W405 PolarHBondContact O-N 3.42Å; W405-H409 AromaticContact CD2-CD2 3.72Å; W405-H409 AromaticContact CE2-CD2 3.22Å; W405-H409 AromaticContact CH2-CD2 3.78Å; W405-H409 AromaticContact CZ2-CD2 3.28Å; W405-H409 WeakPolarHBondContact CZ2-CD2 3.47Å; W405-H409 AromaticContact NE1-CD2 3.49Å; W405-H409 PolarHBondContact NE1-CD2 3.11Å; W405-H409 PolarHBondContact O-CD2 3.2Å; W405-H409 VanDerWaalsContact O-CD2 3.32Å; W405-H409 PolarHBondContact O-N 3.09Å
406	C	92.4	Very high	88.5	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-43.6	176	-73.5	0	0	0	0	111.7	F332 A388 G402 Y403 D404 H409 V410	F332-C406 HydrophobicContact CE1-CB 4.07Å; F332-C406 HydrophobicContact CZ-CB 4.2Å; A388-C406 HydrophobicContact CB-CB 4.26Å; G402-C406 PolarHBondContact O-N 3.29Å; G402-C406 VanDerWaalsContact O-N 3.09Å; G402-C406 PolarHBondContact O-SG 3.41Å; G402-C406 VanDerWaalsContact O-SG 3.32Å; Y403-C406 WeakPolarHBondContact O-CB 3.4Å; Y403-C406 PolarHBondContact O-N 3.32Å; D404-C406 PolarHBondContact O-N 2.97Å; C406-H409 PolarHBondContact O-N 3.32Å; C406-V410 WeakPolarHBondContact O-CB 3.46Å; C406-V410 WeakPolarHBondContact O-CG2 3.03Å; C406-V410 PolarHBondContact O-N 3.21Å
407	I	91	Very high	88.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-46.2	-179.8	-71.1	157.1	0	0	0	110.5	Y403 D404 H409 V410 K411 A419 L422 E423	Y403-I407 WeakPolarHBondContact O-CB 3.27Å; Y403-I407 VanDerWaalsContact O-CD1 3.32Å; Y403-I407 WeakPolarHBondContact O-CD1 3.13Å; Y403-I407 WeakPolarHBondContact O-CG1 3.4Å; Y403-I407 PolarHBondContact O-N 3.35Å; D404-I407 PolarHBondContact O-N 3.29Å; I407-H409 VanDerWaalsContact C-N 3.34Å; I407-H409 PolarHBondContact O-N 2.87Å; I407-V410 PolarHBondContact O-N 3.24Å; I407-K411 HydrophobicContact CG2-CD 3.88Å; I407-K411 HydrophobicContact CG2-CG 4.41Å; I407-K411 WeakPolarHBondContact O-CB 3.38Å; I407-K411 WeakPolarHBondContact O-CG 3.39Å; I407-K411 PolarHBondContact O-N 3.49Å; I407-A419 HydrophobicContact CG2-CB 4.46Å; I407-L422 HydrophobicContact CD1-CB 4.45Å; I407-L422 HydrophobicContact CG1-CB 3.76Å; I407-E423 HydrophobicContact CD1-CB 4.36Å; I407-E423 HydrophobicContact CD1-CG 3.59Å; I407-E423 HydrophobicContact CG1-CG 4.17Å; I407-E423 HydrophobicContact CG2-CG 4.08Å
408	D	92.2	Very high	88.3	Confident	86 Å²	86	48.8 Å²	48.8	46%	0.46	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-41.3	178.8	-74.3	-15.8	0	0	0	111.9	D404 M412	D404-D408 PolarHBondContact O-N 3.32Å; D408-M412 WeakPolarHBondContact O-CG 3.28Å; D408-M412 PolarHBondContact O-N 2.91Å
409	H	91.6	Very high	88.3	Confident	69 Å²	69	44.5 Å²	44.5	32%	0.319	23%	0.226	S	C	.	.	H	α-helix	trans	-69.9	-35.1	175.3	-81.2	-60.9	0	0	0	113.4	Q333 L336 W405 C406 I407 M412	Q333-H409 PolarHBondContact NE2-NE2 2.98Å; L336-H409 HydrophobicContact CD1-CB 3.79Å; W405-H409 AromaticContact CD2-CD2 3.72Å; W405-H409 AromaticContact CE2-CD2 3.22Å; W405-H409 AromaticContact CH2-CD2 3.78Å; W405-H409 AromaticContact CZ2-CD2 3.28Å; W405-H409 WeakPolarHBondContact CZ2-CD2 3.47Å; W405-H409 AromaticContact NE1-CD2 3.49Å; W405-H409 PolarHBondContact NE1-CD2 3.11Å; W405-H409 PolarHBondContact O-CD2 3.2Å; W405-H409 VanDerWaalsContact O-CD2 3.32Å; W405-H409 PolarHBondContact O-N 3.09Å; C406-H409 PolarHBondContact O-N 3.32Å; I407-H409 VanDerWaalsContact C-N 3.34Å; I407-H409 PolarHBondContact O-N 2.87Å; H409-M412 PolarHBondContact O-N 3.04Å
410	V	91.3	Very high	88.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-41.8	175.6	171.6	0	0	0	0	110.7	F332 L336 I384 C406 I407 M412 S413 Y415 I418 A419 L422	F332-V410 HydrophobicContact CE1-CG2 4.21Å; F332-V410 HydrophobicContact CZ-CG2 3.98Å; L336-V410 HydrophobicContact CD1-CG2 4.18Å; L336-V410 HydrophobicContact CD2-CG2 3.87Å; I384-V410 HydrophobicContact CG2-CG2 4.33Å; C406-V410 WeakPolarHBondContact O-CB 3.46Å; C406-V410 WeakPolarHBondContact O-CG2 3.03Å; C406-V410 PolarHBondContact O-N 3.21Å; I407-V410 PolarHBondContact O-N 3.24Å; V410-M412 PolarHBondContact O-N 3.43Å; V410-S413 PolarHBondContact O-N 2.82Å; V410-S413 PolarHBondContact O-OG 3.08Å; V410-Y415 VanDerWaalsContact CG1-O 3.22Å; V410-Y415 WeakPolarHBondContact CG1-O 3.11Å; V410-I418 HydrophobicContact CG1-CB 3.98Å; V410-I418 HydrophobicContact CG1-CG2 4.39Å; V410-A419 HydrophobicContact CG1-CB 4.12Å; V410-L422 HydrophobicContact CB-CD1 4.25Å; V410-L422 HydrophobicContact CG1-CD1 4.33Å; V410-L422 HydrophobicContact CG2-CD1 3.64Å
411	K	89.1	Confident	88.1	Confident	95 Å²	95	46.2 Å²	46.2	41%	0.413	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-25.1	174.7	-74.5	171.1	179.1	164.6	0	113.8	I407 A419 E423	I407-K411 HydrophobicContact CG2-CD 3.88Å; I407-K411 HydrophobicContact CG2-CG 4.41Å; I407-K411 WeakPolarHBondContact O-CB 3.38Å; I407-K411 WeakPolarHBondContact O-CG 3.39Å; I407-K411 PolarHBondContact O-N 3.49Å; K411-A419 HydrophobicContact CD-CB 4.41Å; K411-A419 HydrophobicContact CG-CB 3.58Å; K411-E423 WeakPolarHBondContact CE-OE1 3.31Å; K411-E423 IonicContact NZ-OE1 2.87Å; K411-E423 PolarHBondContact NZ-OE1 2.97Å
412	M	88.1	Confident	87.9	Confident	149 Å²	149	43.3 Å²	43.3	73%	0.734	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	0.9	175.6	-64.8	175.9	-165.5	0	0	113.7	D408 H409 V410	D408-M412 WeakPolarHBondContact O-CG 3.28Å; D408-M412 PolarHBondContact O-N 2.91Å; H409-M412 PolarHBondContact O-N 3.04Å; V410-M412 PolarHBondContact O-N 3.43Å
413	S	86	Confident	87.7	Confident	23 Å²	23	44.7 Å²	44.7	16%	0.161	22%	0.222	C	C	.	.	S	Bend	trans	-109.3	171.8	-179.1	75.7	0	0	0	0	111.7	V410 Y415	V410-S413 PolarHBondContact O-N 2.82Å; V410-S413 PolarHBondContact O-OG 3.08Å; S413-Y415 PolarHBondContact O-N 3.32Å; S413-Y415 PolarHBondContact OG-N 3.37Å
414	S	83.1	Confident	87.4	Confident	63 Å²	63	45.2 Å²	45.2	44%	0.441	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-24	170.8	47.3	0	0	0	0	112.9	H416	S414-H416 PolarHBondContact O-N 2.74Å; S414-H416 VanDerWaalsContact O-N 3.08Å
415	Y	83	Confident	87.2	Confident	14 Å²	14	43.6 Å²	43.6	6%	0.055	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	32.2	-178.6	-57.3	-80.9	0	0	0	114.1	L336 V338 L340 A380 I384 V410 S413 E417 I418	L336-Y415 HydrophobicContact CD2-CD2 4.33Å; V338-Y415 PolarHBondContact O-OH 2.87Å; L340-Y415 HydrophobicContact CD1-CE1 3.97Å; L340-Y415 WeakPolarHBondContact CD1-OH 3.25Å; L340-Y415 WeakPolarHBondContact CG-OH 3.25Å; A380-Y415 HydrophobicContact CB-CE1 4.24Å; I384-Y415 HydrophobicContact CD1-CD1 3.64Å; I384-Y415 HydrophobicContact CD1-CD2 3.58Å; I384-Y415 HydrophobicContact CD1-CE1 3.76Å; I384-Y415 HydrophobicContact CD1-CE2 3.72Å; I384-Y415 HydrophobicContact CD1-CG 3.54Å; V410-Y415 VanDerWaalsContact CG1-O 3.22Å; V410-Y415 WeakPolarHBondContact CG1-O 3.11Å; S413-Y415 PolarHBondContact O-N 3.32Å; S413-Y415 PolarHBondContact OG-N 3.37Å; Y415-E417 PolarHBondContact O-N 2.99Å; Y415-E417 VanDerWaalsContact O-N 3.14Å; Y415-I418 HydrophobicContact CD1-CD1 3.98Å; Y415-I418 HydrophobicContact CG-CD1 4.14Å; Y415-I418 WeakPolarHBondContact O-CB 3.45Å; Y415-I418 PolarHBondContact O-N 2.8Å
416	H	82.7	Confident	87	Confident	113 Å²	113	42.5 Å²	42.5	52%	0.523	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.4	-174.2	65.6	77.6	0	0	0	113.5	S414 I418 A419	S414-H416 PolarHBondContact O-N 2.74Å; S414-H416 VanDerWaalsContact O-N 3.08Å; H416-I418 PolarHBondContact O-N 3.35Å; H416-A419 WeakPolarHBondContact O-CB 3.29Å; H416-A419 PolarHBondContact O-N 3.43Å; H416-A419 VanDerWaalsContact O-N 3.09Å
417	E	79.7	Confident	86.8	Confident	98 Å²	98	42.6 Å²	42.6	46%	0.458	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.2	176.8	-56	-175.9	120.7	0	0	112.2	K377 Y415 A419	K377-E417 WeakPolarHBondContact CE-OE2 3.18Å; K377-E417 IonicContact NZ-OE2 3.72Å; K377-E417 PolarHBondContact NZ-OE2 3.29Å; Y415-E417 PolarHBondContact O-N 2.99Å; Y415-E417 VanDerWaalsContact O-N 3.14Å; E417-A419 PolarHBondContact O-N 3.41Å
418	I	85.4	Confident	86.5	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-24.4	179.7	-55.5	-177.6	0	0	0	112.2	E381 I384 K385 V410 Y415 H416 H420 D421 L422	E381-I418 HydrophobicContact CB-CD1 3.74Å; E381-I418 HydrophobicContact CB-CG1 4.23Å; E381-I418 HydrophobicContact CG-CD1 3.68Å; E381-I418 HydrophobicContact CG-CG1 3.96Å; I384-I418 HydrophobicContact CB-CD1 4.06Å; I384-I418 HydrophobicContact CD1-CD1 4.04Å; I384-I418 HydrophobicContact CG2-CD1 4.04Å; K385-I418 HydrophobicContact CD-CG2 4.35Å; K385-I418 HydrophobicContact CG-CG2 3.65Å; V410-I418 HydrophobicContact CG1-CB 3.98Å; V410-I418 HydrophobicContact CG1-CG2 4.39Å; Y415-I418 HydrophobicContact CD1-CD1 3.98Å; Y415-I418 HydrophobicContact CG-CD1 4.14Å; Y415-I418 WeakPolarHBondContact O-CB 3.45Å; Y415-I418 PolarHBondContact O-N 2.8Å; H416-I418 PolarHBondContact O-N 3.35Å; I418-H420 PolarHBondContact O-N 3.19Å; I418-H420 VanDerWaalsContact O-N 3.13Å; I418-D421 PolarHBondContact O-N 3.08Å; I418-L422 HydrophobicContact CG2-CD1 3.99Å; I418-L422 HydrophobicContact CG2-CG 3.91Å; I418-L422 PolarHBondContact O-N 3.12Å
419	A	86.6	Confident	86.1	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-32.4	-173.2	0	0	0	0	0	112.7	I407 V410 K411 H416 E417 E423	I407-A419 HydrophobicContact CG2-CB 4.46Å; V410-A419 HydrophobicContact CG1-CB 4.12Å; K411-A419 HydrophobicContact CD-CB 4.41Å; K411-A419 HydrophobicContact CG-CB 3.58Å; H416-A419 WeakPolarHBondContact O-CB 3.29Å; H416-A419 PolarHBondContact O-N 3.43Å; H416-A419 VanDerWaalsContact O-N 3.09Å; E417-A419 PolarHBondContact O-N 3.41Å; A419-E423 WeakPolarHBondContact O-CG 3.46Å; A419-E423 PolarHBondContact O-N 3.04Å; A419-E423 VanDerWaalsContact O-N 3.08Å
420	H	85.2	Confident	85.9	Confident	39 Å²	39	39.4 Å²	39.4	18%	0.181	20%	0.199	C	C	.	.	H	α-helix	trans	-71.7	-41.6	176.7	-68.5	-33.8	0	0	0	112.9	I418 L422 E423 I424 F446 V453	I418-H420 PolarHBondContact O-N 3.19Å; I418-H420 VanDerWaalsContact O-N 3.13Å; H420-L422 VanDerWaalsContact C-N 3.27Å; H420-L422 PolarHBondContact O-N 3.29Å; H420-E423 IonicContact ND1-OE2 2.62Å; H420-E423 PolarHBondContact ND1-OE2 3.1Å; H420-E423 PolarHBondContact O-N 3.1Å; H420-I424 WeakPolarHBondContact O-CG1 3.11Å; H420-I424 PolarHBondContact O-N 2.98Å; H420-F446 HydrophobicContact CB-CE1 3.98Å; H420-F446 AromaticContact ND1-CE1 3.92Å; H420-F446 WeakPolarHBondContact O-CZ 3.48Å; H420-V453 HydrophobicContact CB-CG1 3.73Å; H420-V453 HydrophobicContact CB-CG2 3.93Å
421	D	85.3	Confident	85.4	Confident	56 Å²	56	41.2 Å²	41.2	30%	0.299	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-35.3	174.7	-63.7	-30.3	0	0	0	111.5	K385 I418 I424 D425	K385-D421 WeakPolarHBondContact CE-OD2 3.06Å; K385-D421 IonicContact NZ-OD2 2.67Å; K385-D421 PolarHBondContact NZ-OD2 3.39Å; I418-D421 PolarHBondContact O-N 3.08Å; D421-I424 PolarHBondContact O-N 2.93Å; D421-D425 WeakPolarHBondContact O-CB 3.41Å; D421-D425 PolarHBondContact O-N 3.48Å
422	L	86.8	Confident	85.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70	-35.3	174.7	-67.6	176.4	0	0	0	113.2	A388 I407 V410 I418 H420 I424 D425 K426	A388-L422 HydrophobicContact CB-CD1 4.18Å; A388-L422 HydrophobicContact CB-CD2 3.49Å; A388-L422 VanDerWaalsContact CB-CD2 3.49Å; I407-L422 HydrophobicContact CD1-CB 4.45Å; I407-L422 HydrophobicContact CG1-CB 3.76Å; V410-L422 HydrophobicContact CB-CD1 4.25Å; V410-L422 HydrophobicContact CG1-CD1 4.33Å; V410-L422 HydrophobicContact CG2-CD1 3.64Å; I418-L422 HydrophobicContact CG2-CD1 3.99Å; I418-L422 HydrophobicContact CG2-CG 3.91Å; I418-L422 PolarHBondContact O-N 3.12Å; H420-L422 VanDerWaalsContact C-N 3.27Å; H420-L422 PolarHBondContact O-N 3.29Å; L422-I424 VanDerWaalsContact C-N 3.34Å; L422-D425 PolarHBondContact O-N 3.03Å; L422-K426 WeakPolarHBondContact O-CB 3.45Å; L422-K426 PolarHBondContact O-N 2.86Å
423	E	86.4	Confident	85	Confident	28 Å²	28	42.6 Å²	42.6	13%	0.131	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-34.5	171.2	-76.7	171.7	175.8	0	0	111	I407 K411 A419 H420 K426 A427 F446 K449	I407-E423 HydrophobicContact CD1-CB 4.36Å; I407-E423 HydrophobicContact CD1-CG 3.59Å; I407-E423 HydrophobicContact CG1-CG 4.17Å; I407-E423 HydrophobicContact CG2-CG 4.08Å; K411-E423 WeakPolarHBondContact CE-OE1 3.31Å; K411-E423 IonicContact NZ-OE1 2.87Å; K411-E423 PolarHBondContact NZ-OE1 2.97Å; A419-E423 WeakPolarHBondContact O-CG 3.46Å; A419-E423 PolarHBondContact O-N 3.04Å; A419-E423 VanDerWaalsContact O-N 3.08Å; H420-E423 IonicContact ND1-OE2 2.62Å; H420-E423 PolarHBondContact ND1-OE2 3.1Å; H420-E423 PolarHBondContact O-N 3.1Å; E423-K426 WeakPolarHBondContact O-CB 3.42Å; E423-A427 PolarHBondContact O-N 2.91Å; E423-F446 HydrophobicContact CB-CE1 4Å; E423-F446 HydrophobicContact CB-CE2 3.94Å; E423-F446 HydrophobicContact CB-CZ 3.21Å; E423-F446 HydrophobicContact CG-CZ 4.35Å; E423-F446 WeakPolarHBondContact OE2-CE1 3.37Å; E423-K449 IonicContact OE2-NZ 3.88Å; E423-K449 PolarHBondContact OE2-NZ 3.37Å
424	I	85.5	Confident	84.8	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.062	24%	0.241	C	C	.	.	H	α-helix	trans	-70.4	-43.9	171.5	-67.2	172	0	0	0	110.9	H420 D421 L422 K426 A427 V428 L443 F446 V453 N460	H420-I424 WeakPolarHBondContact O-CG1 3.11Å; H420-I424 PolarHBondContact O-N 2.98Å; D421-I424 PolarHBondContact O-N 2.93Å; L422-I424 VanDerWaalsContact C-N 3.34Å; I424-K426 PolarHBondContact O-N 3.06Å; I424-A427 WeakPolarHBondContact O-CA 3.21Å; I424-A427 VanDerWaalsContact O-CB 3.3Å; I424-A427 WeakPolarHBondContact O-CB 3.43Å; I424-A427 PolarHBondContact O-N 3.06Å; I424-V428 PolarHBondContact O-N 3.2Å; I424-L443 HydrophobicContact CG1-CD2 4.24Å; I424-L443 HydrophobicContact CG2-CD2 4.49Å; I424-F446 HydrophobicContact CG1-CE1 4.24Å; I424-F446 HydrophobicContact CG1-CE2 4.1Å; I424-F446 HydrophobicContact CG1-CZ 3.67Å; I424-V453 HydrophobicContact CD1-CG1 4.29Å; I424-N460 WeakPolarHBondContact CG2-ND2 3.32Å
425	D	86.8	Confident	84.9	Confident	22 Å²	22	50.8 Å²	50.8	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-33.8	176.4	-75.9	-42.7	0	0	0	112.2	K389 Y403 D421 L422 V428 M429	K389-D425 WeakPolarHBondContact CE-OD1 3.49Å; K389-D425 WeakPolarHBondContact CE-OD2 3.3Å; K389-D425 IonicContact NZ-OD1 2.62Å; K389-D425 PolarHBondContact NZ-OD1 2.81Å; K389-D425 IonicContact NZ-OD2 3.49Å; K389-D425 PolarHBondContact NZ-OD2 3.39Å; K389-D425 VanDerWaalsContact NZ-OD2 3.08Å; Y403-D425 HydrophobicContact CE1-CB 4.14Å; D421-D425 WeakPolarHBondContact O-CB 3.41Å; D421-D425 PolarHBondContact O-N 3.48Å; L422-D425 PolarHBondContact O-N 3.03Å; D425-V428 PolarHBondContact O-N 3.11Å; D425-M429 WeakPolarHBondContact O-CG 3.25Å; D425-M429 PolarHBondContact O-N 3.43Å
426	K	89.5	Confident	85	Confident	21 Å²	21	53.2 Å²	53.2	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-44.4	170.5	-171.9	-168.2	-177.3	-173.7	0	111.5	S400 Y403 D404 L422 E423 I424 M429 F430	S400-K426 WeakPolarHBondContact OG-CE 3.48Å; S400-K426 PolarHBondContact OG-NZ 3.28Å; Y403-K426 HydrophobicContact CD1-CB 4.03Å; Y403-K426 HydrophobicContact CD2-CB 4.46Å; Y403-K426 HydrophobicContact CD2-CG 4.32Å; Y403-K426 HydrophobicContact CG-CB 3.95Å; Y403-K426 HydrophobicContact CG-CG 4.01Å; D404-K426 IonicContact OD1-NZ 3.95Å; D404-K426 PolarHBondContact OD1-NZ 3.28Å; D404-K426 IonicContact OD2-NZ 2.64Å; D404-K426 PolarHBondContact OD2-NZ 2.84Å; L422-K426 WeakPolarHBondContact O-CB 3.45Å; L422-K426 PolarHBondContact O-N 2.86Å; E423-K426 WeakPolarHBondContact O-CB 3.42Å; I424-K426 PolarHBondContact O-N 3.06Å; K426-M429 WeakPolarHBondContact O-CB 3.47Å; K426-M429 PolarHBondContact O-N 3.47Å; K426-M429 VanDerWaalsContact O-N 3.12Å; K426-F430 HydrophobicContact CD-CE2 4.27Å; K426-F430 HydrophobicContact CG-CD2 4.41Å; K426-F430 HydrophobicContact CG-CE2 3.9Å; K426-F430 VanDerWaalsContact O-CD2 3.22Å; K426-F430 WeakPolarHBondContact O-CD2 3.43Å; K426-F430 PolarHBondContact O-N 2.98Å; K426-F430 VanDerWaalsContact O-N 3.13Å
427	A	86.8	Confident	85.2	Confident	1 Å²	1	54 Å²	54	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-41.7	173.7	0	0	0	0	0	112.2	E423 I424 M429 F430 L431 T442 L443	E423-A427 PolarHBondContact O-N 2.91Å; I424-A427 WeakPolarHBondContact O-CA 3.21Å; I424-A427 VanDerWaalsContact O-CB 3.3Å; I424-A427 WeakPolarHBondContact O-CB 3.43Å; I424-A427 PolarHBondContact O-N 3.06Å; A427-M429 PolarHBondContact O-N 3.4Å; A427-F430 WeakPolarHBondContact O-CB 3.49Å; A427-F430 PolarHBondContact O-N 3.49Å; A427-F430 VanDerWaalsContact O-N 3.14Å; A427-L431 PolarHBondContact O-N 3.32Å; A427-T442 WeakPolarHBondContact CB-OG1 3.43Å; A427-L443 HydrophobicContact CB-CD1 4.13Å; A427-L443 HydrophobicContact CB-CD2 3.78Å; A427-L443 HydrophobicContact CB-CG 3.63Å
428	V	84.7	Confident	85.5	Confident	43 Å²	43	53.6 Å²	53.6	26%	0.261	25%	0.247	S	C	.	.	H	α-helix	trans	-64.3	-27.6	174.3	178.6	0	0	0	0	112.2	I424 D425 L431 K432	I424-V428 PolarHBondContact O-N 3.2Å; D425-V428 PolarHBondContact O-N 3.11Å; V428-L431 WeakPolarHBondContact O-CB 3.41Å; V428-K432 WeakPolarHBondContact O-CG 3.28Å; V428-K432 PolarHBondContact O-N 2.97Å
429	M	84.7	Confident	85.6	Confident	44 Å²	44	53.5 Å²	53.5	22%	0.217	25%	0.246	C	C	.	.	H	α-helix	trans	-76.4	-30	172.4	-68.1	-59.1	98	0	0	113.9	F399 Y403 D425 K426 A427 K432 Q433	F399-M429 HydrophobicContact CD2-CB 3.99Å; F399-M429 HydrophobicContact CE2-CB 4.16Å; Y403-M429 HydrophobicContact CE2-CB 4.33Å; Y403-M429 HydrophobicContact CE2-CG 3.65Å; Y403-M429 WeakPolarHBondContact OH-CG 3.36Å; D425-M429 WeakPolarHBondContact O-CG 3.25Å; D425-M429 PolarHBondContact O-N 3.43Å; K426-M429 WeakPolarHBondContact O-CB 3.47Å; K426-M429 PolarHBondContact O-N 3.47Å; K426-M429 VanDerWaalsContact O-N 3.12Å; A427-M429 PolarHBondContact O-N 3.4Å; M429-K432 HydrophobicContact CE-CD 3.8Å; M429-Q433 PolarHBondContact O-NE2 2.78Å; M429-Q433 VanDerWaalsContact O-NE2 3.11Å
430	F	87.4	Confident	85.6	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-43.1	169.2	-75.2	-68.5	0	0	0	110.7	F399 K426 A427 K432 Q433 R434 D435 Q438 A439 T442	F399-F430 HydrophobicContact CE1-CE1 4.43Å; F399-F430 AromaticContact CE2-CD1 3.71Å; F399-F430 HydrophobicContact CE2-CD1 3.71Å; F399-F430 HydrophobicContact CE2-CD2 4.26Å; F399-F430 AromaticContact CE2-CE1 3.63Å; F399-F430 HydrophobicContact CE2-CE1 3.63Å; F399-F430 HydrophobicContact CE2-CE2 4.21Å; F399-F430 HydrophobicContact CE2-CG 4.02Å; F399-F430 AromaticContact CE2-CZ 3.89Å; F399-F430 HydrophobicContact CE2-CZ 3.89Å; F399-F430 AromaticContact CZ-CD1 3.42Å; F399-F430 HydrophobicContact CZ-CD1 3.42Å; F399-F430 VanDerWaalsContact CZ-CD1 3.42Å; F399-F430 AromaticContact CZ-CE1 3.31Å; F399-F430 HydrophobicContact CZ-CE1 3.31Å; F399-F430 HydrophobicContact CZ-CG 4.17Å; F399-F430 HydrophobicContact CZ-CZ 4.01Å; K426-F430 HydrophobicContact CD-CE2 4.27Å; K426-F430 HydrophobicContact CG-CD2 4.41Å; K426-F430 HydrophobicContact CG-CE2 3.9Å; K426-F430 VanDerWaalsContact O-CD2 3.22Å; K426-F430 WeakPolarHBondContact O-CD2 3.43Å; K426-F430 PolarHBondContact O-N 2.98Å; K426-F430 VanDerWaalsContact O-N 3.13Å; A427-F430 WeakPolarHBondContact O-CB 3.49Å; A427-F430 PolarHBondContact O-N 3.49Å; A427-F430 VanDerWaalsContact O-N 3.14Å; F430-K432 PolarHBondContact O-N 3.27Å; F430-Q433 CarbonylContact O-C 3.55Å; F430-Q433 WeakPolarHBondContact O-CA 3.49Å; F430-Q433 PolarHBondContact O-N 3.44Å; F430-R434 PolarHBondContact O-N 3.09Å; F430-D435 HydrophobicContact CD1-CB 4.33Å; F430-D435 PolarHBondContact O-N 3.12Å; F430-D435 VanDerWaalsContact O-N 3.07Å; F430-Q438 HydrophobicContact CD1-CB 3.5Å; F430-Q438 HydrophobicContact CD1-CG 4.39Å; F430-Q438 HydrophobicContact CD2-CB 4.22Å; F430-Q438 HydrophobicContact CE1-CB 3.59Å; F430-Q438 HydrophobicContact CE1-CG 4.16Å; F430-Q438 HydrophobicContact CE2-CB 4.28Å; F430-Q438 HydrophobicContact CG-CB 3.86Å; F430-Q438 HydrophobicContact CZ-CB 3.99Å; F430-A439 HydrophobicContact CB-CB 3.85Å; F430-T442 HydrophobicContact CD2-CG2 4.47Å; F430-T442 HydrophobicContact CE2-CG2 3.98Å
431	L	81.6	Confident	85.7	Confident	38 Å²	38	56 Å²	56	20%	0.199	26%	0.261	C	S	.	.	H	α-helix	trans	-52.9	-49.1	172.8	-96.9	178.1	0	0	0	113.6	A427 V428 Q433 R434 F436 A439 L464	A427-L431 PolarHBondContact O-N 3.32Å; V428-L431 WeakPolarHBondContact O-CB 3.41Å; L431-Q433 PolarHBondContact O-N 3.18Å; L431-Q433 VanDerWaalsContact O-N 3.11Å; L431-R434 WeakPolarHBondContact O-CA 3.47Å; L431-R434 PolarHBondContact O-N 3.36Å; L431-F436 HydrophobicContact CD2-CD1 3.73Å; L431-F436 HydrophobicContact CD2-CE1 3.69Å; L431-A439 HydrophobicContact CG-CB 4.34Å; L431-L464 HydrophobicContact CD1-CD2 3.57Å; L431-L464 HydrophobicContact CD2-CD2 3.19Å; L431-L464 HydrophobicContact CG-CD2 3.49Å; L431-L464 VanDerWaalsContact CG-CD2 3.49Å
432	K	83.1	Confident	85.7	Confident	161 Å²	161	54.8 Å²	54.8	70%	0.7	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.5	178.6	-68.8	-170	-175.5	-158	0	114	V428 M429 F430	V428-K432 WeakPolarHBondContact O-CG 3.28Å; V428-K432 PolarHBondContact O-N 2.97Å; M429-K432 HydrophobicContact CE-CD 3.8Å; F430-K432 PolarHBondContact O-N 3.27Å
433	Q	85.2	Confident	85.7	Confident	111 Å²	111	54.9 Å²	54.9	52%	0.519	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	4	173.4	-70.9	170.8	69.8	0	0	112.8	F399 M429 F430 L431 D435	F399-Q433 VanDerWaalsContact CD1-NE2 3.32Å; F399-Q433 VanDerWaalsContact CE1-CD 3.47Å; M429-Q433 PolarHBondContact O-NE2 2.78Å; M429-Q433 VanDerWaalsContact O-NE2 3.11Å; F430-Q433 CarbonylContact O-C 3.55Å; F430-Q433 WeakPolarHBondContact O-CA 3.49Å; F430-Q433 PolarHBondContact O-N 3.44Å; L431-Q433 PolarHBondContact O-N 3.18Å; L431-Q433 VanDerWaalsContact O-N 3.11Å; Q433-D435 PolarHBondContact O-N 3.28Å
434	R	81.4	Confident	85.6	Confident	205 Å²	205	56.9 Å²	56.9	77%	0.774	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	25.7	-173.7	-59.9	-177.7	171.1	-167.4	-6.5	113.8	F430 L431 F436	F430-R434 PolarHBondContact O-N 3.09Å; L431-R434 WeakPolarHBondContact O-CA 3.47Å; L431-R434 PolarHBondContact O-N 3.36Å; R434-F436 HydrophobicContact CB-CE2 4.06Å; R434-F436 HydrophobicContact CB-CZ 4.43Å; R434-F436 WeakPolarHBondContact O-CD2 3.46Å; R434-F436 PolarHBondContact O-N 2.97Å
435	D	85.7	Confident	85.5	Confident	53 Å²	53	59.3 Å²	59.3	28%	0.283	28%	0.282	S	S	.	.			trans	-93.2	77	171.2	-166.8	-26.3	0	0	0	109.7	F430 Q433 H437 Q438 A439	F430-D435 HydrophobicContact CD1-CB 4.33Å; F430-D435 PolarHBondContact O-N 3.12Å; F430-D435 VanDerWaalsContact O-N 3.07Å; Q433-D435 PolarHBondContact O-N 3.28Å; D435-H437 VanDerWaalsContact C-N 3.29Å; D435-H437 PolarHBondContact O-N 3.36Å; D435-Q438 PolarHBondContact OD1-N 2.82Å; D435-Q438 VanDerWaalsContact OD1-N 3.13Å; D435-Q438 PolarHBondContact OD2-NE2 3.03Å; D435-A439 PolarHBondContact O-N 3.28Å
436	F	83.9	Confident	85.2	Confident	65 Å²	65	58.3 Å²	58.3	29%	0.285	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-35	-178	-58.3	-79.1	0	0	0	112.1	L431 R434 A439 I440 L464 L467 E468	L431-F436 HydrophobicContact CD2-CD1 3.73Å; L431-F436 HydrophobicContact CD2-CE1 3.69Å; R434-F436 HydrophobicContact CB-CE2 4.06Å; R434-F436 HydrophobicContact CB-CZ 4.43Å; R434-F436 WeakPolarHBondContact O-CD2 3.46Å; R434-F436 PolarHBondContact O-N 2.97Å; F436-A439 WeakPolarHBondContact O-CB 3.42Å; F436-A439 PolarHBondContact O-N 3Å; F436-I440 VanDerWaalsContact O-CG1 3.32Å; F436-I440 WeakPolarHBondContact O-CG1 3.34Å; F436-I440 PolarHBondContact O-N 3.3Å; F436-L464 HydrophobicContact CD1-CD2 4.48Å; F436-L467 HydrophobicContact CE1-CD1 4.39Å; F436-E468 HydrophobicContact CB-CG 4.31Å; F436-E468 VanDerWaalsContact CB-OE1 3.29Å; F436-E468 WeakPolarHBondContact CB-OE1 3.41Å
437	H	87.3	Confident	84.4	Confident	130 Å²	130	62 Å²	62	60%	0.602	29%	0.294	S	S	*	.	H	α-helix	trans	-65.1	-47.3	-176.1	-158.9	56.5	0	0	0	112	D435 A439 I440 D441	D435-H437 VanDerWaalsContact C-N 3.29Å; D435-H437 PolarHBondContact O-N 3.36Å; H437-A439 VanDerWaalsContact C-N 3.33Å; H437-A439 PolarHBondContact O-N 2.88Å; H437-I440 PolarHBondContact O-N 2.69Å; H437-D441 PolarHBondContact O-N 3.32Å
438	Q	86.6	Confident	83.8	Confident	90 Å²	90	73.4 Å²	73.4	42%	0.421	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-30.3	175.6	-67.1	-170.4	66.3	0	0	112.7	F430 D435 T442	F430-Q438 HydrophobicContact CD1-CB 3.5Å; F430-Q438 HydrophobicContact CD1-CG 4.39Å; F430-Q438 HydrophobicContact CD2-CB 4.22Å; F430-Q438 HydrophobicContact CE1-CB 3.59Å; F430-Q438 HydrophobicContact CE1-CG 4.16Å; F430-Q438 HydrophobicContact CE2-CB 4.28Å; F430-Q438 HydrophobicContact CG-CB 3.86Å; F430-Q438 HydrophobicContact CZ-CB 3.99Å; D435-Q438 PolarHBondContact OD1-N 2.82Å; D435-Q438 VanDerWaalsContact OD1-N 3.13Å; D435-Q438 PolarHBondContact OD2-NE2 3.03Å; Q438-T442 WeakPolarHBondContact O-CB 3.21Å; Q438-T442 WeakPolarHBondContact O-CG2 3.21Å; Q438-T442 PolarHBondContact O-N 3.15Å; Q438-T442 PolarHBondContact O-OG1 3.35Å
439	A	86.5	Confident	83.2	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-44.6	172.5	0	0	0	0	0	111.8	F430 L431 D435 F436 H437 T442 L443 L464	F430-A439 HydrophobicContact CB-CB 3.85Å; L431-A439 HydrophobicContact CG-CB 4.34Å; D435-A439 PolarHBondContact O-N 3.28Å; F436-A439 WeakPolarHBondContact O-CB 3.42Å; F436-A439 PolarHBondContact O-N 3Å; H437-A439 VanDerWaalsContact C-N 3.33Å; H437-A439 PolarHBondContact O-N 2.88Å; A439-T442 PolarHBondContact O-OG1 3.47Å; A439-L443 WeakPolarHBondContact O-CG 3.27Å; A439-L443 PolarHBondContact O-N 3.47Å; A439-L443 VanDerWaalsContact O-N 3.09Å; A439-L464 HydrophobicContact CB-CD1 3.87Å
440	I	86.8	Confident	82.6	Confident	4 Å²	4	78 Å²	78	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-48.3	177.2	-70.8	172.5	0	0	0	111	F436 H437 T442 L443 K444 L461 L464 Y465 E468	F436-I440 VanDerWaalsContact O-CG1 3.32Å; F436-I440 WeakPolarHBondContact O-CG1 3.34Å; F436-I440 PolarHBondContact O-N 3.3Å; H437-I440 PolarHBondContact O-N 2.69Å; I440-T442 VanDerWaalsContact C-N 3.35Å; I440-T442 PolarHBondContact O-N 2.71Å; I440-L443 PolarHBondContact O-N 2.71Å; I440-K444 HydrophobicContact CG2-CD 3.79Å; I440-K444 HydrophobicContact CG2-CG 4.3Å; I440-K444 VanDerWaalsContact CG2-NZ 3.34Å; I440-K444 WeakPolarHBondContact O-CB 3.11Å; I440-K444 WeakPolarHBondContact O-CG 3.25Å; I440-K444 PolarHBondContact O-N 3.01Å; I440-L461 HydrophobicContact CB-CD2 4.41Å; I440-L461 HydrophobicContact CG1-CD2 4.38Å; I440-L461 HydrophobicContact CG2-CD2 4.14Å; I440-L464 HydrophobicContact CB-CD1 4.48Å; I440-L464 HydrophobicContact CG1-CB 4.18Å; I440-L464 HydrophobicContact CG1-CD1 3.59Å; I440-Y465 HydrophobicContact CD1-CD1 4.48Å; I440-Y465 HydrophobicContact CD1-CE1 3.95Å; I440-Y465 WeakPolarHBondContact CG2-OH 3.31Å; I440-E468 VanDerWaalsContact CD1-CD 3.44Å; I440-E468 WeakPolarHBondContact CD1-OE1 3.46Å; I440-E468 VanDerWaalsContact CD1-OE2 3.24Å; I440-E468 WeakPolarHBondContact CD1-OE2 3.31Å
441	D	87.6	Confident	82.2	Confident	89 Å²	89	82.4 Å²	82.4	48%	0.476	39%	0.385	S	S	.	.	H	α-helix	trans	-65	-37.8	-178.4	-80.1	-8.7	0	0	0	112.5	H437 S445	H437-D441 PolarHBondContact O-N 3.32Å; D441-S445 PolarHBondContact O-N 2.95Å
442	T	85.9	Confident	82.1	Confident	29 Å²	29	90.9 Å²	90.9	18%	0.178	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-42	174.9	46.7	0	0	0	0	112.1	A427 F430 Q438 A439 I440 S445 F446	A427-T442 WeakPolarHBondContact CB-OG1 3.43Å; F430-T442 HydrophobicContact CD2-CG2 4.47Å; F430-T442 HydrophobicContact CE2-CG2 3.98Å; Q438-T442 WeakPolarHBondContact O-CB 3.21Å; Q438-T442 WeakPolarHBondContact O-CG2 3.21Å; Q438-T442 PolarHBondContact O-N 3.15Å; Q438-T442 PolarHBondContact O-OG1 3.35Å; A439-T442 PolarHBondContact O-OG1 3.47Å; I440-T442 VanDerWaalsContact C-N 3.35Å; I440-T442 PolarHBondContact O-N 2.71Å; T442-S445 WeakPolarHBondContact O-CB 3.16Å; T442-S445 PolarHBondContact O-N 3.24Å; T442-S445 PolarHBondContact O-OG 2.9Å; T442-F446 VanDerWaalsContact O-CD2 3.28Å; T442-F446 WeakPolarHBondContact O-CD2 3.26Å; T442-F446 WeakPolarHBondContact O-CE2 3.44Å
443	L	85.9	Confident	81.9	Confident	3 Å²	3	84.2 Å²	84.2	2%	0.016	39%	0.387	C	S	.	.	H	α-helix	trans	-70.2	-36.6	176.7	-68.7	171.9	0	0	0	113.3	I424 A427 A439 I440 S445 F446 A457 N460 L461 L464	I424-L443 HydrophobicContact CG1-CD2 4.24Å; I424-L443 HydrophobicContact CG2-CD2 4.49Å; A427-L443 HydrophobicContact CB-CD1 4.13Å; A427-L443 HydrophobicContact CB-CD2 3.78Å; A427-L443 HydrophobicContact CB-CG 3.63Å; A439-L443 WeakPolarHBondContact O-CG 3.27Å; A439-L443 PolarHBondContact O-N 3.47Å; A439-L443 VanDerWaalsContact O-N 3.09Å; I440-L443 PolarHBondContact O-N 2.71Å; L443-S445 PolarHBondContact O-N 3.34Å; L443-F446 HydrophobicContact CD2-CE2 4.48Å; L443-F446 WeakPolarHBondContact O-CB 3.27Å; L443-F446 WeakPolarHBondContact O-CD2 3.48Å; L443-F446 PolarHBondContact O-N 3.13Å; L443-A457 HydrophobicContact CD2-CB 4.27Å; L443-N460 HydrophobicContact CD1-CB 3.69Å; L443-N460 HydrophobicContact CD2-CB 4.33Å; L443-L461 HydrophobicContact CB-CD1 4Å; L443-L461 HydrophobicContact CB-CD2 3.81Å; L443-L461 HydrophobicContact CB-CG 3.67Å; L443-L461 HydrophobicContact CD1-CD2 4.32Å; L443-L461 HydrophobicContact CD1-CG 4.13Å; L443-L464 HydrophobicContact CD1-CD1 3.62Å; L443-L464 HydrophobicContact CD1-CG 4.43Å
444	K	85	Confident	81.8	Confident	69 Å²	69	80 Å²	80	30%	0.3	37%	0.371	S	S	.	.	H	α-helix	trans	-60.5	-26.9	174.3	-78.9	176.5	177.5	166.7	0	113.4	I440 F446 E447 L461 Y465	I440-K444 HydrophobicContact CG2-CD 3.79Å; I440-K444 HydrophobicContact CG2-CG 4.3Å; I440-K444 VanDerWaalsContact CG2-NZ 3.34Å; I440-K444 WeakPolarHBondContact O-CB 3.11Å; I440-K444 WeakPolarHBondContact O-CG 3.25Å; I440-K444 PolarHBondContact O-N 3.01Å; K444-F446 PolarHBondContact O-N 2.97Å; K444-F446 VanDerWaalsContact O-N 3.08Å; K444-E447 PolarHBondContact O-N 3.2Å; K444-L461 HydrophobicContact CG-CD1 4.32Å; K444-L461 HydrophobicContact CG-CD2 4.3Å; K444-Y465 VanDerWaalsContact CE-OH 3.29Å; K444-Y465 WeakPolarHBondContact CE-OH 3.38Å; K444-Y465 PolarHBondContact NZ-OH 3.45Å
445	S	83.2	Confident	82	Confident	64 Å²	64	70.6 Å²	70.6	45%	0.448	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16	174.9	83	0	0	0	0	114	D441 T442 L443	D441-S445 PolarHBondContact O-N 2.95Å; T442-S445 WeakPolarHBondContact O-CB 3.16Å; T442-S445 PolarHBondContact O-N 3.24Å; T442-S445 PolarHBondContact O-OG 2.9Å; L443-S445 PolarHBondContact O-N 3.34Å
446	F	80.1	Confident	81.9	Confident	1 Å²	1	70.3 Å²	70.3	0%	0.004	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.1	179.3	-65.8	-94.9	0	0	0	115	H420 E423 I424 T442 L443 K444 R448 K449 V453 A457	H420-F446 HydrophobicContact CB-CE1 3.98Å; H420-F446 AromaticContact ND1-CE1 3.92Å; H420-F446 WeakPolarHBondContact O-CZ 3.48Å; E423-F446 HydrophobicContact CB-CE1 4Å; E423-F446 HydrophobicContact CB-CE2 3.94Å; E423-F446 HydrophobicContact CB-CZ 3.21Å; E423-F446 HydrophobicContact CG-CZ 4.35Å; E423-F446 WeakPolarHBondContact OE2-CE1 3.37Å; I424-F446 HydrophobicContact CG1-CE1 4.24Å; I424-F446 HydrophobicContact CG1-CE2 4.1Å; I424-F446 HydrophobicContact CG1-CZ 3.67Å; T442-F446 VanDerWaalsContact O-CD2 3.28Å; T442-F446 WeakPolarHBondContact O-CD2 3.26Å; T442-F446 WeakPolarHBondContact O-CE2 3.44Å; L443-F446 HydrophobicContact CD2-CE2 4.48Å; L443-F446 WeakPolarHBondContact O-CB 3.27Å; L443-F446 WeakPolarHBondContact O-CD2 3.48Å; L443-F446 PolarHBondContact O-N 3.13Å; K444-F446 PolarHBondContact O-N 2.97Å; K444-F446 VanDerWaalsContact O-N 3.08Å; F446-R448 PolarHBondContact O-N 3.18Å; F446-K449 HydrophobicContact CD1-CD 3.72Å; F446-K449 HydrophobicContact CE1-CD 4.41Å; F446-K449 HydrophobicContact CG-CD 4.36Å; F446-K449 PolarHBondContact O-N 2.85Å; F446-V453 HydrophobicContact CD1-CG1 3.28Å; F446-V453 HydrophobicContact CE1-CG1 3.53Å; F446-V453 HydrophobicContact CG-CG1 4.26Å; F446-A457 HydrophobicContact CB-CB 3.7Å; F446-A457 HydrophobicContact CD2-CB 4.38Å; F446-A457 HydrophobicContact CG-CB 4.21Å
447	E	73.5	Confident	82	Confident	97 Å²	97	67.3 Å²	67.3	45%	0.453	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-16.5	-179.4	-68.8	-179.9	175.9	0	0	113.5	K444 Y477	K444-E447 PolarHBondContact O-N 3.2Å; E447-Y477 VanDerWaalsContact OE1-CE1 3.27Å; E447-Y477 WeakPolarHBondContact OE1-CE1 3.46Å; E447-Y477 PolarHBondContact OE1-OH 2.78Å
448	R	73.5	Confident	82.2	Confident	242 Å²	242	61.6 Å²	61.6	91%	0.913	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	3.9	-179.3	-54.3	-177.8	-173.6	175	2.1	114.4	F446	F446-R448 PolarHBondContact O-N 3.18Å
449	K	73.1	Confident	82.3	Confident	71 Å²	71	57.9 Å²	57.9	31%	0.309	29%	0.285	S	S	.	.	S	Bend	trans	-99.3	-171.7	-179.3	-61.9	-176.4	-167.7	155.2	0	110.6	E423 F446	E423-K449 IonicContact OE2-NZ 3.88Å; E423-K449 PolarHBondContact OE2-NZ 3.37Å; F446-K449 HydrophobicContact CD1-CD 3.72Å; F446-K449 HydrophobicContact CE1-CD 4.41Å; F446-K449 HydrophobicContact CG-CD 4.36Å; F446-K449 PolarHBondContact O-N 2.85Å
450	D	71	Confident	82.4	Confident	111 Å²	111	60.1 Å²	60.1	59%	0.594	30%	0.297	S	S	*	.			trans	-49.3	137.3	-177.5	-68.4	-34.3	0	0	0	113.9	R452 V453 A454	D450-R452 VanDerWaalsContact C-N 3.3Å; D450-R452 PolarHBondContact O-N 2.92Å; D450-R452 VanDerWaalsContact O-N 3.13Å; D450-V453 HydrophobicContact CB-CG2 4.31Å; D450-V453 PolarHBondContact O-N 3.43Å; D450-A454 PolarHBondContact O-N 2.92Å
451	T	79.3	Confident	82.5	Confident	97 Å²	97	60 Å²	60	60%	0.595	30%	0.296	S	S	*	.	H	α-helix	trans	-48	-44	-174.9	-52.9	0	0	0	0	113.9	A454 C455 V484	T451-A454 PolarHBondContact O-N 3.02Å; T451-C455 PolarHBondContact O-N 3.5Å; T451-V484 HydrophobicContact CG2-CB 4.46Å; T451-V484 HydrophobicContact CG2-CG1 3.35Å; T451-V484 HydrophobicContact CG2-CG2 4.35Å; T451-V484 WeakPolarHBondContact O-CG1 3.35Å
452	R	79.2	Confident	82.7	Confident	216 Å²	216	55.8 Å²	55.8	82%	0.815	27%	0.274	S	S	*	.	H	α-helix	trans	-67.2	-40.5	178.7	-71	-171.4	-73.5	-157.8	-0.9	112.9	D450 C455 S456	D450-R452 VanDerWaalsContact C-N 3.3Å; D450-R452 PolarHBondContact O-N 2.92Å; D450-R452 VanDerWaalsContact O-N 3.13Å; R452-C455 PolarHBondContact O-N 2.77Å; R452-S456 PolarHBondContact O-N 3.46Å
453	V	79.7	Confident	82.8	Confident	21 Å²	21	57.4 Å²	57.4	13%	0.127	28%	0.279	C	S	.	.	H	α-helix	trans	-70.8	-40.1	178.2	-175.7	0	0	0	0	110.3	H420 I424 F446 D450 C455 S456 A457	H420-V453 HydrophobicContact CB-CG1 3.73Å; H420-V453 HydrophobicContact CB-CG2 3.93Å; I424-V453 HydrophobicContact CD1-CG1 4.29Å; F446-V453 HydrophobicContact CD1-CG1 3.28Å; F446-V453 HydrophobicContact CE1-CG1 3.53Å; F446-V453 HydrophobicContact CG-CG1 4.26Å; D450-V453 HydrophobicContact CB-CG2 4.31Å; D450-V453 PolarHBondContact O-N 3.43Å; V453-C455 VanDerWaalsContact C-N 3.3Å; V453-C455 PolarHBondContact O-N 2.96Å; V453-S456 PolarHBondContact O-N 3.48Å; V453-A457 WeakPolarHBondContact O-CB 3.32Å; V453-A457 PolarHBondContact O-N 3.49Å
454	A	82.5	Confident	82.8	Confident	22 Å²	22	57.3 Å²	57.3	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-38.6	173.4	0	0	0	0	0	112	D450 T451 A457 A458	D450-A454 PolarHBondContact O-N 2.92Å; T451-A454 PolarHBondContact O-N 3.02Å; A454-A457 PolarHBondContact O-N 3.08Å; A454-A458 VanDerWaalsContact O-CB 3.24Å; A454-A458 WeakPolarHBondContact O-CB 3.42Å; A454-A458 PolarHBondContact O-N 2.83Å
455	C	85.5	Confident	83.1	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.054	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-46.4	173.6	-175.3	0	0	0	0	112.6	T451 R452 V453 A457 A458 T459 A481 V484 N488	T451-C455 PolarHBondContact O-N 3.5Å; R452-C455 PolarHBondContact O-N 2.77Å; V453-C455 VanDerWaalsContact C-N 3.3Å; V453-C455 PolarHBondContact O-N 2.96Å; C455-A457 PolarHBondContact O-N 3.11Å; C455-A458 PolarHBondContact O-N 2.85Å; C455-T459 WeakPolarHBondContact O-CB 3.38Å; C455-T459 PolarHBondContact O-N 3.28Å; C455-T459 PolarHBondContact O-OG1 3.23Å; C455-A481 PolarHBondContact SG-O 3.36Å; C455-V484 HydrophobicContact CB-CB 4.12Å; C455-V484 HydrophobicContact CB-CG1 3.72Å; C455-N488 PolarHBondContact SG-ND2 2.89Å
456	S	84.2	Confident	83.4	Confident	48 Å²	48	53.2 Å²	53.2	34%	0.336	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-41.9	176.2	-172.5	0	0	0	0	111.9	R452 V453 T459 N460	R452-S456 PolarHBondContact O-N 3.46Å; V453-S456 PolarHBondContact O-N 3.48Å; S456-T459 PolarHBondContact O-N 3.21Å; S456-N460 PolarHBondContact O-N 3.46Å; S456-N460 PolarHBondContact O-ND2 3.06Å
457	A	86.5	Confident	83.7	Confident	2 Å²	2	56.5 Å²	56.5	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-42.6	175.5	0	0	0	0	0	112.5	L443 F446 V453 A454 C455 N460 L461	L443-A457 HydrophobicContact CD2-CB 4.27Å; F446-A457 HydrophobicContact CB-CB 3.7Å; F446-A457 HydrophobicContact CD2-CB 4.38Å; F446-A457 HydrophobicContact CG-CB 4.21Å; V453-A457 WeakPolarHBondContact O-CB 3.32Å; V453-A457 PolarHBondContact O-N 3.49Å; A454-A457 PolarHBondContact O-N 3.08Å; C455-A457 PolarHBondContact O-N 3.11Å; A457-N460 PolarHBondContact O-N 3.24Å; A457-L461 WeakPolarHBondContact O-CB 3.42Å; A457-L461 WeakPolarHBondContact O-CG 3.43Å; A457-L461 PolarHBondContact O-N 2.89Å
458	A	90	Very high	84.4	Confident	9 Å²	9	56.1 Å²	56.1	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-39.5	175.6	0	0	0	0	0	112.2	A454 C455 N460 L461 S462 Y477 Q480 A481	A454-A458 VanDerWaalsContact O-CB 3.24Å; A454-A458 WeakPolarHBondContact O-CB 3.42Å; A454-A458 PolarHBondContact O-N 2.83Å; C455-A458 PolarHBondContact O-N 2.85Å; A458-N460 PolarHBondContact O-N 3.3Å; A458-L461 PolarHBondContact O-N 2.95Å; A458-S462 WeakPolarHBondContact O-CB 3.42Å; A458-S462 PolarHBondContact O-N 3.5Å; A458-Y477 HydrophobicContact CB-CD1 4.38Å; A458-Q480 HydrophobicContact CB-CB 4.48Å; A458-A481 HydrophobicContact CB-CB 4.07Å
459	T	90.2	Very high	85	Confident	12 Å²	12	47.1 Å²	47.1	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-59.3	-47.2	174	-54.2	0	0	0	0	110.6	C455 S456 S462 F463 N488 A490 A491 N494	C455-T459 WeakPolarHBondContact O-CB 3.38Å; C455-T459 PolarHBondContact O-N 3.28Å; C455-T459 PolarHBondContact O-OG1 3.23Å; S456-T459 PolarHBondContact O-N 3.21Å; T459-S462 PolarHBondContact O-N 3.25Å; T459-F463 PolarHBondContact O-N 3.43Å; T459-N488 PolarHBondContact OG1-ND2 2.69Å; T459-A490 HydrophobicContact CG2-CB 3.76Å; T459-A491 HydrophobicContact CG2-CB 4.49Å; T459-N494 PolarHBondContact O-ND2 2.88Å
460	N	87.4	Confident	85.9	Confident	48 Å²	48	46.7 Å²	46.7	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-66.8	-42.5	176.7	-70.1	-44.5	0	0	0	112.3	I424 L443 S456 A457 A458 S462 F463 L464	I424-N460 WeakPolarHBondContact CG2-ND2 3.32Å; L443-N460 HydrophobicContact CD1-CB 3.69Å; L443-N460 HydrophobicContact CD2-CB 4.33Å; S456-N460 PolarHBondContact O-N 3.46Å; S456-N460 PolarHBondContact O-ND2 3.06Å; A457-N460 PolarHBondContact O-N 3.24Å; A458-N460 PolarHBondContact O-N 3.3Å; N460-S462 VanDerWaalsContact C-N 3.31Å; N460-S462 PolarHBondContact O-N 2.87Å; N460-F463 PolarHBondContact O-N 3.23Å; N460-L464 WeakPolarHBondContact O-CG 3.44Å; N460-L464 PolarHBondContact O-N 3.04Å
461	L	89.3	Confident	86.9	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-38.8	175.9	-80.1	164.8	0	0	0	112.4	I440 L443 K444 A457 A458 F463 L464 Y465 Y477	I440-L461 HydrophobicContact CB-CD2 4.41Å; I440-L461 HydrophobicContact CG1-CD2 4.38Å; I440-L461 HydrophobicContact CG2-CD2 4.14Å; L443-L461 HydrophobicContact CB-CD1 4Å; L443-L461 HydrophobicContact CB-CD2 3.81Å; L443-L461 HydrophobicContact CB-CG 3.67Å; L443-L461 HydrophobicContact CD1-CD2 4.32Å; L443-L461 HydrophobicContact CD1-CG 4.13Å; K444-L461 HydrophobicContact CG-CD1 4.32Å; K444-L461 HydrophobicContact CG-CD2 4.3Å; A457-L461 WeakPolarHBondContact O-CB 3.42Å; A457-L461 WeakPolarHBondContact O-CG 3.43Å; A457-L461 PolarHBondContact O-N 2.89Å; A458-L461 PolarHBondContact O-N 2.95Å; L461-F463 VanDerWaalsContact C-N 3.35Å; L461-F463 PolarHBondContact O-N 3.25Å; L461-L464 HydrophobicContact CD2-CD1 4.41Å; L461-L464 WeakPolarHBondContact O-CB 3.4Å; L461-L464 PolarHBondContact O-N 3.41Å; L461-Y465 HydrophobicContact CD2-CE2 4.22Å; L461-Y465 VanDerWaalsContact O-CD2 3.23Å; L461-Y465 WeakPolarHBondContact O-CD2 3.42Å; L461-Y465 PolarHBondContact O-N 3.19Å; L461-Y477 HydrophobicContact CB-CD1 3.97Å; L461-Y477 HydrophobicContact CB-CD2 4.31Å; L461-Y477 HydrophobicContact CB-CE1 4.37Å; L461-Y477 HydrophobicContact CB-CG 3.94Å; L461-Y477 HydrophobicContact CD1-CD1 4.01Å; L461-Y477 HydrophobicContact CD1-CE1 3.7Å
462	S	91	Very high	87.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-46.2	174.9	179.6	0	0	0	0	111.6	A458 T459 N460 Y465 F466 A474 A478	A458-S462 WeakPolarHBondContact O-CB 3.42Å; A458-S462 PolarHBondContact O-N 3.5Å; T459-S462 PolarHBondContact O-N 3.25Å; N460-S462 VanDerWaalsContact C-N 3.31Å; N460-S462 PolarHBondContact O-N 2.87Å; S462-Y465 PolarHBondContact O-N 3.44Å; S462-F466 WeakPolarHBondContact O-CB 3.4Å; S462-F466 PolarHBondContact O-N 3.1Å; S462-A474 WeakPolarHBondContact CB-O 3.25Å; S462-A474 WeakPolarHBondContact O-CB 3.43Å; S462-A474 PolarHBondContact OG-O 2.87Å; S462-A478 WeakPolarHBondContact OG-CB 3.39Å
463	F	88.5	Confident	88.2	Confident	64 Å²	64	37.3 Å²	37.3	28%	0.281	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-39.1	175.1	-174.5	-110	0	0	0	112.6	T459 N460 L461 F466 L467	T459-F463 PolarHBondContact O-N 3.43Å; N460-F463 PolarHBondContact O-N 3.23Å; L461-F463 VanDerWaalsContact C-N 3.35Å; L461-F463 PolarHBondContact O-N 3.25Å; F463-F466 PolarHBondContact O-N 3.03Å; F463-L467 HydrophobicContact CD1-CD1 4.05Å; F463-L467 HydrophobicContact CE1-CD1 3.54Å; F463-L467 HydrophobicContact CE1-CG 4.21Å; F463-L467 HydrophobicContact CZ-CD1 3.89Å; F463-L467 HydrophobicContact CZ-CD2 4.29Å; F463-L467 HydrophobicContact CZ-CG 4.19Å; F463-L467 WeakPolarHBondContact O-CG 3.22Å; F463-L467 PolarHBondContact O-N 3.44Å
464	L	87.1	Confident	88.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-50.4	174.1	-70.5	-171.3	0	0	0	112.4	L431 F436 A439 I440 L443 N460 L461 F466 L467 E468	L431-L464 HydrophobicContact CD1-CD2 3.57Å; L431-L464 HydrophobicContact CD2-CD2 3.19Å; L431-L464 HydrophobicContact CG-CD2 3.49Å; L431-L464 VanDerWaalsContact CG-CD2 3.49Å; F436-L464 HydrophobicContact CD1-CD2 4.48Å; A439-L464 HydrophobicContact CB-CD1 3.87Å; I440-L464 HydrophobicContact CB-CD1 4.48Å; I440-L464 HydrophobicContact CG1-CB 4.18Å; I440-L464 HydrophobicContact CG1-CD1 3.59Å; L443-L464 HydrophobicContact CD1-CD1 3.62Å; L443-L464 HydrophobicContact CD1-CG 4.43Å; N460-L464 WeakPolarHBondContact O-CG 3.44Å; N460-L464 PolarHBondContact O-N 3.04Å; L461-L464 HydrophobicContact CD2-CD1 4.41Å; L461-L464 WeakPolarHBondContact O-CB 3.4Å; L461-L464 PolarHBondContact O-N 3.41Å; L464-F466 VanDerWaalsContact C-N 3.27Å; L464-F466 PolarHBondContact O-N 3.49Å; L464-L467 PolarHBondContact O-N 3.06Å; L464-L467 VanDerWaalsContact O-N 3.15Å; L464-E468 PolarHBondContact O-N 3.35Å
465	Y	90.4	Very high	89.4	Confident	19 Å²	19	37.2 Å²	37.2	8%	0.075	21%	0.205	C	C	.	.	H	α-helix	trans	-67.2	-30.5	-179.2	-80.6	-59	0	0	0	112.7	I440 K444 L461 S462 E468 G469 D470 Q473 Y477	I440-Y465 HydrophobicContact CD1-CD1 4.48Å; I440-Y465 HydrophobicContact CD1-CE1 3.95Å; I440-Y465 WeakPolarHBondContact CG2-OH 3.31Å; K444-Y465 VanDerWaalsContact CE-OH 3.29Å; K444-Y465 WeakPolarHBondContact CE-OH 3.38Å; K444-Y465 PolarHBondContact NZ-OH 3.45Å; L461-Y465 HydrophobicContact CD2-CE2 4.22Å; L461-Y465 VanDerWaalsContact O-CD2 3.23Å; L461-Y465 WeakPolarHBondContact O-CD2 3.42Å; L461-Y465 PolarHBondContact O-N 3.19Å; S462-Y465 PolarHBondContact O-N 3.44Å; Y465-E468 PolarHBondContact O-N 3.44Å; Y465-G469 PolarHBondContact O-N 3.39Å; Y465-G469 VanDerWaalsContact O-N 3.14Å; Y465-D470 HydrophobicContact CD1-CB 4.02Å; Y465-D470 CarbonylContact O-C 3.56Å; Y465-D470 PolarHBondContact O-N 3.37Å; Y465-Q473 HydrophobicContact CD1-CB 3.76Å; Y465-Q473 HydrophobicContact CD1-CG 4.33Å; Y465-Q473 HydrophobicContact CD2-CB 3.67Å; Y465-Q473 HydrophobicContact CE1-CB 4.11Å; Y465-Q473 HydrophobicContact CE1-CG 4.28Å; Y465-Q473 HydrophobicContact CE2-CB 4.03Å; Y465-Q473 HydrophobicContact CG-CB 3.52Å; Y465-Y477 AromaticContact CD2-CD2 3.57Å; Y465-Y477 HydrophobicContact CD2-CD2 3.57Å; Y465-Y477 AromaticContact CD2-CE2 3.77Å; Y465-Y477 HydrophobicContact CD2-CE2 3.77Å; Y465-Y477 AromaticContact CE2-CD2 3.71Å; Y465-Y477 HydrophobicContact CE2-CD2 3.71Å; Y465-Y477 AromaticContact CE2-CE2 3.37Å; Y465-Y477 HydrophobicContact CE2-CE2 3.37Å
466	F	90.8	Very high	89.8	Confident	29 Å²	29	41.4 Å²	41.4	13%	0.127	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-45.6	170.1	178.9	-96.6	0	0	0	111.6	Y11 S462 F463 L464 G469 L471 A474 N497 V498 Q501	Y11-F466 HydrophobicContact CD2-CE1 4.41Å; Y11-F466 AromaticContact CE2-CE1 3.78Å; Y11-F466 HydrophobicContact CE2-CE1 3.78Å; Y11-F466 HydrophobicContact CE2-CZ 4.31Å; S462-F466 WeakPolarHBondContact O-CB 3.4Å; S462-F466 PolarHBondContact O-N 3.1Å; F463-F466 PolarHBondContact O-N 3.03Å; L464-F466 VanDerWaalsContact C-N 3.27Å; L464-F466 PolarHBondContact O-N 3.49Å; F466-G469 PolarHBondContact O-N 3.33Å; F466-G469 VanDerWaalsContact O-N 3.11Å; F466-L471 HydrophobicContact CD2-CD2 3.95Å; F466-L471 HydrophobicContact CE2-CD2 4.26Å; F466-A474 HydrophobicContact CB-CB 4.11Å; F466-N497 HydrophobicContact CD2-CB 4.18Å; F466-N497 HydrophobicContact CE1-CB 4.35Å; F466-N497 HydrophobicContact CE2-CB 3.83Å; F466-N497 WeakPolarHBondContact CE2-O 3.34Å; F466-N497 HydrophobicContact CZ-CB 3.93Å; F466-V498 HydrophobicContact CD2-CG2 3.87Å; F466-Q501 HydrophobicContact CE2-CB 4.09Å
467	L	86	Confident	90.1	Very high	70 Å²	70	39.6 Å²	39.6	37%	0.366	21%	0.208	S	C	.	.	H	α-helix	trans	-67.5	-32.3	176.2	-68.5	178.9	0	0	0	113.7	F436 F463 L464 G469	F436-L467 HydrophobicContact CE1-CD1 4.39Å; F463-L467 HydrophobicContact CD1-CD1 4.05Å; F463-L467 HydrophobicContact CE1-CD1 3.54Å; F463-L467 HydrophobicContact CE1-CG 4.21Å; F463-L467 HydrophobicContact CZ-CD1 3.89Å; F463-L467 HydrophobicContact CZ-CD2 4.29Å; F463-L467 HydrophobicContact CZ-CG 4.19Å; F463-L467 WeakPolarHBondContact O-CG 3.22Å; F463-L467 PolarHBondContact O-N 3.44Å; L464-L467 PolarHBondContact O-N 3.06Å; L464-L467 VanDerWaalsContact O-N 3.15Å; L467-G469 PolarHBondContact O-N 3.14Å
468	E	86.6	Confident	90.4	Very high	89 Å²	89	39.5 Å²	39.5	42%	0.416	21%	0.207	S	C	.	.	H	α-helix	trans	-73.9	-12.1	171.8	-70.9	-167.8	154.3	0	0	113.1	F436 I440 L464 Y465	F436-E468 HydrophobicContact CB-CG 4.31Å; F436-E468 VanDerWaalsContact CB-OE1 3.29Å; F436-E468 WeakPolarHBondContact CB-OE1 3.41Å; I440-E468 VanDerWaalsContact CD1-CD 3.44Å; I440-E468 WeakPolarHBondContact CD1-OE1 3.46Å; I440-E468 VanDerWaalsContact CD1-OE2 3.24Å; I440-E468 WeakPolarHBondContact CD1-OE2 3.31Å; L464-E468 PolarHBondContact O-N 3.35Å; Y465-E468 PolarHBondContact O-N 3.44Å
469	G	87.4	Confident	90.6	Very high	52 Å²	52	42.3 Å²	42.3	54%	0.536	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	3	-176.6	0	0	0	0	0	115.1	Y465 F466 L467 L471	Y465-G469 PolarHBondContact O-N 3.39Å; Y465-G469 VanDerWaalsContact O-N 3.14Å; F466-G469 PolarHBondContact O-N 3.33Å; F466-G469 VanDerWaalsContact O-N 3.11Å; L467-G469 PolarHBondContact O-N 3.14Å; G469-L471 VanDerWaalsContact C-N 3.29Å; G469-L471 PolarHBondContact O-N 3.36Å
470	D	91.4	Very high	90.7	Very high	62 Å²	62	45.5 Å²	45.5	33%	0.332	24%	0.235	S	C	.	.			trans	-81.3	77.5	172.2	-169.6	-20.9	0	0	0	110.3	Y465 L472 Q473 A474	Y465-D470 HydrophobicContact CD1-CB 4.02Å; Y465-D470 CarbonylContact O-C 3.56Å; Y465-D470 PolarHBondContact O-N 3.37Å; D470-L472 PolarHBondContact O-N 2.97Å; D470-L472 VanDerWaalsContact O-N 3.13Å; D470-L472 PolarHBondContact OD1-N 3.22Å; D470-Q473 PolarHBondContact O-N 3.11Å; D470-Q473 PolarHBondContact OD1-N 3.1Å; D470-Q473 VanDerWaalsContact OD2-CG 3.31Å; D470-Q473 WeakPolarHBondContact OD2-CG 3.36Å; D470-A474 WeakPolarHBondContact O-CB 3.44Å; D470-A474 PolarHBondContact O-N 3.34Å
471	L	92.7	Very high	90.8	Very high	40 Å²	40	43.2 Å²	43.2	21%	0.209	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-26.1	179.2	-58.4	-177.7	0	0	0	113.1	F466 G469 E475 V498 Q501 Q502	F466-L471 HydrophobicContact CD2-CD2 3.95Å; F466-L471 HydrophobicContact CE2-CD2 4.26Å; G469-L471 VanDerWaalsContact C-N 3.29Å; G469-L471 PolarHBondContact O-N 3.36Å; L471-E475 WeakPolarHBondContact O-CB 3.34Å; L471-E475 PolarHBondContact O-N 3.26Å; L471-V498 HydrophobicContact CB-CG1 4.16Å; L471-V498 HydrophobicContact CD2-CG1 4.45Å; L471-Q501 HydrophobicContact CD1-CB 4.01Å; L471-Q501 HydrophobicContact CD1-CG 3.8Å; L471-Q501 HydrophobicContact CD2-CB 4.03Å; L471-Q501 HydrophobicContact CD2-CG 4.02Å; L471-Q502 HydrophobicContact CD1-CG 4.26Å
472	L	93.3	Very high	90.9	Very high	128 Å²	128	44.5 Å²	44.5	67%	0.67	23%	0.229	S	C	*	.	H	α-helix	trans	-75.7	-43.2	-178.5	-65.1	176.1	0	0	0	111.8	D470 K476	D470-L472 PolarHBondContact O-N 2.97Å; D470-L472 VanDerWaalsContact O-N 3.13Å; D470-L472 PolarHBondContact OD1-N 3.22Å; L472-K476 WeakPolarHBondContact O-CB 3.31Å; L472-K476 PolarHBondContact O-N 2.76Å
473	Q	91.6	Very high	90.9	Very high	59 Å²	59	49.1 Å²	49.1	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-70.2	-37.1	170.8	-62.2	-51.5	-50.7	0	0	110.9	Y465 D470 E475 K476 Y477	Y465-Q473 HydrophobicContact CD1-CB 3.76Å; Y465-Q473 HydrophobicContact CD1-CG 4.33Å; Y465-Q473 HydrophobicContact CD2-CB 3.67Å; Y465-Q473 HydrophobicContact CE1-CB 4.11Å; Y465-Q473 HydrophobicContact CE1-CG 4.28Å; Y465-Q473 HydrophobicContact CE2-CB 4.03Å; Y465-Q473 HydrophobicContact CG-CB 3.52Å; D470-Q473 PolarHBondContact O-N 3.11Å; D470-Q473 PolarHBondContact OD1-N 3.1Å; D470-Q473 VanDerWaalsContact OD2-CG 3.31Å; D470-Q473 WeakPolarHBondContact OD2-CG 3.36Å; Q473-E475 PolarHBondContact O-N 2.8Å; Q473-K476 PolarHBondContact O-N 3.04Å; Q473-Y477 HydrophobicContact CB-CD2 4.24Å; Q473-Y477 HydrophobicContact CB-CE2 4.37Å; Q473-Y477 VanDerWaalsContact O-CD2 3.25Å; Q473-Y477 WeakPolarHBondContact O-CD2 3.36Å; Q473-Y477 PolarHBondContact O-N 2.66Å
474	A	92.7	Very high	90.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-47.3	178.1	0	0	0	0	0	112.5	S462 F466 D470 A478 V498	S462-A474 WeakPolarHBondContact CB-O 3.25Å; S462-A474 WeakPolarHBondContact O-CB 3.43Å; S462-A474 PolarHBondContact OG-O 2.87Å; F466-A474 HydrophobicContact CB-CB 4.11Å; D470-A474 WeakPolarHBondContact O-CB 3.44Å; D470-A474 PolarHBondContact O-N 3.34Å; A474-A478 PolarHBondContact O-N 3.26Å; A474-V498 HydrophobicContact CB-CG2 3.46Å; A474-V498 VanDerWaalsContact CB-CG2 3.46Å
475	E	94.1	Very high	90.9	Very high	42 Å²	42	52.6 Å²	52.6	20%	0.196	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-47.5	175.2	-167.5	168.7	-179.8	0	0	111.5	L471 Q473 Y477 A478 D479 V498 Q502	L471-E475 WeakPolarHBondContact O-CB 3.34Å; L471-E475 PolarHBondContact O-N 3.26Å; Q473-E475 PolarHBondContact O-N 2.8Å; E475-Y477 PolarHBondContact O-N 3.13Å; E475-A478 WeakPolarHBondContact O-CB 3.19Å; E475-A478 PolarHBondContact O-N 3.38Å; E475-D479 PolarHBondContact O-N 3.15Å; E475-V498 HydrophobicContact CB-CG1 3.99Å; E475-Q502 PolarHBondContact OE2-NE2 2.79Å
476	K	93.9	Very high	90.8	Very high	95 Å²	95	58.9 Å²	58.9	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-59.2	-43.6	179.6	178.5	-169.2	163.8	-152.2	0	112.7	L472 Q473 D479 Q480	L472-K476 WeakPolarHBondContact O-CB 3.31Å; L472-K476 PolarHBondContact O-N 2.76Å; Q473-K476 PolarHBondContact O-N 3.04Å; K476-D479 PolarHBondContact O-N 2.65Å; K476-Q480 WeakPolarHBondContact O-CG 3.46Å; K476-Q480 PolarHBondContact O-N 3.04Å
477	Y	92.3	Very high	90.6	Very high	11 Å²	11	64.6 Å²	64.6	4%	0.043	33%	0.331	C	S	.	.	H	α-helix	trans	-73.8	-30	178.6	-80.2	-71.6	0	0	0	112.4	E447 A458 L461 Y465 Q473 E475 Q480 A481	E447-Y477 VanDerWaalsContact OE1-CE1 3.27Å; E447-Y477 WeakPolarHBondContact OE1-CE1 3.46Å; E447-Y477 PolarHBondContact OE1-OH 2.78Å; A458-Y477 HydrophobicContact CB-CD1 4.38Å; L461-Y477 HydrophobicContact CB-CD1 3.97Å; L461-Y477 HydrophobicContact CB-CD2 4.31Å; L461-Y477 HydrophobicContact CB-CE1 4.37Å; L461-Y477 HydrophobicContact CB-CG 3.94Å; L461-Y477 HydrophobicContact CD1-CD1 4.01Å; L461-Y477 HydrophobicContact CD1-CE1 3.7Å; Y465-Y477 AromaticContact CD2-CD2 3.57Å; Y465-Y477 HydrophobicContact CD2-CD2 3.57Å; Y465-Y477 AromaticContact CD2-CE2 3.77Å; Y465-Y477 HydrophobicContact CD2-CE2 3.77Å; Y465-Y477 AromaticContact CE2-CD2 3.71Å; Y465-Y477 HydrophobicContact CE2-CD2 3.71Å; Y465-Y477 AromaticContact CE2-CE2 3.37Å; Y465-Y477 HydrophobicContact CE2-CE2 3.37Å; Q473-Y477 HydrophobicContact CB-CD2 4.24Å; Q473-Y477 HydrophobicContact CB-CE2 4.37Å; Q473-Y477 VanDerWaalsContact O-CD2 3.25Å; Q473-Y477 WeakPolarHBondContact O-CD2 3.36Å; Q473-Y477 PolarHBondContact O-N 2.66Å; E475-Y477 PolarHBondContact O-N 3.13Å; Y477-Q480 PolarHBondContact O-N 3.39Å; Y477-A481 PolarHBondContact O-N 3.08Å
478	A	92.4	Very high	90.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-48.3	169.5	0	0	0	0	0	111	S462 A474 E475 Q480 A481 L482 K495	S462-A478 WeakPolarHBondContact OG-CB 3.39Å; A474-A478 PolarHBondContact O-N 3.26Å; E475-A478 WeakPolarHBondContact O-CB 3.19Å; E475-A478 PolarHBondContact O-N 3.38Å; A478-Q480 VanDerWaalsContact C-N 3.3Å; A478-Q480 PolarHBondContact O-N 2.98Å; A478-A481 WeakPolarHBondContact O-CB 3.49Å; A478-A481 PolarHBondContact O-N 3.36Å; A478-A481 VanDerWaalsContact O-N 3.15Å; A478-L482 WeakPolarHBondContact O-CG 3.49Å; A478-L482 PolarHBondContact O-N 3.4Å; A478-K495 HydrophobicContact CB-CB 3.96Å
479	D	93.5	Very high	90.9	Very high	67 Å²	67	59.6 Å²	59.6	36%	0.358	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-35.3	177.1	-83.1	-10.2	0	0	0	112.6	E475 K476 L482 S483 K495	E475-D479 PolarHBondContact O-N 3.15Å; K476-D479 PolarHBondContact O-N 2.65Å; D479-L482 PolarHBondContact O-N 3.19Å; D479-S483 VanDerWaalsContact O-CB 3.31Å; D479-S483 WeakPolarHBondContact O-CB 3.3Å; D479-S483 PolarHBondContact O-N 3.35Å; D479-K495 WeakPolarHBondContact OD1-CE 3.47Å; D479-K495 IonicContact OD1-NZ 3.3Å; D479-K495 PolarHBondContact OD1-NZ 2.59Å; D479-K495 IonicContact OD2-NZ 3.05Å
480	Q	91.5	Very high	91.1	Very high	80 Å²	80	59.3 Å²	59.3	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-44.9	171.7	-77.7	-179.6	-18.6	0	0	112.2	A458 K476 Y477 A478 S483 V484	A458-Q480 HydrophobicContact CB-CB 4.48Å; K476-Q480 WeakPolarHBondContact O-CG 3.46Å; K476-Q480 PolarHBondContact O-N 3.04Å; Y477-Q480 PolarHBondContact O-N 3.39Å; A478-Q480 VanDerWaalsContact C-N 3.3Å; A478-Q480 PolarHBondContact O-N 2.98Å; Q480-S483 PolarHBondContact O-N 2.99Å; Q480-S483 PolarHBondContact O-OG 2.86Å; Q480-V484 PolarHBondContact O-N 3.22Å
481	A	91.4	Very high	91.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-46.8	175	0	0	0	0	0	111.4	C455 A458 Y477 A478 S483 V484 D485 A491	C455-A481 PolarHBondContact SG-O 3.36Å; A458-A481 HydrophobicContact CB-CB 4.07Å; Y477-A481 PolarHBondContact O-N 3.08Å; A478-A481 WeakPolarHBondContact O-CB 3.49Å; A478-A481 PolarHBondContact O-N 3.36Å; A478-A481 VanDerWaalsContact O-N 3.15Å; A481-S483 VanDerWaalsContact C-N 3.31Å; A481-S483 PolarHBondContact O-N 3.42Å; A481-V484 PolarHBondContact O-N 3.03Å; A481-V484 VanDerWaalsContact O-N 3.11Å; A481-D485 PolarHBondContact O-N 3.24Å; A481-A491 HydrophobicContact CB-CB 3.69Å
482	L	91.3	Very high	91.2	Very high	28 Å²	28	54.6 Å²	54.6	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-27.5	178	-64.3	172.8	0	0	0	113.9	A478 D479 V484 D485 R486 A491 L492 K495	A478-L482 WeakPolarHBondContact O-CG 3.49Å; A478-L482 PolarHBondContact O-N 3.4Å; D479-L482 PolarHBondContact O-N 3.19Å; L482-V484 PolarHBondContact O-N 3.36Å; L482-D485 WeakPolarHBondContact CA-O 3.19Å; L482-D485 CarbonylContact O-C 3.47Å; L482-R486 WeakPolarHBondContact O-CA 3.41Å; L482-R486 PolarHBondContact O-N 3.08Å; L482-A491 HydrophobicContact CD2-CB 3.68Å; L482-A491 HydrophobicContact CG-CB 3.95Å; L482-L492 HydrophobicContact CD1-CD2 3.97Å; L482-L492 HydrophobicContact CD2-CD2 3.59Å; L482-L492 HydrophobicContact CD2-CG 3.65Å; L482-L492 HydrophobicContact CG-CD2 4.45Å; L482-K495 HydrophobicContact CD1-CB 4.45Å; L482-K495 HydrophobicContact CD1-CD 3.65Å
483	S	91	Very high	91.2	Very high	96 Å²	96	48.9 Å²	48.9	67%	0.671	25%	0.246	S	C	*	.	H	α-helix	trans	-70.7	-22.5	174.1	76.4	0	0	0	0	113.2	D479 Q480 A481	D479-S483 VanDerWaalsContact O-CB 3.31Å; D479-S483 WeakPolarHBondContact O-CB 3.3Å; D479-S483 PolarHBondContact O-N 3.35Å; Q480-S483 PolarHBondContact O-N 2.99Å; Q480-S483 PolarHBondContact O-OG 2.86Å; A481-S483 VanDerWaalsContact C-N 3.31Å; A481-S483 PolarHBondContact O-N 3.42Å
484	V	87.4	Confident	91.3	Very high	66 Å²	66	46.8 Å²	46.8	40%	0.4	24%	0.237	S	C	.	.	H	α-helix	trans	-94.4	-49.1	178.3	171.9	0	0	0	0	111.4	T451 C455 Q480 A481 L482	T451-V484 HydrophobicContact CG2-CB 4.46Å; T451-V484 HydrophobicContact CG2-CG1 3.35Å; T451-V484 HydrophobicContact CG2-CG2 4.35Å; T451-V484 WeakPolarHBondContact O-CG1 3.35Å; C455-V484 HydrophobicContact CB-CB 4.12Å; C455-V484 HydrophobicContact CB-CG1 3.72Å; Q480-V484 PolarHBondContact O-N 3.22Å; A481-V484 PolarHBondContact O-N 3.03Å; A481-V484 VanDerWaalsContact O-N 3.11Å; L482-V484 PolarHBondContact O-N 3.36Å
485	D	86.6	Confident	91.4	Very high	71 Å²	71	48.6 Å²	48.6	38%	0.38	25%	0.245	S	C	.	.			trans	-130.4	102.7	175.1	-175.1	4.7	0	0	0	109.2	A481 L482 Y487 N488	A481-D485 PolarHBondContact O-N 3.24Å; L482-D485 WeakPolarHBondContact CA-O 3.19Å; L482-D485 CarbonylContact O-C 3.47Å; D485-Y487 PolarHBondContact O-N 3.44Å; D485-Y487 PolarHBondContact OD1-N 3.17Å; D485-Y487 VanDerWaalsContact OD1-N 3.07Å; D485-N488 HydrophobicContact CB-CB 4.19Å; D485-N488 WeakPolarHBondContact O-CB 3.49Å
486	R	89.1	Confident	91.4	Very high	151 Å²	151	46.6 Å²	46.6	57%	0.57	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.1	-179.9	-179.2	174.4	177	-174.1	-3.2	112.2	L482 N488 E514	L482-R486 WeakPolarHBondContact O-CA 3.41Å; L482-R486 PolarHBondContact O-N 3.08Å; R486-N488 VanDerWaalsContact C-N 3.31Å; R486-N488 PolarHBondContact O-N 3.21Å; R486-E514 IonicContact CZ-OE1 3.84Å; R486-E514 IonicContact NE-OE1 2.71Å; R486-E514 IonicContact NH2-OE1 3.53Å; R486-E514 PolarHBondContact NH2-OE1 3.18Å; R486-E514 VanDerWaalsContact NH2-OE1 3.12Å
487	Y	87.3	Confident	91.4	Very high	150 Å²	150	42.3 Å²	42.3	59%	0.588	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	25.9	-171.5	-54.7	-72.1	0	0	0	112.3	D485 P489 D518	D485-Y487 PolarHBondContact O-N 3.44Å; D485-Y487 PolarHBondContact OD1-N 3.17Å; D485-Y487 VanDerWaalsContact OD1-N 3.07Å; Y487-P489 WeakPolarHBondContact O-CD 3.23Å; Y487-D518 WeakPolarHBondContact CA-OD2 3.48Å; Y487-D518 WeakPolarHBondContact CD1-OD1 3.43Å
488	N	88.1	Confident	91.4	Very high	23 Å²	23	41.8 Å²	41.8	12%	0.123	22%	0.215	C	C	.	.			trans	-88.8	103.1	179.1	176.1	-5.8	0	0	0	110.1	C455 T459 D485 R486 A490 A491 L492	C455-N488 PolarHBondContact SG-ND2 2.89Å; T459-N488 PolarHBondContact OG1-ND2 2.69Å; D485-N488 HydrophobicContact CB-CB 4.19Å; D485-N488 WeakPolarHBondContact O-CB 3.49Å; R486-N488 VanDerWaalsContact C-N 3.31Å; R486-N488 PolarHBondContact O-N 3.21Å; N488-A490 VanDerWaalsContact C-N 3.28Å; N488-A490 PolarHBondContact O-N 2.94Å; N488-A490 PolarHBondContact OD1-N 3.39Å; N488-A490 VanDerWaalsContact OD1-N 3.15Å; N488-A491 HydrophobicContact CB-CB 4.07Å; N488-A491 PolarHBondContact O-N 3.12Å; N488-A491 PolarHBondContact OD1-N 2.8Å; N488-L492 PolarHBondContact O-N 3.03Å; N488-L492 VanDerWaalsContact O-N 3.14Å
489	P	90.7	Very high	91.5	Very high	31 Å²	31	41.8 Å²	41.8	20%	0.201	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-32	-175.2	26.7	-35.8	0	0	0	112.3	Y487 L492 V493 A515 D519 C522	Y487-P489 WeakPolarHBondContact O-CD 3.23Å; P489-L492 PolarHBondContact O-N 3.37Å; P489-V493 WeakPolarHBondContact O-CB 3.32Å; P489-V493 VanDerWaalsContact O-CG2 3.27Å; P489-V493 WeakPolarHBondContact O-CG2 3.43Å; P489-V493 PolarHBondContact O-N 3.13Å; P489-A515 HydrophobicContact CB-CB 4.15Å; P489-D519 HydrophobicContact CB-CB 4.21Å; P489-D519 HydrophobicContact CG-CB 4.02Å; P489-C522 HydrophobicContact CB-CB 4.5Å
490	A	90.8	Very high	91.6	Very high	45 Å²	45	40.2 Å²	40.2	37%	0.372	21%	0.205	S	C	.	.	H	α-helix	trans	-69	-35.2	178.7	0	0	0	0	0	112.3	T459 N488 N494	T459-A490 HydrophobicContact CG2-CB 3.76Å; N488-A490 VanDerWaalsContact C-N 3.28Å; N488-A490 PolarHBondContact O-N 2.94Å; N488-A490 PolarHBondContact OD1-N 3.39Å; N488-A490 VanDerWaalsContact OD1-N 3.15Å; A490-N494 WeakPolarHBondContact O-CB 3.49Å; A490-N494 VanDerWaalsContact O-CG 3.26Å; A490-N494 PolarHBondContact O-N 3.3Å; A490-N494 PolarHBondContact O-ND2 3.41Å
491	A	91.9	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-39.2	173.9	0	0	0	0	0	112	T459 A481 L482 N488 N494 K495	T459-A491 HydrophobicContact CG2-CB 4.49Å; A481-A491 HydrophobicContact CB-CB 3.69Å; L482-A491 HydrophobicContact CD2-CB 3.68Å; L482-A491 HydrophobicContact CG-CB 3.95Å; N488-A491 HydrophobicContact CB-CB 4.07Å; N488-A491 PolarHBondContact O-N 3.12Å; N488-A491 PolarHBondContact OD1-N 2.8Å; A491-N494 PolarHBondContact O-N 3.23Å; A491-K495 WeakPolarHBondContact O-CB 3.35Å; A491-K495 PolarHBondContact O-N 2.96Å
492	L	94.2	Very high	91.6	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-42.5	173.5	-70.5	171.4	0	0	0	111.8	L482 N488 P489 K495 G496 E514 A515	L482-L492 HydrophobicContact CD1-CD2 3.97Å; L482-L492 HydrophobicContact CD2-CD2 3.59Å; L482-L492 HydrophobicContact CD2-CG 3.65Å; L482-L492 HydrophobicContact CG-CD2 4.45Å; N488-L492 PolarHBondContact O-N 3.03Å; N488-L492 VanDerWaalsContact O-N 3.14Å; P489-L492 PolarHBondContact O-N 3.37Å; L492-K495 PolarHBondContact O-N 2.98Å; L492-G496 PolarHBondContact O-N 2.94Å; L492-E514 HydrophobicContact CD1-CB 4.07Å; L492-E514 HydrophobicContact CD1-CG 3.9Å; L492-E514 HydrophobicContact CD2-CB 4.46Å; L492-E514 HydrophobicContact CD2-CG 4.37Å; L492-A515 HydrophobicContact CB-CB 3.79Å; L492-A515 HydrophobicContact CD1-CB 4.21Å
493	V	93.9	Very high	91.7	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-60.6	-49.2	173.1	166.2	0	0	0	0	111.2	P489 K495 G496 N497 Y512 A515 E524 A525	P489-V493 WeakPolarHBondContact O-CB 3.32Å; P489-V493 VanDerWaalsContact O-CG2 3.27Å; P489-V493 WeakPolarHBondContact O-CG2 3.43Å; P489-V493 PolarHBondContact O-N 3.13Å; V493-K495 VanDerWaalsContact C-N 3.3Å; V493-K495 PolarHBondContact O-N 2.97Å; V493-G496 CarbonylContact O-C 3.47Å; V493-G496 WeakPolarHBondContact O-CA 3.34Å; V493-G496 PolarHBondContact O-N 3.05Å; V493-N497 PolarHBondContact O-N 3.02Å; V493-N497 PolarHBondContact O-OD1 3.32Å; V493-N497 VanDerWaalsContact O-OD1 3.13Å; V493-Y512 HydrophobicContact CG1-CE1 4.29Å; V493-Y512 HydrophobicContact CG2-CD1 4.22Å; V493-A515 HydrophobicContact CG2-CB 4.16Å; V493-E524 HydrophobicContact CG1-CB 4.03Å; V493-E524 HydrophobicContact CG2-CB 4.39Å; V493-A525 HydrophobicContact CG2-CB 3.61Å
494	N	93.2	Very high	91.8	Very high	15 Å²	15	48.7 Å²	48.7	8%	0.08	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-39.7	179.1	-73.4	-16.8	0	0	0	112.1	T459 A490 A491 N497 V498	T459-N494 PolarHBondContact O-ND2 2.88Å; A490-N494 WeakPolarHBondContact O-CB 3.49Å; A490-N494 VanDerWaalsContact O-CG 3.26Å; A490-N494 PolarHBondContact O-N 3.3Å; A490-N494 PolarHBondContact O-ND2 3.41Å; A491-N494 PolarHBondContact O-N 3.23Å; N494-N497 WeakPolarHBondContact O-CB 3.13Å; N494-N497 PolarHBondContact O-N 3.28Å; N494-V498 WeakPolarHBondContact O-CG2 3.32Å; N494-V498 PolarHBondContact O-N 2.91Å; N494-V498 VanDerWaalsContact O-N 3.1Å
495	K	94.3	Very high	92.1	Very high	39 Å²	39	48.2 Å²	48.2	17%	0.17	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-43.5	172.1	-172.6	167.3	-178.6	166.8	0	112.1	A478 D479 L482 A491 L492 V493 N497 V498 L499	A478-K495 HydrophobicContact CB-CB 3.96Å; D479-K495 WeakPolarHBondContact OD1-CE 3.47Å; D479-K495 IonicContact OD1-NZ 3.3Å; D479-K495 PolarHBondContact OD1-NZ 2.59Å; D479-K495 IonicContact OD2-NZ 3.05Å; L482-K495 HydrophobicContact CD1-CB 4.45Å; L482-K495 HydrophobicContact CD1-CD 3.65Å; A491-K495 WeakPolarHBondContact O-CB 3.35Å; A491-K495 PolarHBondContact O-N 2.96Å; L492-K495 PolarHBondContact O-N 2.98Å; V493-K495 VanDerWaalsContact C-N 3.3Å; V493-K495 PolarHBondContact O-N 2.97Å; K495-N497 VanDerWaalsContact C-N 3.32Å; K495-N497 PolarHBondContact O-N 3.35Å; K495-V498 PolarHBondContact O-N 3.37Å; K495-L499 HydrophobicContact CG-CD1 4.08Å; K495-L499 WeakPolarHBondContact O-CG 3.46Å; K495-L499 PolarHBondContact O-N 3.41Å
496	G	93.8	Very high	92.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-42.4	173.3	0	0	0	0	0	112.6	L492 V493 L499 Y500 A508 Y512	L492-G496 PolarHBondContact O-N 2.94Å; V493-G496 CarbonylContact O-C 3.47Å; V493-G496 WeakPolarHBondContact O-CA 3.34Å; V493-G496 PolarHBondContact O-N 3.05Å; G496-L499 PolarHBondContact O-N 3.24Å; G496-Y500 WeakPolarHBondContact O-CB 3.14Å; G496-Y500 PolarHBondContact O-N 3.34Å; G496-A508 WeakPolarHBondContact O-CB 3.4Å; G496-Y512 VanDerWaalsContact C-CZ 3.45Å; G496-Y512 PolarHBondContact O-OH 3.03Å
497	N	93.9	Very high	92.8	Very high	4 Å²	4	47 Å²	47	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-46.1	179.2	-61.6	-14.2	0	0	0	110.9	Y11 F466 V493 N494 K495 Y500 Q501 Y512 N528	Y11-N497 VanDerWaalsContact OH-CG 3.23Å; Y11-N497 PolarHBondContact OH-ND2 2.98Å; Y11-N497 PolarHBondContact OH-OD1 3.06Å; Y11-N497 VanDerWaalsContact OH-OD1 3.13Å; F466-N497 HydrophobicContact CD2-CB 4.18Å; F466-N497 HydrophobicContact CE1-CB 4.35Å; F466-N497 HydrophobicContact CE2-CB 3.83Å; F466-N497 WeakPolarHBondContact CE2-O 3.34Å; F466-N497 HydrophobicContact CZ-CB 3.93Å; V493-N497 PolarHBondContact O-N 3.02Å; V493-N497 PolarHBondContact O-OD1 3.32Å; V493-N497 VanDerWaalsContact O-OD1 3.13Å; N494-N497 WeakPolarHBondContact O-CB 3.13Å; N494-N497 PolarHBondContact O-N 3.28Å; K495-N497 VanDerWaalsContact C-N 3.32Å; K495-N497 PolarHBondContact O-N 3.35Å; N497-Y500 WeakPolarHBondContact O-CB 3.24Å; N497-Y500 PolarHBondContact O-N 3.23Å; N497-Q501 PolarHBondContact O-N 3.08Å; N497-Y512 WeakPolarHBondContact CA-OH 3.25Å; N497-Y512 PolarHBondContact N-OH 2.88Å; N497-Y512 PolarHBondContact OD1-OH 3.04Å; N497-N528 PolarHBondContact OD1-ND2 3.44Å
498	V	94.2	Very high	93.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-45	176.5	176.6	0	0	0	0	111	F466 L471 A474 E475 N494 K495 Y500 Q501 Q502	F466-V498 HydrophobicContact CD2-CG2 3.87Å; L471-V498 HydrophobicContact CB-CG1 4.16Å; L471-V498 HydrophobicContact CD2-CG1 4.45Å; A474-V498 HydrophobicContact CB-CG2 3.46Å; A474-V498 VanDerWaalsContact CB-CG2 3.46Å; E475-V498 HydrophobicContact CB-CG1 3.99Å; N494-V498 WeakPolarHBondContact O-CG2 3.32Å; N494-V498 PolarHBondContact O-N 2.91Å; N494-V498 VanDerWaalsContact O-N 3.1Å; K495-V498 PolarHBondContact O-N 3.37Å; V498-Y500 VanDerWaalsContact C-N 3.32Å; V498-Y500 PolarHBondContact O-N 2.83Å; V498-Q501 PolarHBondContact O-N 3.4Å; V498-Q502 HydrophobicContact CG1-CG 4.48Å; V498-Q502 VanDerWaalsContact O-CG 3.32Å; V498-Q502 WeakPolarHBondContact O-CG 3.38Å; V498-Q502 PolarHBondContact O-N 2.9Å
499	L	94.6	Very high	93.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-35.1	176.7	-71.7	167.2	0	0	0	112.7	K495 G496 Q502 Q503 Q504 R507 A508	K495-L499 HydrophobicContact CG-CD1 4.08Å; K495-L499 WeakPolarHBondContact O-CG 3.46Å; K495-L499 PolarHBondContact O-N 3.41Å; G496-L499 PolarHBondContact O-N 3.24Å; L499-Q502 CarbonylContact O-C 3.51Å; L499-Q502 PolarHBondContact O-N 3.46Å; L499-Q503 PolarHBondContact O-N 2.81Å; L499-Q504 HydrophobicContact CB-CB 4.46Å; L499-Q504 HydrophobicContact CD2-CB 4.25Å; L499-Q504 PolarHBondContact O-N 3.06Å; L499-R507 HydrophobicContact CD1-CB 4.03Å; L499-R507 HydrophobicContact CD2-CB 4.42Å; L499-A508 HydrophobicContact CB-CB 3.92Å
500	Y	94	Very high	93.7	Very high	34 Å²	34	43.8 Å²	43.8	13%	0.133	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-45.9	174.3	-175.7	-94.5	0	0	0	111.3	L10 G496 N497 V498 Q502 Q503 Y505 V532 Q535	L10-Y500 HydrophobicContact CD1-CE1 4.44Å; L10-Y500 HydrophobicContact CD2-CD1 4.47Å; L10-Y500 HydrophobicContact CD2-CE1 4.19Å; G496-Y500 WeakPolarHBondContact O-CB 3.14Å; G496-Y500 PolarHBondContact O-N 3.34Å; N497-Y500 WeakPolarHBondContact O-CB 3.24Å; N497-Y500 PolarHBondContact O-N 3.23Å; V498-Y500 VanDerWaalsContact C-N 3.32Å; V498-Y500 PolarHBondContact O-N 2.83Å; Y500-Q502 VanDerWaalsContact C-N 3.3Å; Y500-Q502 PolarHBondContact O-N 2.87Å; Y500-Q503 WeakPolarHBondContact O-CA 3.34Å; Y500-Q503 PolarHBondContact O-N 3.35Å; Y500-Y505 AromaticContact CD2-CD1 3.52Å; Y500-Y505 HydrophobicContact CD2-CD1 3.52Å; Y500-Y505 AromaticContact CD2-CE1 3.68Å; Y500-Y505 HydrophobicContact CD2-CE1 3.68Å; Y500-Y505 AromaticContact CE2-CD1 3.63Å; Y500-Y505 HydrophobicContact CE2-CD1 3.63Å; Y500-Y505 AromaticContact CE2-CE1 3.55Å; Y500-Y505 HydrophobicContact CE2-CE1 3.55Å; Y500-Y505 HydrophobicContact CG-CD1 4.35Å; Y500-Y505 HydrophobicContact CG-CE1 4.25Å; Y500-V532 HydrophobicContact CD2-CB 4.41Å; Y500-V532 HydrophobicContact CD2-CG2 3.42Å; Y500-V532 VanDerWaalsContact CD2-CG2 3.42Å; Y500-V532 HydrophobicContact CE2-CB 4.47Å; Y500-V532 HydrophobicContact CE2-CG2 3.77Å; Y500-V532 HydrophobicContact CG-CG2 4.46Å; Y500-Q535 HydrophobicContact CE2-CB 4.33Å; Y500-Q535 HydrophobicContact CE2-CG 4.43Å
501	Q	91.8	Very high	93.9	Very high	117 Å²	117	42.4 Å²	42.4	55%	0.547	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-29.6	176.6	-159.7	67.7	4.1	0	0	112.6	F466 L471 N497 V498 Q503	F466-Q501 HydrophobicContact CE2-CB 4.09Å; L471-Q501 HydrophobicContact CD1-CB 4.01Å; L471-Q501 HydrophobicContact CD1-CG 3.8Å; L471-Q501 HydrophobicContact CD2-CB 4.03Å; L471-Q501 HydrophobicContact CD2-CG 4.02Å; N497-Q501 PolarHBondContact O-N 3.08Å; V498-Q501 PolarHBondContact O-N 3.4Å; Q501-Q503 PolarHBondContact O-N 3.28Å
502	Q	92.7	Very high	94	Very high	53 Å²	53	42.5 Å²	42.5	25%	0.248	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	7.4	168.4	-66.1	179.5	14.4	0	0	113.7	L471 E475 V498 L499 Y500 Q504	L471-Q502 HydrophobicContact CD1-CG 4.26Å; E475-Q502 PolarHBondContact OE2-NE2 2.79Å; V498-Q502 HydrophobicContact CG1-CG 4.48Å; V498-Q502 VanDerWaalsContact O-CG 3.32Å; V498-Q502 WeakPolarHBondContact O-CG 3.38Å; V498-Q502 PolarHBondContact O-N 2.9Å; L499-Q502 CarbonylContact O-C 3.51Å; L499-Q502 PolarHBondContact O-N 3.46Å; Y500-Q502 VanDerWaalsContact C-N 3.3Å; Y500-Q502 PolarHBondContact O-N 2.87Å; Q502-Q504 HydrophobicContact CB-CG 4.48Å; Q502-Q504 PolarHBondContact O-N 3.09Å
503	Q	91.8	Very high	94	Very high	147 Å²	147	44 Å²	44	69%	0.687	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	18.5	-177.7	-55.6	179.5	-3.2	0	0	114.9	L499 Y500 Q501 Y505	L499-Q503 PolarHBondContact O-N 2.81Å; Y500-Q503 WeakPolarHBondContact O-CA 3.34Å; Y500-Q503 PolarHBondContact O-N 3.35Å; Q501-Q503 PolarHBondContact O-N 3.28Å; Q503-Y505 VanDerWaalsContact C-N 3.28Å; Q503-Y505 HydrophobicContact CB-CE2 4.3Å; Q503-Y505 PolarHBondContact O-N 3.35Å; Q503-Y505 VanDerWaalsContact O-N 3.16Å
504	Q	93.9	Very high	93.9	Very high	64 Å²	64	46.5 Å²	46.5	30%	0.299	22%	0.216	S	C	.	.			trans	-91.6	58.2	179.2	-68.4	175.4	56.1	0	0	111.1	L499 Q502 E506 R507 A508	L499-Q504 HydrophobicContact CB-CB 4.46Å; L499-Q504 HydrophobicContact CD2-CB 4.25Å; L499-Q504 PolarHBondContact O-N 3.06Å; Q502-Q504 HydrophobicContact CB-CG 4.48Å; Q502-Q504 PolarHBondContact O-N 3.09Å; Q504-E506 PolarHBondContact O-N 2.91Å; Q504-R507 HydrophobicContact CB-CB 4.42Å; Q504-R507 PolarHBondContact O-N 3.24Å; Q504-A508 PolarHBondContact O-N 2.98Å
505	Y	94.6	Very high	93.9	Very high	56 Å²	56	45.8 Å²	45.8	22%	0.22	21%	0.213	C	C	.	.	H	α-helix	trans	-54	-43.9	-169.3	-58.1	-55.8	0	0	0	114.6	Y500 Q503 R507 A508 R509 V532 Q535	Y500-Y505 AromaticContact CD2-CD1 3.52Å; Y500-Y505 HydrophobicContact CD2-CD1 3.52Å; Y500-Y505 AromaticContact CD2-CE1 3.68Å; Y500-Y505 HydrophobicContact CD2-CE1 3.68Å; Y500-Y505 AromaticContact CE2-CD1 3.63Å; Y500-Y505 HydrophobicContact CE2-CD1 3.63Å; Y500-Y505 AromaticContact CE2-CE1 3.55Å; Y500-Y505 HydrophobicContact CE2-CE1 3.55Å; Y500-Y505 HydrophobicContact CG-CD1 4.35Å; Y500-Y505 HydrophobicContact CG-CE1 4.25Å; Q503-Y505 VanDerWaalsContact C-N 3.28Å; Q503-Y505 HydrophobicContact CB-CE2 4.3Å; Q503-Y505 PolarHBondContact O-N 3.35Å; Q503-Y505 VanDerWaalsContact O-N 3.16Å; Y505-R507 PolarHBondContact O-N 3.45Å; Y505-A508 PolarHBondContact O-N 2.85Å; Y505-R509 WeakPolarHBondContact O-CB 3.42Å; Y505-R509 PolarHBondContact O-N 3.4Å; Y505-V532 WeakPolarHBondContact O-CG1 3.33Å; Y505-Q535 HydrophobicContact CD1-CG 4.1Å; Y505-Q535 HydrophobicContact CD2-CG 4.36Å; Y505-Q535 HydrophobicContact CE1-CG 3.76Å; Y505-Q535 HydrophobicContact CE2-CG 4.02Å; Y505-Q535 HydrophobicContact CG-CG 4.39Å
506	E	95.3	Very high	93.8	Very high	79 Å²	79	45.2 Å²	45.2	37%	0.369	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-43	177.2	-65.4	-68.4	165.1	0	0	112.3	Q504 R509 D510 L536 R538	Q504-E506 PolarHBondContact O-N 2.91Å; E506-R509 WeakPolarHBondContact O-CB 3.32Å; E506-R509 PolarHBondContact O-N 3.05Å; E506-R509 IonicContact OE2-CZ 3.06Å; E506-R509 IonicContact OE2-NE 2.99Å; E506-R509 IonicContact OE2-NH2 3.32Å; E506-D510 PolarHBondContact O-N 3.05Å; E506-L536 HydrophobicContact CG-CD2 4.35Å; E506-L536 WeakPolarHBondContact OE1-CD2 3.41Å; E506-R538 IonicContact OE1-CZ 3.07Å; E506-R538 IonicContact OE1-NH2 3.74Å; E506-R538 PolarHBondContact OE1-NH2 3.35Å; E506-R538 IonicContact OE2-CZ 3.9Å; E506-R538 IonicContact OE2-NH2 2.67Å; E506-R538 PolarHBondContact OE2-NH2 2.9Å
507	R	94.6	Very high	93.7	Very high	119 Å²	119	52.2 Å²	52.2	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-70.1	-35.3	178.1	-64.4	-179	67.8	-155.9	-0.1	111.8	L499 Q504 Y505 D510 C511	L499-R507 HydrophobicContact CD1-CB 4.03Å; L499-R507 HydrophobicContact CD2-CB 4.42Å; Q504-R507 HydrophobicContact CB-CB 4.42Å; Q504-R507 PolarHBondContact O-N 3.24Å; Y505-R507 PolarHBondContact O-N 3.45Å; R507-D510 PolarHBondContact O-N 2.78Å; R507-C511 PolarHBondContact O-N 2.91Å; R507-C511 VanDerWaalsContact O-N 3.08Å; R507-C511 PolarHBondContact O-SG 2.96Å; R507-C511 VanDerWaalsContact O-SG 3.38Å
508	A	95.2	Very high	93.3	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-48.3	173.4	0	0	0	0	0	110.9	G496 L499 Q504 Y505 D510 C511 Y512 V532	G496-A508 WeakPolarHBondContact O-CB 3.4Å; L499-A508 HydrophobicContact CB-CB 3.92Å; Q504-A508 PolarHBondContact O-N 2.98Å; Y505-A508 PolarHBondContact O-N 2.85Å; A508-D510 VanDerWaalsContact C-N 3.3Å; A508-D510 PolarHBondContact O-N 2.79Å; A508-C511 PolarHBondContact O-N 2.97Å; A508-C511 VanDerWaalsContact O-N 3.16Å; A508-Y512 HydrophobicContact CB-CE2 3.97Å; A508-Y512 WeakPolarHBondContact O-CD2 3.25Å; A508-Y512 WeakPolarHBondContact O-CE2 3.38Å; A508-Y512 PolarHBondContact O-N 3.44Å; A508-V532 HydrophobicContact CB-CG2 4.45Å
509	R	95	Very high	92.9	Very high	56 Å²	56	58 Å²	58	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-53.8	-45.9	174.1	-174	-156.4	65.8	143.6	-1.3	111.5	Y505 E506 C511 Y512 A513 L529 V532 E541	Y505-R509 WeakPolarHBondContact O-CB 3.42Å; Y505-R509 PolarHBondContact O-N 3.4Å; E506-R509 WeakPolarHBondContact O-CB 3.32Å; E506-R509 PolarHBondContact O-N 3.05Å; E506-R509 IonicContact OE2-CZ 3.06Å; E506-R509 IonicContact OE2-NE 2.99Å; E506-R509 IonicContact OE2-NH2 3.32Å; R509-C511 PolarHBondContact O-N 3.32Å; R509-Y512 PolarHBondContact O-N 3.13Å; R509-A513 WeakPolarHBondContact O-CB 3.38Å; R509-A513 PolarHBondContact O-N 2.99Å; R509-L529 HydrophobicContact CB-CD1 4.45Å; R509-L529 HydrophobicContact CG-CD1 3.53Å; R509-V532 HydrophobicContact CB-CG1 3.89Å; R509-E541 IonicContact NH1-OE2 3.87Å
510	D	95.2	Very high	92.5	Very high	80 Å²	80	63 Å²	63	43%	0.428	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-41	178.7	-65.4	-12.4	0	0	0	112	E506 R507 A508 A513 E514	E506-D510 PolarHBondContact O-N 3.05Å; R507-D510 PolarHBondContact O-N 2.78Å; A508-D510 VanDerWaalsContact C-N 3.3Å; A508-D510 PolarHBondContact O-N 2.79Å; D510-A513 PolarHBondContact O-N 3.07Å; D510-E514 PolarHBondContact O-N 3.32Å
511	C	93.5	Very high	91.9	Very high	15 Å²	15	65.3 Å²	65.3	10%	0.101	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-41.2	174.9	-69.1	0	0	0	0	112.9	R507 A508 R509 A513 E514 A515	R507-C511 PolarHBondContact O-N 2.91Å; R507-C511 VanDerWaalsContact O-N 3.08Å; R507-C511 PolarHBondContact O-SG 2.96Å; R507-C511 VanDerWaalsContact O-SG 3.38Å; A508-C511 PolarHBondContact O-N 2.97Å; A508-C511 VanDerWaalsContact O-N 3.16Å; R509-C511 PolarHBondContact O-N 3.32Å; C511-A513 VanDerWaalsContact C-N 3.31Å; C511-E514 PolarHBondContact O-N 3.39Å; C511-A515 PolarHBondContact O-N 2.79Å
512	Y	94.8	Very high	91.6	Very high	3 Å²	3	60.2 Å²	60.2	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-33.3	174.1	-55.4	-55.8	0	0	0	112	V493 G496 N497 A508 R509 A515 L516 N528 V532	V493-Y512 HydrophobicContact CG1-CE1 4.29Å; V493-Y512 HydrophobicContact CG2-CD1 4.22Å; G496-Y512 VanDerWaalsContact C-CZ 3.45Å; G496-Y512 PolarHBondContact O-OH 3.03Å; N497-Y512 WeakPolarHBondContact CA-OH 3.25Å; N497-Y512 PolarHBondContact N-OH 2.88Å; N497-Y512 PolarHBondContact OD1-OH 3.04Å; A508-Y512 HydrophobicContact CB-CE2 3.97Å; A508-Y512 WeakPolarHBondContact O-CD2 3.25Å; A508-Y512 WeakPolarHBondContact O-CE2 3.38Å; A508-Y512 PolarHBondContact O-N 3.44Å; R509-Y512 PolarHBondContact O-N 3.13Å; Y512-A515 PolarHBondContact O-N 3.45Å; Y512-L516 VanDerWaalsContact O-CG 3.26Å; Y512-L516 WeakPolarHBondContact O-CG 3.43Å; Y512-L516 PolarHBondContact O-N 3.04Å; Y512-N528 HydrophobicContact CD1-CB 3.94Å; Y512-N528 HydrophobicContact CD2-CB 4.25Å; Y512-N528 HydrophobicContact CE1-CB 3.52Å; Y512-N528 HydrophobicContact CE2-CB 3.9Å; Y512-N528 HydrophobicContact CG-CB 4.28Å; Y512-N528 VanDerWaalsContact CZ-CB 3.48Å; Y512-V532 HydrophobicContact CD2-CG2 4Å; Y512-V532 HydrophobicContact CE2-CG2 3.47Å; Y512-V532 VanDerWaalsContact CE2-CG2 3.47Å
513	A	93.5	Very high	91.4	Very high	34 Å²	34	58.8 Å²	58.8	28%	0.281	29%	0.286	S	S	.	.	H	α-helix	trans	-70.6	-32.3	174.9	0	0	0	0	0	113.1	R509 D510 C511 Q517	R509-A513 WeakPolarHBondContact O-CB 3.38Å; R509-A513 PolarHBondContact O-N 2.99Å; D510-A513 PolarHBondContact O-N 3.07Å; C511-A513 VanDerWaalsContact C-N 3.31Å; A513-Q517 WeakPolarHBondContact O-CG 3.31Å; A513-Q517 PolarHBondContact O-N 2.94Å; A513-Q517 PolarHBondContact O-NE2 3.48Å
514	E	93.2	Very high	91.2	Very high	61 Å²	61	54.9 Å²	54.9	29%	0.285	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-46	169.3	-163.4	170	-163.5	0	0	109.6	R486 L492 D510 C511 L516 Q517 D518	R486-E514 IonicContact CZ-OE1 3.84Å; R486-E514 IonicContact NE-OE1 2.71Å; R486-E514 IonicContact NH2-OE1 3.53Å; R486-E514 PolarHBondContact NH2-OE1 3.18Å; R486-E514 VanDerWaalsContact NH2-OE1 3.12Å; L492-E514 HydrophobicContact CD1-CB 4.07Å; L492-E514 HydrophobicContact CD1-CG 3.9Å; L492-E514 HydrophobicContact CD2-CB 4.46Å; L492-E514 HydrophobicContact CD2-CG 4.37Å; D510-E514 PolarHBondContact O-N 3.32Å; C511-E514 PolarHBondContact O-N 3.39Å; E514-L516 PolarHBondContact O-N 2.9Å; E514-Q517 WeakPolarHBondContact O-CB 3.14Å; E514-Q517 PolarHBondContact O-N 3.28Å; E514-D518 PolarHBondContact O-N 3.37Å
515	A	92.8	Very high	91.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.2	-35.5	176.9	0	0	0	0	0	113.5	P489 L492 V493 C511 Y512 D519 A525	P489-A515 HydrophobicContact CB-CB 4.15Å; L492-A515 HydrophobicContact CB-CB 3.79Å; L492-A515 HydrophobicContact CD1-CB 4.21Å; V493-A515 HydrophobicContact CG2-CB 4.16Å; C511-A515 PolarHBondContact O-N 2.79Å; Y512-A515 PolarHBondContact O-N 3.45Å; A515-D519 PolarHBondContact O-N 3.48Å; A515-A525 HydrophobicContact CB-CB 3.92Å
516	L	90.7	Very high	91	Very high	26 Å²	26	49.5 Å²	49.5	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-81.3	-13.5	178	-68.8	168.4	0	0	0	114.5	Y512 E514 T520 C522 A525 L526 L529	Y512-L516 VanDerWaalsContact O-CG 3.26Å; Y512-L516 WeakPolarHBondContact O-CG 3.43Å; Y512-L516 PolarHBondContact O-N 3.04Å; E514-L516 PolarHBondContact O-N 2.9Å; L516-T520 WeakPolarHBondContact O-CA 3.46Å; L516-T520 PolarHBondContact O-N 2.99Å; L516-C522 HydrophobicContact CD2-CB 4.46Å; L516-A525 HydrophobicContact CD1-CB 4.34Å; L516-A525 HydrophobicContact CD2-CB 3.78Å; L516-A525 HydrophobicContact CG-CB 3.74Å; L516-L526 HydrophobicContact CD1-CD2 3.91Å; L516-L526 HydrophobicContact CD1-CG 4.45Å; L516-L526 HydrophobicContact CD2-CD2 3.83Å; L516-L526 HydrophobicContact CD2-CG 3.67Å; L516-L529 HydrophobicContact CD1-CB 4.43Å; L516-L529 HydrophobicContact CD1-CD2 3.64Å
517	Q	91.6	Very high	90.8	Very high	148 Å²	148	47 Å²	47	69%	0.692	23%	0.232	S	C	*	.	H	α-helix	trans	-75.6	-37.3	168.1	-75.2	165	63.1	0	0	110.6	A513 E514	A513-Q517 WeakPolarHBondContact O-CG 3.31Å; A513-Q517 PolarHBondContact O-N 2.94Å; A513-Q517 PolarHBondContact O-NE2 3.48Å; E514-Q517 WeakPolarHBondContact O-CB 3.14Å; E514-Q517 PolarHBondContact O-N 3.28Å
518	D	87.3	Confident	90.7	Very high	63 Å²	63	41.4 Å²	41.4	34%	0.337	21%	0.211	S	C	.	.	H	α-helix	trans	-79.9	-51	179.4	-63.5	-26.5	0	0	0	112.1	Y487 E514	Y487-D518 WeakPolarHBondContact CA-OD2 3.48Å; Y487-D518 WeakPolarHBondContact CD1-OD1 3.43Å; E514-D518 PolarHBondContact O-N 3.37Å
519	D	85.4	Confident	90.7	Very high	63 Å²	63	42.7 Å²	42.7	34%	0.337	22%	0.218	S	C	.	.			trans	-122	95	170.1	-177.4	11.6	0	0	0	111.7	P489 A515 R521 C522	P489-D519 HydrophobicContact CB-CB 4.21Å; P489-D519 HydrophobicContact CG-CB 4.02Å; A515-D519 PolarHBondContact O-N 3.48Å; D519-R521 PolarHBondContact O-N 3.34Å; D519-R521 WeakPolarHBondContact OD1-CA 3.2Å; D519-R521 WeakPolarHBondContact OD1-CB 3.4Å; D519-R521 PolarHBondContact OD1-N 2.88Å; D519-C522 HydrophobicContact CB-CB 4.14Å; D519-C522 WeakPolarHBondContact O-CB 3.48Å; D519-C522 PolarHBondContact O-N 3.11Å; D519-C522 PolarHBondContact OD2-N 3.44Å
520	T	86.2	Confident	90.5	Very high	105 Å²	105	40 Å²	40	64%	0.644	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-11.8	173.4	61.6	0	0	0	0	115.2	L516	L516-T520 WeakPolarHBondContact O-CA 3.46Å; L516-T520 PolarHBondContact O-N 2.99Å
521	R	80.7	Confident	90.4	Very high	83 Å²	83	36.8 Å²	36.8	31%	0.313	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	3.9	-179.3	-66.4	177.4	165.5	-174.9	-10.5	113.8	V27 D519 V523	V27-R521 VanDerWaalsContact CG2-NH1 3.25Å; D519-R521 PolarHBondContact O-N 3.34Å; D519-R521 WeakPolarHBondContact OD1-CA 3.2Å; D519-R521 WeakPolarHBondContact OD1-CB 3.4Å; D519-R521 PolarHBondContact OD1-N 2.88Å; R521-V523 PolarHBondContact O-N 3.13Å
522	C	85.3	Confident	90.5	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.061	19%	0.186	C	C	.	.			trans	-60.3	108.5	176.8	179.1	0	0	0	0	110.3	P489 L516 D519 E524 A525 L526	P489-C522 HydrophobicContact CB-CB 4.5Å; L516-C522 HydrophobicContact CD2-CB 4.46Å; D519-C522 HydrophobicContact CB-CB 4.14Å; D519-C522 WeakPolarHBondContact O-CB 3.48Å; D519-C522 PolarHBondContact O-N 3.11Å; D519-C522 PolarHBondContact OD2-N 3.44Å; C522-E524 VanDerWaalsContact C-N 3.33Å; C522-E524 PolarHBondContact SG-OE2 3.45Å; C522-E524 VanDerWaalsContact SG-OE2 3.36Å; C522-A525 HydrophobicContact CB-CB 3.94Å; C522-A525 PolarHBondContact O-N 2.95Å; C522-A525 VanDerWaalsContact SG-CB 3.57Å; C522-A525 PolarHBondContact SG-N 3.02Å; C522-A525 VanDerWaalsContact SG-N 3.43Å; C522-L526 PolarHBondContact O-N 3.37Å
523	V	88.6	Confident	90.4	Very high	24 Å²	24	36 Å²	36	15%	0.145	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-41.5	-174.3	164.4	0	0	0	0	110.3	F14 R521 L526 Y527 L549 V552 L553	F14-V523 HydrophobicContact CZ-CG1 4.14Å; R521-V523 PolarHBondContact O-N 3.13Å; V523-L526 PolarHBondContact O-N 3.2Å; V523-Y527 WeakPolarHBondContact O-CB 3.4Å; V523-Y527 PolarHBondContact O-N 3.15Å; V523-L549 HydrophobicContact CB-CD1 4.34Å; V523-L549 HydrophobicContact CG1-CD1 3.99Å; V523-L549 HydrophobicContact CG2-CD1 4.4Å; V523-V552 HydrophobicContact CG2-CG1 4.38Å; V523-L553 HydrophobicContact CG1-CD1 3.61Å; V523-L553 HydrophobicContact CG2-CD1 4.33Å; V523-L553 HydrophobicContact CG2-CG 4.43Å
524	E	88.4	Confident	90.4	Very high	64 Å²	64	36 Å²	36	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-48.6	178.4	-58	75.9	-172.8	0	0	110.5	F14 V493 C522 Y527 N528	F14-E524 HydrophobicContact CE1-CG 3.99Å; F14-E524 HydrophobicContact CZ-CG 3.9Å; V493-E524 HydrophobicContact CG1-CB 4.03Å; V493-E524 HydrophobicContact CG2-CB 4.39Å; C522-E524 VanDerWaalsContact C-N 3.33Å; C522-E524 PolarHBondContact SG-OE2 3.45Å; C522-E524 VanDerWaalsContact SG-OE2 3.36Å; E524-Y527 PolarHBondContact O-N 3.5Å; E524-N528 WeakPolarHBondContact O-CB 3.47Å; E524-N528 VanDerWaalsContact O-CG 3.23Å; E524-N528 PolarHBondContact O-N 3.36Å; E524-N528 PolarHBondContact O-OD1 2.85Å
525	A	91	Very high	90.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.6	-41.3	178.4	0	0	0	0	0	112.3	V493 A515 L516 C522 L529	V493-A525 HydrophobicContact CG2-CB 3.61Å; A515-A525 HydrophobicContact CB-CB 3.92Å; L516-A525 HydrophobicContact CD1-CB 4.34Å; L516-A525 HydrophobicContact CD2-CB 3.78Å; L516-A525 HydrophobicContact CG-CB 3.74Å; C522-A525 HydrophobicContact CB-CB 3.94Å; C522-A525 PolarHBondContact O-N 2.95Å; C522-A525 VanDerWaalsContact SG-CB 3.57Å; C522-A525 PolarHBondContact SG-N 3.02Å; C522-A525 VanDerWaalsContact SG-N 3.43Å; A525-L529 WeakPolarHBondContact O-CB 3.39Å; A525-L529 PolarHBondContact O-N 3.28Å
526	L	92.1	Very high	90.4	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-44.8	175	-79.5	177.4	0	0	0	112.3	L516 C522 V523 G530 K548 L549	L516-L526 HydrophobicContact CD1-CD2 3.91Å; L516-L526 HydrophobicContact CD1-CG 4.45Å; L516-L526 HydrophobicContact CD2-CD2 3.83Å; L516-L526 HydrophobicContact CD2-CG 3.67Å; C522-L526 PolarHBondContact O-N 3.37Å; V523-L526 PolarHBondContact O-N 3.2Å; L526-G530 PolarHBondContact O-N 3.35Å; L526-G530 VanDerWaalsContact O-N 3.11Å; L526-K548 HydrophobicContact CD1-CB 4.31Å; L526-K548 HydrophobicContact CD2-CB 4.03Å; L526-K548 HydrophobicContact CD2-CD 4.45Å; L526-L549 HydrophobicContact CB-CB 4.25Å; L526-L549 HydrophobicContact CB-CD1 3.99Å; L526-L549 HydrophobicContact CD1-CB 4.36Å; L526-L549 HydrophobicContact CD1-CD1 4.14Å
527	Y	92.3	Very high	90.5	Very high	25 Å²	25	45.2 Å²	45.2	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-47.7	-179.8	-171.9	-104.4	0	0	0	111.1	F14 V523 E524 G530 L531 F546 L549 Q562	F14-Y527 HydrophobicContact CE2-CD1 4.38Å; V523-Y527 WeakPolarHBondContact O-CB 3.4Å; V523-Y527 PolarHBondContact O-N 3.15Å; E524-Y527 PolarHBondContact O-N 3.5Å; Y527-G530 PolarHBondContact O-N 3.15Å; Y527-L531 HydrophobicContact CD1-CD1 3.92Å; Y527-L531 HydrophobicContact CE1-CD1 3.52Å; Y527-L531 HydrophobicContact CE1-CG 4.26Å; Y527-L531 PolarHBondContact O-N 3.46Å; Y527-F546 HydrophobicContact CD2-CD1 4.42Å; Y527-F546 AromaticContact CD2-CE1 3.69Å; Y527-F546 HydrophobicContact CD2-CE1 3.69Å; Y527-F546 AromaticContact CE2-CE1 3.92Å; Y527-F546 HydrophobicContact CE2-CE1 3.92Å; Y527-F546 HydrophobicContact CG-CE1 4.45Å; Y527-L549 HydrophobicContact CD2-CD2 3.67Å; Y527-L549 HydrophobicContact CG-CD2 4.2Å; Y527-Q562 HydrophobicContact CE2-CG 4.08Å; Y527-Q562 PolarHBondContact OH-NE2 3.49Å
528	N	92.6	Very high	90.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.011	20%	0.203	C	C	.	.	H	α-helix	trans	-69.7	-38.9	-177.8	-65.3	-1.4	0	0	0	111.5	Y11 N497 Y512 E524 G530 L531 V532	Y11-N528 PolarHBondContact OH-ND2 2.98Å; Y11-N528 VanDerWaalsContact OH-ND2 3.11Å; N497-N528 PolarHBondContact OD1-ND2 3.44Å; Y512-N528 HydrophobicContact CD1-CB 3.94Å; Y512-N528 HydrophobicContact CD2-CB 4.25Å; Y512-N528 HydrophobicContact CE1-CB 3.52Å; Y512-N528 HydrophobicContact CE2-CB 3.9Å; Y512-N528 HydrophobicContact CG-CB 4.28Å; Y512-N528 VanDerWaalsContact CZ-CB 3.48Å; E524-N528 WeakPolarHBondContact O-CB 3.47Å; E524-N528 VanDerWaalsContact O-CG 3.23Å; E524-N528 PolarHBondContact O-N 3.36Å; E524-N528 PolarHBondContact O-OD1 2.85Å; N528-G530 VanDerWaalsContact C-N 3.31Å; N528-G530 PolarHBondContact O-N 2.96Å; N528-L531 PolarHBondContact O-N 3.17Å; N528-V532 WeakPolarHBondContact O-CG2 3.2Å; N528-V532 PolarHBondContact O-N 2.91Å
529	L	93.5	Very high	90.9	Very high	28 Å²	28	41.3 Å²	41.3	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-56.2	-45.6	171	-179.4	67.1	0	0	0	111.3	R509 L516 A525 L531 V532 C533 A545	R509-L529 HydrophobicContact CB-CD1 4.45Å; R509-L529 HydrophobicContact CG-CD1 3.53Å; L516-L529 HydrophobicContact CD1-CB 4.43Å; L516-L529 HydrophobicContact CD1-CD2 3.64Å; A525-L529 WeakPolarHBondContact O-CB 3.39Å; A525-L529 PolarHBondContact O-N 3.28Å; L529-L531 VanDerWaalsContact C-N 3.35Å; L529-L531 PolarHBondContact O-N 3.47Å; L529-V532 PolarHBondContact O-N 3.25Å; L529-C533 WeakPolarHBondContact O-CB 3.33Å; L529-C533 PolarHBondContact O-N 3.25Å; L529-C533 PolarHBondContact O-SG 3.33Å; L529-C533 VanDerWaalsContact O-SG 3.35Å; L529-A545 HydrophobicContact CD2-CB 4.34Å; L529-A545 HydrophobicContact CG-CB 4.41Å
530	G	92.2	Very high	91.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-42.8	176.5	0	0	0	0	0	112.9	L526 Y527 N528 K534 A542 F546	L526-G530 PolarHBondContact O-N 3.35Å; L526-G530 VanDerWaalsContact O-N 3.11Å; Y527-G530 PolarHBondContact O-N 3.15Å; N528-G530 VanDerWaalsContact C-N 3.31Å; N528-G530 PolarHBondContact O-N 2.96Å; G530-K534 WeakPolarHBondContact O-CB 3.42Å; G530-K534 PolarHBondContact O-N 2.89Å; G530-A542 WeakPolarHBondContact O-CB 3.46Å; G530-F546 VanDerWaalsContact C-CZ 3.46Å; G530-F546 VanDerWaalsContact CA-CE2 3.49Å
531	L	92.7	Very high	91.5	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-43.4	175.6	-69.4	178.5	0	0	0	112.6	L10 Y527 N528 L529 K534 Q535 F546 Q562	L10-L531 HydrophobicContact CD1-CD1 4.11Å; L10-L531 HydrophobicContact CD2-CD1 3.93Å; L10-L531 HydrophobicContact CG-CD1 3.93Å; Y527-L531 HydrophobicContact CD1-CD1 3.92Å; Y527-L531 HydrophobicContact CE1-CD1 3.52Å; Y527-L531 HydrophobicContact CE1-CG 4.26Å; Y527-L531 PolarHBondContact O-N 3.46Å; N528-L531 PolarHBondContact O-N 3.17Å; L529-L531 VanDerWaalsContact C-N 3.35Å; L529-L531 PolarHBondContact O-N 3.47Å; L531-K534 WeakPolarHBondContact O-CB 3.28Å; L531-K534 PolarHBondContact O-N 3.33Å; L531-Q535 PolarHBondContact O-N 2.89Å; L531-F546 HydrophobicContact CD2-CZ 4.13Å; L531-F546 HydrophobicContact CG-CZ 4.21Å; L531-Q562 HydrophobicContact CD2-CG 4.44Å
532	V	94.6	Very high	92.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-41.9	178.8	-176.6	0	0	0	0	111.5	Y500 Y505 A508 R509 Y512 N528 L529 K534 Q535 L536	Y500-V532 HydrophobicContact CD2-CB 4.41Å; Y500-V532 HydrophobicContact CD2-CG2 3.42Å; Y500-V532 VanDerWaalsContact CD2-CG2 3.42Å; Y500-V532 HydrophobicContact CE2-CB 4.47Å; Y500-V532 HydrophobicContact CE2-CG2 3.77Å; Y500-V532 HydrophobicContact CG-CG2 4.46Å; Y505-V532 WeakPolarHBondContact O-CG1 3.33Å; A508-V532 HydrophobicContact CB-CG2 4.45Å; R509-V532 HydrophobicContact CB-CG1 3.89Å; Y512-V532 HydrophobicContact CD2-CG2 4Å; Y512-V532 HydrophobicContact CE2-CG2 3.47Å; Y512-V532 VanDerWaalsContact CE2-CG2 3.47Å; N528-V532 WeakPolarHBondContact O-CG2 3.2Å; N528-V532 PolarHBondContact O-N 2.91Å; L529-V532 PolarHBondContact O-N 3.25Å; V532-K534 VanDerWaalsContact C-N 3.29Å; V532-K534 PolarHBondContact O-N 3.27Å; V532-Q535 PolarHBondContact O-N 3.1Å; V532-L536 HydrophobicContact CG1-CD1 4Å; V532-L536 HydrophobicContact CG1-CG 4.42Å; V532-L536 WeakPolarHBondContact O-CB 3.44Å; V532-L536 WeakPolarHBondContact O-CG 3.4Å; V532-L536 PolarHBondContact O-N 3.17Å
533	C	94.2	Very high	92.5	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-36.8	173.8	-70.2	0	0	0	0	111.6	L529 L536 E537 R538 E541 A542	L529-C533 WeakPolarHBondContact O-CB 3.33Å; L529-C533 PolarHBondContact O-N 3.25Å; L529-C533 PolarHBondContact O-SG 3.33Å; L529-C533 VanDerWaalsContact O-SG 3.35Å; C533-L536 PolarHBondContact O-N 3.07Å; C533-E537 PolarHBondContact O-N 3.49Å; C533-R538 HydrophobicContact CB-CB 4.39Å; C533-R538 WeakPolarHBondContact O-CA 3.46Å; C533-R538 PolarHBondContact O-N 3.26Å; C533-E541 HydrophobicContact CB-CB 4.04Å; C533-A542 HydrophobicContact CB-CB 3.79Å
534	K	93	Very high	92.7	Very high	33 Å²	33	45.5 Å²	45.5	14%	0.143	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-41.3	172.3	-167.9	179.5	76	169	0	112.2	G530 L531 V532 L536 E537 Y539 A542 D565 I566	G530-K534 WeakPolarHBondContact O-CB 3.42Å; G530-K534 PolarHBondContact O-N 2.89Å; L531-K534 WeakPolarHBondContact O-CB 3.28Å; L531-K534 PolarHBondContact O-N 3.33Å; V532-K534 VanDerWaalsContact C-N 3.29Å; V532-K534 PolarHBondContact O-N 3.27Å; K534-L536 VanDerWaalsContact C-N 3.34Å; K534-E537 PolarHBondContact O-N 3.16Å; K534-E537 VanDerWaalsContact O-N 3.16Å; K534-Y539 HydrophobicContact CG-CE1 4.29Å; K534-A542 HydrophobicContact CB-CB 4.33Å; K534-D565 VanDerWaalsContact CD-OD2 3.31Å; K534-D565 WeakPolarHBondContact CD-OD2 3.13Å; K534-D565 WeakPolarHBondContact CE-OD2 3.28Å; K534-D565 IonicContact NZ-OD2 3.66Å; K534-D565 PolarHBondContact NZ-OD2 3.44Å; K534-I566 HydrophobicContact CD-CD1 4.37Å; K534-I566 HydrophobicContact CD-CG1 3.82Å; K534-I566 HydrophobicContact CG-CG1 4.1Å
535	Q	92.3	Very high	92.8	Very high	95 Å²	95	42.5 Å²	42.5	44%	0.444	20%	0.196	S	C	.	.	H	α-helix	trans	-70.9	-28	178.1	-166.8	65.9	3.1	0	0	113.2	Y500 Y505 L531 V532 E537	Y500-Q535 HydrophobicContact CE2-CB 4.33Å; Y500-Q535 HydrophobicContact CE2-CG 4.43Å; Y505-Q535 HydrophobicContact CD1-CG 4.1Å; Y505-Q535 HydrophobicContact CD2-CG 4.36Å; Y505-Q535 HydrophobicContact CE1-CG 3.76Å; Y505-Q535 HydrophobicContact CE2-CG 4.02Å; Y505-Q535 HydrophobicContact CG-CG 4.39Å; L531-Q535 PolarHBondContact O-N 2.89Å; V532-Q535 PolarHBondContact O-N 3.1Å; Q535-E537 PolarHBondContact O-N 3.19Å
536	L	93.9	Very high	92.9	Very high	40 Å²	40	42.5 Å²	42.5	21%	0.209	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	8.5	170.8	-70.2	171.5	0	0	0	113.3	E506 V532 C533 K534 R538	E506-L536 HydrophobicContact CG-CD2 4.35Å; E506-L536 WeakPolarHBondContact OE1-CD2 3.41Å; V532-L536 HydrophobicContact CG1-CD1 4Å; V532-L536 HydrophobicContact CG1-CG 4.42Å; V532-L536 WeakPolarHBondContact O-CB 3.44Å; V532-L536 WeakPolarHBondContact O-CG 3.4Å; V532-L536 PolarHBondContact O-N 3.17Å; C533-L536 PolarHBondContact O-N 3.07Å; K534-L536 VanDerWaalsContact C-N 3.34Å; L536-R538 HydrophobicContact CB-CG 3.96Å; L536-R538 WeakPolarHBondContact O-CG 3.48Å; L536-R538 PolarHBondContact O-N 2.87Å; L536-R538 VanDerWaalsContact O-N 3.12Å
537	E	93.1	Very high	92.8	Very high	146 Å²	146	45.1 Å²	45.1	68%	0.682	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	18.7	-174.7	-55.3	-172.7	158.6	0	0	114.7	C533 K534 Q535 Y539	C533-E537 PolarHBondContact O-N 3.49Å; K534-E537 PolarHBondContact O-N 3.16Å; K534-E537 VanDerWaalsContact O-N 3.16Å; Q535-E537 PolarHBondContact O-N 3.19Å; E537-Y539 VanDerWaalsContact C-N 3.31Å; E537-Y539 HydrophobicContact CB-CE2 4.08Å; E537-Y539 VanDerWaalsContact O-CD2 3.26Å; E537-Y539 WeakPolarHBondContact O-CD2 3.47Å; E537-Y539 WeakPolarHBondContact O-CE2 3.38Å; E537-Y539 PolarHBondContact O-N 3.21Å; E537-Y539 VanDerWaalsContact O-N 3.13Å
538	R	93.8	Very high	92.7	Very high	75 Å²	75	49 Å²	49	28%	0.283	22%	0.224	S	C	.	.			trans	-90.6	65.9	179	-53.3	-161.5	-162.6	172.3	8.5	111	E506 C533 L536 E540 E541 A542	E506-R538 IonicContact OE1-CZ 3.07Å; E506-R538 IonicContact OE1-NH2 3.74Å; E506-R538 PolarHBondContact OE1-NH2 3.35Å; E506-R538 IonicContact OE2-CZ 3.9Å; E506-R538 IonicContact OE2-NH2 2.67Å; E506-R538 PolarHBondContact OE2-NH2 2.9Å; C533-R538 HydrophobicContact CB-CB 4.39Å; C533-R538 WeakPolarHBondContact O-CA 3.46Å; C533-R538 PolarHBondContact O-N 3.26Å; L536-R538 HydrophobicContact CB-CG 3.96Å; L536-R538 WeakPolarHBondContact O-CG 3.48Å; L536-R538 PolarHBondContact O-N 2.87Å; L536-R538 VanDerWaalsContact O-N 3.12Å; R538-E540 VanDerWaalsContact C-N 3.26Å; R538-E540 PolarHBondContact O-N 2.86Å; R538-E541 HydrophobicContact CB-CB 4.27Å; R538-E541 HydrophobicContact CB-CG 4.44Å; R538-E541 WeakPolarHBondContact CD-OE1 3.44Å; R538-E541 IonicContact CZ-OE1 3.08Å; R538-E541 IonicContact NE-OE1 2.79Å; R538-E541 IonicContact NH1-OE1 2.92Å; R538-E541 PolarHBondContact NH1-OE1 3.11Å; R538-E541 IonicContact NH1-OE2 3.72Å; R538-E541 PolarHBondContact O-N 3.39Å; R538-A542 PolarHBondContact O-N 3.13Å
539	Y	93.7	Very high	92.4	Very high	54 Å²	54	49 Å²	49	21%	0.212	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-33.2	-172.8	-59.6	-61.7	0	0	0	114.1	K534 E537 A542 L543 I566 K569 L570	K534-Y539 HydrophobicContact CG-CE1 4.29Å; E537-Y539 VanDerWaalsContact C-N 3.31Å; E537-Y539 HydrophobicContact CB-CE2 4.08Å; E537-Y539 VanDerWaalsContact O-CD2 3.26Å; E537-Y539 WeakPolarHBondContact O-CD2 3.47Å; E537-Y539 WeakPolarHBondContact O-CE2 3.38Å; E537-Y539 PolarHBondContact O-N 3.21Å; E537-Y539 VanDerWaalsContact O-N 3.13Å; Y539-A542 PolarHBondContact O-N 2.71Å; Y539-L543 WeakPolarHBondContact O-CB 3.37Å; Y539-L543 WeakPolarHBondContact O-CG 3.37Å; Y539-L543 PolarHBondContact O-N 2.98Å; Y539-I566 HydrophobicContact CD1-CG2 3.95Å; Y539-I566 HydrophobicContact CG-CG2 4.31Å; Y539-K569 HydrophobicContact CD1-CB 4.38Å; Y539-K569 HydrophobicContact CE1-CB 3.83Å; Y539-K569 HydrophobicContact CE1-CD 3.9Å; Y539-K569 HydrophobicContact CE1-CG 4.44Å; Y539-L570 HydrophobicContact CD2-CD2 4.17Å; Y539-L570 HydrophobicContact CG-CD2 4.19Å; Y539-L570 HydrophobicContact CG-CG 4.32Å
540	E	92.5	Very high	92.2	Very high	160 Å²	160	49.9 Å²	49.9	75%	0.748	23%	0.226	S	C	*	.	H	α-helix	trans	-67.2	-48.3	176.3	-62.5	-174.5	167.9	0	0	112.3	R538 A542 L543 E544	R538-E540 VanDerWaalsContact C-N 3.26Å; R538-E540 PolarHBondContact O-N 2.86Å; E540-A542 VanDerWaalsContact C-N 3.27Å; E540-A542 PolarHBondContact O-N 3.14Å; E540-L543 PolarHBondContact O-N 2.96Å; E540-E544 PolarHBondContact O-N 3.06Å
541	E	92	Very high	91.8	Very high	78 Å²	78	51.8 Å²	51.8	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-37.9	174.1	-67.4	-173.8	-123	0	0	111.1	R509 C533 R538 E544 A545	R509-E541 IonicContact NH1-OE2 3.87Å; C533-E541 HydrophobicContact CB-CB 4.04Å; R538-E541 HydrophobicContact CB-CB 4.27Å; R538-E541 HydrophobicContact CB-CG 4.44Å; R538-E541 WeakPolarHBondContact CD-OE1 3.44Å; R538-E541 IonicContact CZ-OE1 3.08Å; R538-E541 IonicContact NE-OE1 2.79Å; R538-E541 IonicContact NH1-OE1 2.92Å; R538-E541 PolarHBondContact NH1-OE1 3.11Å; R538-E541 IonicContact NH1-OE2 3.72Å; R538-E541 PolarHBondContact O-N 3.39Å; E541-E544 PolarHBondContact O-N 3.34Å; E541-A545 PolarHBondContact O-N 3.49Å; E541-A545 VanDerWaalsContact O-N 3.14Å
542	A	93.7	Very high	91.3	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-45.6	177.3	0	0	0	0	0	112.3	G530 C533 K534 R538 Y539 E540 E544 A545 F546 I566	G530-A542 WeakPolarHBondContact O-CB 3.46Å; C533-A542 HydrophobicContact CB-CB 3.79Å; K534-A542 HydrophobicContact CB-CB 4.33Å; R538-A542 PolarHBondContact O-N 3.13Å; Y539-A542 PolarHBondContact O-N 2.71Å; E540-A542 VanDerWaalsContact C-N 3.27Å; E540-A542 PolarHBondContact O-N 3.14Å; A542-E544 VanDerWaalsContact C-N 3.33Å; A542-E544 PolarHBondContact O-N 2.85Å; A542-A545 PolarHBondContact O-N 3.07Å; A542-F546 WeakPolarHBondContact O-CD2 3.12Å; A542-F546 PolarHBondContact O-N 3.38Å; A542-I566 HydrophobicContact CB-CD1 3.71Å
543	L	93.2	Very high	90.7	Very high	18 Å²	18	55.9 Å²	55.9	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-44.2	174.2	-77.6	179.5	0	0	0	111.2	Y539 E540 A545 F546 F547 L563 I566 Y567 L570	Y539-L543 WeakPolarHBondContact O-CB 3.37Å; Y539-L543 WeakPolarHBondContact O-CG 3.37Å; Y539-L543 PolarHBondContact O-N 2.98Å; E540-L543 PolarHBondContact O-N 2.96Å; L543-A545 VanDerWaalsContact C-N 3.34Å; L543-A545 PolarHBondContact O-N 3.08Å; L543-F546 PolarHBondContact O-N 2.88Å; L543-F547 HydrophobicContact CB-CD2 4.16Å; L543-F547 HydrophobicContact CB-CE2 4.16Å; L543-F547 HydrophobicContact CD2-CE2 4.18Å; L543-F547 WeakPolarHBondContact O-CB 3.4Å; L543-F547 WeakPolarHBondContact O-CD2 3.32Å; L543-F547 WeakPolarHBondContact O-CG 3.48Å; L543-F547 PolarHBondContact O-N 3.35Å; L543-L563 HydrophobicContact CD2-CD2 3.75Å; L543-I566 HydrophobicContact CD1-CG2 4.3Å; L543-I566 HydrophobicContact CD2-CB 4.03Å; L543-I566 HydrophobicContact CD2-CD1 4.46Å; L543-I566 HydrophobicContact CD2-CG2 3.71Å; L543-I566 HydrophobicContact CG-CB 4.5Å; L543-I566 HydrophobicContact CG-CG2 3.66Å; L543-Y567 HydrophobicContact CD1-CE1 4.05Å; L543-Y567 HydrophobicContact CD1-CE2 4.44Å; L543-Y567 HydrophobicContact CD2-CD2 4.16Å; L543-Y567 HydrophobicContact CD2-CE2 3.71Å; L543-L570 HydrophobicContact CD1-CD1 3.71Å
544	E	91.9	Very high	90	Very high	116 Å²	116	61.6 Å²	61.6	54%	0.542	28%	0.284	S	S	.	.	H	α-helix	trans	-57.6	-44.8	176.1	-80.2	-161	-160.4	0	0	112.8	E540 E541 A542 K548	E540-E544 PolarHBondContact O-N 3.06Å; E541-E544 PolarHBondContact O-N 3.34Å; A542-E544 VanDerWaalsContact C-N 3.33Å; A542-E544 PolarHBondContact O-N 2.85Å; E544-K548 WeakPolarHBondContact O-CB 3.37Å; E544-K548 WeakPolarHBondContact O-CD 3.45Å; E544-K548 VanDerWaalsContact O-CG 3.23Å; E544-K548 WeakPolarHBondContact O-CG 3.45Å; E544-K548 PolarHBondContact O-N 2.85Å; E544-K548 IonicContact OE2-NZ 3.89Å; E544-K548 PolarHBondContact OE2-NZ 2.93Å
545	A	90.7	Very high	89.1	Confident	2 Å²	2	65.6 Å²	65.6	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-47.5	178.3	0	0	0	0	0	111.6	L529 E541 A542 L543 K548 L549	L529-A545 HydrophobicContact CD2-CB 4.34Å; L529-A545 HydrophobicContact CG-CB 4.41Å; E541-A545 PolarHBondContact O-N 3.49Å; E541-A545 VanDerWaalsContact O-N 3.14Å; A542-A545 PolarHBondContact O-N 3.07Å; L543-A545 VanDerWaalsContact C-N 3.34Å; L543-A545 PolarHBondContact O-N 3.08Å; A545-K548 PolarHBondContact O-N 3.34Å; A545-L549 WeakPolarHBondContact O-CB 3.25Å; A545-L549 PolarHBondContact O-N 3.5Å
546	F	92.2	Very high	88.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.5	-30	178.7	-69.9	-59.9	0	0	0	113.4	Y527 G530 L531 A542 L543 L549 Y550 V559 Q562 L563 I566	Y527-F546 HydrophobicContact CD2-CD1 4.42Å; Y527-F546 AromaticContact CD2-CE1 3.69Å; Y527-F546 HydrophobicContact CD2-CE1 3.69Å; Y527-F546 AromaticContact CE2-CE1 3.92Å; Y527-F546 HydrophobicContact CE2-CE1 3.92Å; Y527-F546 HydrophobicContact CG-CE1 4.45Å; G530-F546 VanDerWaalsContact C-CZ 3.46Å; G530-F546 VanDerWaalsContact CA-CE2 3.49Å; L531-F546 HydrophobicContact CD2-CZ 4.13Å; L531-F546 HydrophobicContact CG-CZ 4.21Å; A542-F546 WeakPolarHBondContact O-CD2 3.12Å; A542-F546 PolarHBondContact O-N 3.38Å; L543-F546 PolarHBondContact O-N 2.88Å; F546-L549 HydrophobicContact CD1-CD2 4.3Å; F546-L549 PolarHBondContact O-N 3.21Å; F546-Y550 VanDerWaalsContact O-CB 3.27Å; F546-Y550 WeakPolarHBondContact O-CB 3.41Å; F546-Y550 PolarHBondContact O-N 2.79Å; F546-V559 HydrophobicContact CB-CG1 4.42Å; F546-V559 HydrophobicContact CD1-CG1 4.31Å; F546-Q562 HydrophobicContact CD1-CB 3.95Å; F546-Q562 HydrophobicContact CD1-CG 4.39Å; F546-Q562 HydrophobicContact CD2-CB 4Å; F546-Q562 HydrophobicContact CE1-CB 3.71Å; F546-Q562 HydrophobicContact CE1-CG 3.74Å; F546-Q562 HydrophobicContact CE2-CB 3.76Å; F546-Q562 HydrophobicContact CE2-CG 4.33Å; F546-Q562 HydrophobicContact CG-CB 4.1Å; F546-Q562 HydrophobicContact CZ-CB 3.62Å; F546-Q562 HydrophobicContact CZ-CG 3.7Å; F546-L563 HydrophobicContact CB-CD2 3.61Å; F546-L563 HydrophobicContact CB-CG 3.99Å; F546-I566 HydrophobicContact CD2-CD1 3.46Å; F546-I566 VanDerWaalsContact CD2-CD1 3.46Å; F546-I566 HydrophobicContact CE2-CD1 3.64Å
547	F	91.2	Very high	88.5	Confident	62 Å²	62	61 Å²	61	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-69.8	-41.6	171.6	-82.3	-55.2	0	0	0	112.5	L543 L549 Y550 S551 L563 Y567 W579	L543-F547 HydrophobicContact CB-CD2 4.16Å; L543-F547 HydrophobicContact CB-CE2 4.16Å; L543-F547 HydrophobicContact CD2-CE2 4.18Å; L543-F547 WeakPolarHBondContact O-CB 3.4Å; L543-F547 WeakPolarHBondContact O-CD2 3.32Å; L543-F547 WeakPolarHBondContact O-CG 3.48Å; L543-F547 PolarHBondContact O-N 3.35Å; F547-L549 VanDerWaalsContact C-N 3.3Å; F547-L549 PolarHBondContact O-N 3.33Å; F547-Y550 PolarHBondContact O-N 2.98Å; F547-S551 PolarHBondContact O-N 2.94Å; F547-L563 HydrophobicContact CD1-CD1 4.36Å; F547-L563 HydrophobicContact CD1-CD2 4.24Å; F547-L563 HydrophobicContact CD2-CD2 4.31Å; F547-L563 HydrophobicContact CE1-CD1 4.19Å; F547-L563 HydrophobicContact CE1-CD2 4.12Å; F547-L563 HydrophobicContact CE2-CD2 4.19Å; F547-L563 HydrophobicContact CG-CD2 4.32Å; F547-L563 HydrophobicContact CZ-CD2 4.09Å; F547-Y567 HydrophobicContact CZ-CE2 4.14Å; F547-Y567 WeakPolarHBondContact CZ-OH 3.27Å; F547-W579 HydrophobicContact CE1-CH2 4.03Å; F547-W579 AromaticContact CE1-CZ2 3.59Å; F547-W579 HydrophobicContact CE1-CZ2 3.59Å; F547-W579 HydrophobicContact CZ-CZ2 4Å
548	K	88.7	Confident	88.2	Confident	107 Å²	107	56.5 Å²	56.5	47%	0.465	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-47	170.5	-72.5	162	-167.8	159.1	0	109.7	L526 E544 A545 S551 V552	L526-K548 HydrophobicContact CD1-CB 4.31Å; L526-K548 HydrophobicContact CD2-CB 4.03Å; L526-K548 HydrophobicContact CD2-CD 4.45Å; E544-K548 WeakPolarHBondContact O-CB 3.37Å; E544-K548 WeakPolarHBondContact O-CD 3.45Å; E544-K548 VanDerWaalsContact O-CG 3.23Å; E544-K548 WeakPolarHBondContact O-CG 3.45Å; E544-K548 PolarHBondContact O-N 2.85Å; E544-K548 IonicContact OE2-NZ 3.89Å; E544-K548 PolarHBondContact OE2-NZ 2.93Å; A545-K548 PolarHBondContact O-N 3.34Å; K548-S551 WeakPolarHBondContact O-CB 3.39Å; K548-S551 PolarHBondContact O-N 3.14Å; K548-S551 PolarHBondContact O-OG 3.49Å; K548-V552 PolarHBondContact O-N 2.77Å
549	L	88.3	Confident	88	Confident	2 Å²	2	53 Å²	53	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-42.7	178.6	-170	58.9	0	0	0	113.5	V523 L526 Y527 A545 F546 F547 S551 V552 L553 V559	V523-L549 HydrophobicContact CB-CD1 4.34Å; V523-L549 HydrophobicContact CG1-CD1 3.99Å; V523-L549 HydrophobicContact CG2-CD1 4.4Å; L526-L549 HydrophobicContact CB-CB 4.25Å; L526-L549 HydrophobicContact CB-CD1 3.99Å; L526-L549 HydrophobicContact CD1-CB 4.36Å; L526-L549 HydrophobicContact CD1-CD1 4.14Å; Y527-L549 HydrophobicContact CD2-CD2 3.67Å; Y527-L549 HydrophobicContact CG-CD2 4.2Å; A545-L549 WeakPolarHBondContact O-CB 3.25Å; A545-L549 PolarHBondContact O-N 3.5Å; F546-L549 HydrophobicContact CD1-CD2 4.3Å; F546-L549 PolarHBondContact O-N 3.21Å; F547-L549 VanDerWaalsContact C-N 3.3Å; F547-L549 PolarHBondContact O-N 3.33Å; L549-S551 PolarHBondContact O-N 3.28Å; L549-V552 PolarHBondContact O-N 3.28Å; L549-V552 VanDerWaalsContact O-N 3.15Å; L549-L553 HydrophobicContact CD1-CD1 4.17Å; L549-L553 HydrophobicContact CD1-CG 4.46Å; L549-L553 PolarHBondContact O-N 3Å; L549-V559 HydrophobicContact CB-CG1 4.33Å; L549-V559 HydrophobicContact CD2-CG1 4.3Å; L549-V559 HydrophobicContact CD2-CG2 3.6Å; L549-V559 HydrophobicContact CG-CG1 4.31Å; L549-V559 HydrophobicContact CG-CG2 3.9Å
550	Y	87.5	Confident	87.9	Confident	47 Å²	47	50.4 Å²	50.4	18%	0.184	25%	0.25	C	S	.	.	H	α-helix	trans	-62.7	-30.5	175.3	-179.4	-100.2	0	0	0	112.4	F546 F547 V552 L553 R554 V560 W579	F546-Y550 VanDerWaalsContact O-CB 3.27Å; F546-Y550 WeakPolarHBondContact O-CB 3.41Å; F546-Y550 PolarHBondContact O-N 2.79Å; F547-Y550 PolarHBondContact O-N 2.98Å; Y550-V552 VanDerWaalsContact C-N 3.34Å; Y550-L553 CarbonylContact O-C 3.58Å; Y550-R554 PolarHBondContact O-N 2.88Å; Y550-V560 HydrophobicContact CD2-CG2 4.04Å; Y550-V560 HydrophobicContact CE2-CG2 3.77Å; Y550-W579 HydrophobicContact CE1-CH2 4.4Å; Y550-W579 HydrophobicContact CE2-CZ3 4.32Å
551	S	85.6	Confident	87.9	Confident	39 Å²	39	44 Å²	44	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-68.8	-31.9	175	84	0	0	0	0	113.2	F547 K548 L549	F547-S551 PolarHBondContact O-N 2.94Å; K548-S551 WeakPolarHBondContact O-CB 3.39Å; K548-S551 PolarHBondContact O-N 3.14Å; K548-S551 PolarHBondContact O-OG 3.49Å; L549-S551 PolarHBondContact O-N 3.28Å
552	V	82.2	Confident	87.9	Confident	57 Å²	57	41 Å²	41	35%	0.345	21%	0.206	S	C	.	.	H	α-helix	trans	-82.8	-50.9	176.1	179	0	0	0	0	110.7	V523 K548 L549 Y550	V523-V552 HydrophobicContact CG2-CG1 4.38Å; K548-V552 PolarHBondContact O-N 2.77Å; L549-V552 PolarHBondContact O-N 3.28Å; L549-V552 VanDerWaalsContact O-N 3.15Å; Y550-V552 VanDerWaalsContact C-N 3.34Å
553	L	81.5	Confident	87.8	Confident	42 Å²	42	41 Å²	41	22%	0.22	21%	0.206	C	C	.	.	S	Bend	trans	-105.4	70.8	-178.1	-63.8	-175.5	0	0	0	111.7	L17 V523 L549 Y550 N555 S556	L17-L553 HydrophobicContact CD2-CD1 3.81Å; V523-L553 HydrophobicContact CG1-CD1 3.61Å; V523-L553 HydrophobicContact CG2-CD1 4.33Å; V523-L553 HydrophobicContact CG2-CG 4.43Å; L549-L553 HydrophobicContact CD1-CD1 4.17Å; L549-L553 HydrophobicContact CD1-CG 4.46Å; L549-L553 PolarHBondContact O-N 3Å; Y550-L553 CarbonylContact O-C 3.58Å; L553-N555 PolarHBondContact O-N 3.4Å; L553-S556 PolarHBondContact O-N 3.35Å
554	R	78	Confident	87.8	Confident	121 Å²	121	40.2 Å²	40.2	46%	0.457	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	133.3	173.5	-63.4	-171	-173.6	-176.7	7.2	110.4	Y550	Y550-R554 PolarHBondContact O-N 2.88Å
555	N	75.7	Confident	87.8	Confident	116 Å²	116	35.3 Å²	35.3	62%	0.62	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.6	24.2	-177	-46.4	-40.7	0	0	0	116.2	L553 A557 M586	L553-N555 PolarHBondContact O-N 3.4Å; N555-A557 PolarHBondContact O-N 3.07Å; N555-M586 HydrophobicContact CB-CE 4.13Å; N555-M586 HydrophobicContact CB-SD 4.22Å
556	S	85	Confident	87.9	Confident	18 Å²	18	35.2 Å²	35.2	13%	0.126	18%	0.178	C	C	.	.			trans	-76.8	107.5	167.9	-173.1	0	0	0	0	111	L553 V559 V560	L553-S556 PolarHBondContact O-N 3.35Å; S556-V559 PolarHBondContact O-N 3.22Å; S556-V559 VanDerWaalsContact O-N 3.12Å; S556-V560 PolarHBondContact O-N 3.2Å
557	A	87.6	Confident	87.9	Confident	22 Å²	22	36.8 Å²	36.8	18%	0.182	18%	0.184	C	C	.	.	H	α-helix	trans	-57.2	-42.5	-178.3	0	0	0	0	0	114	N555 V559 V560 Y561 L583 M586 V587	N555-A557 PolarHBondContact O-N 3.07Å; A557-V559 VanDerWaalsContact C-N 3.29Å; A557-V559 PolarHBondContact O-N 2.78Å; A557-V560 PolarHBondContact O-N 2.91Å; A557-Y561 PolarHBondContact O-N 3.32Å; A557-L583 HydrophobicContact CB-CD1 3.73Å; A557-L583 VanDerWaalsContact O-CD1 3.27Å; A557-L583 WeakPolarHBondContact O-CD1 3.38Å; A557-M586 HydrophobicContact CB-CB 4.48Å; A557-M586 HydrophobicContact CB-SD 4.49Å; A557-V587 HydrophobicContact CB-CG2 3.81Å
558	P	87.5	Confident	87.9	Confident	50 Å²	50	36.9 Å²	36.9	33%	0.325	19%	0.186	S	C	.	.	H	α-helix	trans	-57.7	-38.6	173.9	-26.5	35.7	0	0	0	113.5	Y561 Q562	P558-Y561 PolarHBondContact O-N 3.41Å; P558-Q562 WeakPolarHBondContact O-CG 3.44Å; P558-Q562 PolarHBondContact O-N 2.95Å
559	V	89.8	Confident	88	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-68.8	-40.6	-179.7	-178.1	0	0	0	0	111.1	F546 L549 S556 A557 Y561 Q562 L563	F546-V559 HydrophobicContact CB-CG1 4.42Å; F546-V559 HydrophobicContact CD1-CG1 4.31Å; L549-V559 HydrophobicContact CB-CG1 4.33Å; L549-V559 HydrophobicContact CD2-CG1 4.3Å; L549-V559 HydrophobicContact CD2-CG2 3.6Å; L549-V559 HydrophobicContact CG-CG1 4.31Å; L549-V559 HydrophobicContact CG-CG2 3.9Å; S556-V559 PolarHBondContact O-N 3.22Å; S556-V559 VanDerWaalsContact O-N 3.12Å; A557-V559 VanDerWaalsContact C-N 3.29Å; A557-V559 PolarHBondContact O-N 2.78Å; V559-Y561 VanDerWaalsContact C-N 3.34Å; V559-Q562 PolarHBondContact O-N 3.48Å; V559-L563 WeakPolarHBondContact O-CG 3.37Å; V559-L563 PolarHBondContact O-N 3.37Å
560	V	91.3	Very high	88.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-36.7	175.9	179.5	0	0	0	0	111.4	Y550 S556 A557 L563 M564 W579 Q582 L583 M586	Y550-V560 HydrophobicContact CD2-CG2 4.04Å; Y550-V560 HydrophobicContact CE2-CG2 3.77Å; S556-V560 PolarHBondContact O-N 3.2Å; A557-V560 PolarHBondContact O-N 2.91Å; V560-L563 PolarHBondContact O-N 3.08Å; V560-M564 WeakPolarHBondContact O-CB 3.25Å; V560-M564 PolarHBondContact O-N 3.1Å; V560-W579 HydrophobicContact CG1-CE3 4.01Å; V560-Q582 HydrophobicContact CG1-CB 4.43Å; V560-L583 HydrophobicContact CB-CD1 4.19Å; V560-L583 HydrophobicContact CG1-CB 3.87Å; V560-L583 HydrophobicContact CG1-CD1 4.35Å; V560-M586 HydrophobicContact CG2-CE 4.02Å; V560-M586 HydrophobicContact CG2-SD 4.34Å
561	Y	91.7	Very high	88.2	Confident	24 Å²	24	40.7 Å²	40.7	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-44.4	172.3	177.7	-95.6	0	0	0	112.3	I2 D4 A557 P558 V559 L563 M564 D565 L583 R596	I2-Y561 HydrophobicContact CD1-CD1 4.45Å; I2-Y561 HydrophobicContact CD1-CD2 4.47Å; I2-Y561 HydrophobicContact CD1-CG 4.2Å; I2-Y561 HydrophobicContact CG2-CD1 4.18Å; I2-Y561 HydrophobicContact CG2-CE1 3.71Å; I2-Y561 HydrophobicContact CG2-CE2 4.3Å; D4-Y561 PolarHBondContact OD1-OH 3.33Å; D4-Y561 VanDerWaalsContact OD1-OH 3.08Å; A557-Y561 PolarHBondContact O-N 3.32Å; P558-Y561 PolarHBondContact O-N 3.41Å; V559-Y561 VanDerWaalsContact C-N 3.34Å; Y561-L563 PolarHBondContact O-N 3.22Å; Y561-M564 HydrophobicContact CD2-CE 3.78Å; Y561-M564 HydrophobicContact CE2-CE 3.76Å; Y561-M564 WeakPolarHBondContact O-CB 3.48Å; Y561-M564 PolarHBondContact O-N 3.46Å; Y561-D565 PolarHBondContact O-N 3.25Å; Y561-L583 HydrophobicContact CD2-CD2 3.97Å; Y561-L583 HydrophobicContact CG-CD2 4.42Å; Y561-R596 PolarHBondContact OH-NH2 2.86Å
562	Q	92.2	Very high	88.4	Confident	17 Å²	17	41.7 Å²	41.7	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-38.6	176.7	-61.6	-60.1	-21.2	0	0	112.3	Y527 L531 F546 P558 V559 I566	Y527-Q562 HydrophobicContact CE2-CG 4.08Å; Y527-Q562 PolarHBondContact OH-NE2 3.49Å; L531-Q562 HydrophobicContact CD2-CG 4.44Å; F546-Q562 HydrophobicContact CD1-CB 3.95Å; F546-Q562 HydrophobicContact CD1-CG 4.39Å; F546-Q562 HydrophobicContact CD2-CB 4Å; F546-Q562 HydrophobicContact CE1-CB 3.71Å; F546-Q562 HydrophobicContact CE1-CG 3.74Å; F546-Q562 HydrophobicContact CE2-CB 3.76Å; F546-Q562 HydrophobicContact CE2-CG 4.33Å; F546-Q562 HydrophobicContact CG-CB 4.1Å; F546-Q562 HydrophobicContact CZ-CB 3.62Å; F546-Q562 HydrophobicContact CZ-CG 3.7Å; P558-Q562 WeakPolarHBondContact O-CG 3.44Å; P558-Q562 PolarHBondContact O-N 2.95Å; V559-Q562 PolarHBondContact O-N 3.48Å; Q562-I566 WeakPolarHBondContact O-CD1 3.49Å; Q562-I566 VanDerWaalsContact O-CG1 3.25Å; Q562-I566 WeakPolarHBondContact O-CG1 3.3Å; Q562-I566 PolarHBondContact O-N 3.18Å
563	L	92.5	Very high	88.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-47.8	172.9	-71.8	171.1	0	0	0	111.2	L543 F546 F547 V559 V560 Y561 I566 Y567 W579	L543-L563 HydrophobicContact CD2-CD2 3.75Å; F546-L563 HydrophobicContact CB-CD2 3.61Å; F546-L563 HydrophobicContact CB-CG 3.99Å; F547-L563 HydrophobicContact CD1-CD1 4.36Å; F547-L563 HydrophobicContact CD1-CD2 4.24Å; F547-L563 HydrophobicContact CD2-CD2 4.31Å; F547-L563 HydrophobicContact CE1-CD1 4.19Å; F547-L563 HydrophobicContact CE1-CD2 4.12Å; F547-L563 HydrophobicContact CE2-CD2 4.19Å; F547-L563 HydrophobicContact CG-CD2 4.32Å; F547-L563 HydrophobicContact CZ-CD2 4.09Å; V559-L563 WeakPolarHBondContact O-CG 3.37Å; V559-L563 PolarHBondContact O-N 3.37Å; V560-L563 PolarHBondContact O-N 3.08Å; Y561-L563 PolarHBondContact O-N 3.22Å; L563-I566 PolarHBondContact O-N 2.97Å; L563-Y567 WeakPolarHBondContact O-CD2 3.31Å; L563-Y567 PolarHBondContact O-N 3.43Å; L563-W579 HydrophobicContact CB-CD2 4.42Å; L563-W579 HydrophobicContact CB-CG 4.5Å; L563-W579 HydrophobicContact CD1-CE3 4.38Å; L563-W579 HydrophobicContact CD1-CH2 4.16Å; L563-W579 HydrophobicContact CD1-CZ2 4.35Å; L563-W579 HydrophobicContact CD1-CZ3 4.18Å
564	M	91.9	Very high	89	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.4	-52.3	176.4	-176.5	-157.2	79.5	0	0	112	V560 Y561 I566 Y567 E568 W579 A580 L583 L593	V560-M564 WeakPolarHBondContact O-CB 3.25Å; V560-M564 PolarHBondContact O-N 3.1Å; Y561-M564 HydrophobicContact CD2-CE 3.78Å; Y561-M564 HydrophobicContact CE2-CE 3.76Å; Y561-M564 WeakPolarHBondContact O-CB 3.48Å; Y561-M564 PolarHBondContact O-N 3.46Å; M564-I566 VanDerWaalsContact C-N 3.29Å; M564-I566 PolarHBondContact O-N 3.18Å; M564-Y567 PolarHBondContact O-N 3.35Å; M564-Y567 VanDerWaalsContact O-N 3.12Å; M564-E568 WeakPolarHBondContact O-CG 3.47Å; M564-E568 PolarHBondContact O-N 3.02Å; M564-W579 HydrophobicContact CB-CB 4.01Å; M564-A580 HydrophobicContact CG-CB 4.1Å; M564-A580 HydrophobicContact SD-CB 3.7Å; M564-L583 HydrophobicContact SD-CD2 4.47Å; M564-L593 HydrophobicContact SD-CD1 3.86Å
565	D	92.2	Very high	89.6	Confident	14 Å²	14	40.6 Å²	40.6	8%	0.075	23%	0.234	C	C	.	.	H	α-helix	trans	-57.9	-37.9	178.4	176.3	54	0	0	0	112.4	K534 Y561 E568 K569	K534-D565 VanDerWaalsContact CD-OD2 3.31Å; K534-D565 WeakPolarHBondContact CD-OD2 3.13Å; K534-D565 WeakPolarHBondContact CE-OD2 3.28Å; K534-D565 IonicContact NZ-OD2 3.66Å; K534-D565 PolarHBondContact NZ-OD2 3.44Å; Y561-D565 PolarHBondContact O-N 3.25Å; D565-E568 PolarHBondContact O-N 3.17Å; D565-K569 WeakPolarHBondContact O-CB 3.46Å; D565-K569 WeakPolarHBondContact O-CG 3.27Å; D565-K569 PolarHBondContact O-N 3.22Å; D565-K569 WeakPolarHBondContact OD1-CE 3.32Å; D565-K569 IonicContact OD1-NZ 3.72Å; D565-K569 PolarHBondContact OD1-NZ 3.02Å; D565-K569 VanDerWaalsContact OD1-NZ 3.12Å; D565-K569 IonicContact OD2-NZ 3.82Å; D565-K569 PolarHBondContact OD2-NZ 2.92Å
566	I	93.1	Very high	90.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.3	-39.8	176.5	-65.4	162	0	0	0	111.7	K534 Y539 A542 L543 F546 Q562 L563 M564 K569 L570	K534-I566 HydrophobicContact CD-CD1 4.37Å; K534-I566 HydrophobicContact CD-CG1 3.82Å; K534-I566 HydrophobicContact CG-CG1 4.1Å; Y539-I566 HydrophobicContact CD1-CG2 3.95Å; Y539-I566 HydrophobicContact CG-CG2 4.31Å; A542-I566 HydrophobicContact CB-CD1 3.71Å; L543-I566 HydrophobicContact CD1-CG2 4.3Å; L543-I566 HydrophobicContact CD2-CB 4.03Å; L543-I566 HydrophobicContact CD2-CD1 4.46Å; L543-I566 HydrophobicContact CD2-CG2 3.71Å; L543-I566 HydrophobicContact CG-CB 4.5Å; L543-I566 HydrophobicContact CG-CG2 3.66Å; F546-I566 HydrophobicContact CD2-CD1 3.46Å; F546-I566 VanDerWaalsContact CD2-CD1 3.46Å; F546-I566 HydrophobicContact CE2-CD1 3.64Å; Q562-I566 WeakPolarHBondContact O-CD1 3.49Å; Q562-I566 VanDerWaalsContact O-CG1 3.25Å; Q562-I566 WeakPolarHBondContact O-CG1 3.3Å; Q562-I566 PolarHBondContact O-N 3.18Å; L563-I566 PolarHBondContact O-N 2.97Å; M564-I566 VanDerWaalsContact C-N 3.29Å; M564-I566 PolarHBondContact O-N 3.18Å; I566-K569 PolarHBondContact O-N 2.79Å; I566-L570 HydrophobicContact CG2-CD1 3.98Å; I566-L570 HydrophobicContact CG2-CG 4.4Å; I566-L570 WeakPolarHBondContact O-CB 3.07Å; I566-L570 WeakPolarHBondContact O-CG 3.43Å; I566-L570 PolarHBondContact O-N 2.85Å
567	Y	93.2	Very high	90.6	Very high	32 Å²	32	35.6 Å²	35.6	13%	0.125	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-35.2	174.8	-80.3	-66.7	0	0	0	112.6	L543 F547 L563 M564 L570 G571 D572 Q575 W579	L543-Y567 HydrophobicContact CD1-CE1 4.05Å; L543-Y567 HydrophobicContact CD1-CE2 4.44Å; L543-Y567 HydrophobicContact CD2-CD2 4.16Å; L543-Y567 HydrophobicContact CD2-CE2 3.71Å; F547-Y567 HydrophobicContact CZ-CE2 4.14Å; F547-Y567 WeakPolarHBondContact CZ-OH 3.27Å; L563-Y567 WeakPolarHBondContact O-CD2 3.31Å; L563-Y567 PolarHBondContact O-N 3.43Å; M564-Y567 PolarHBondContact O-N 3.35Å; M564-Y567 VanDerWaalsContact O-N 3.12Å; Y567-L570 HydrophobicContact CD1-CD1 4.36Å; Y567-L570 PolarHBondContact O-N 3.23Å; Y567-G571 PolarHBondContact O-N 3.27Å; Y567-G571 VanDerWaalsContact O-N 3.14Å; Y567-D572 HydrophobicContact CD1-CB 4.23Å; Y567-D572 PolarHBondContact O-N 3.17Å; Y567-D572 VanDerWaalsContact O-N 3.1Å; Y567-Q575 HydrophobicContact CD1-CB 3.57Å; Y567-Q575 HydrophobicContact CD1-CG 4.3Å; Y567-Q575 HydrophobicContact CD2-CB 4.19Å; Y567-Q575 HydrophobicContact CE1-CB 3.84Å; Y567-Q575 HydrophobicContact CE1-CG 4.14Å; Y567-Q575 HydrophobicContact CE2-CB 4.44Å; Y567-Q575 HydrophobicContact CG-CB 3.77Å; Y567-W579 AromaticContact CD2-CD1 3.4Å; Y567-W579 AromaticContact CD2-NE1 3.54Å; Y567-W579 AromaticContact CE2-CD1 3.66Å; Y567-W579 AromaticContact CE2-NE1 3.24Å
568	E	89.8	Confident	90.7	Very high	65 Å²	65	38.5 Å²	38.5	30%	0.304	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-44.7	170.6	-70.6	-179	159.8	0	0	111.2	M564 D565 G571 A576 R596	M564-E568 WeakPolarHBondContact O-CG 3.47Å; M564-E568 PolarHBondContact O-N 3.02Å; D565-E568 PolarHBondContact O-N 3.17Å; E568-G571 PolarHBondContact O-N 3.06Å; E568-G571 VanDerWaalsContact O-N 3.09Å; E568-A576 HydrophobicContact CG-CB 3.6Å; E568-R596 IonicContact OE2-CZ 2.84Å; E568-R596 IonicContact OE2-NH1 3.24Å; E568-R596 PolarHBondContact OE2-NH1 3.24Å
569	K	90.5	Very high	90.9	Very high	100 Å²	100	36.6 Å²	36.6	44%	0.435	20%	0.201	S	C	.	.	H	α-helix	trans	-68.1	-32.3	177.2	-74.5	170.3	180	163.2	0	114	Y539 D565 I566 G571	Y539-K569 HydrophobicContact CD1-CB 4.38Å; Y539-K569 HydrophobicContact CE1-CB 3.83Å; Y539-K569 HydrophobicContact CE1-CD 3.9Å; Y539-K569 HydrophobicContact CE1-CG 4.44Å; D565-K569 WeakPolarHBondContact O-CB 3.46Å; D565-K569 WeakPolarHBondContact O-CG 3.27Å; D565-K569 PolarHBondContact O-N 3.22Å; D565-K569 WeakPolarHBondContact OD1-CE 3.32Å; D565-K569 IonicContact OD1-NZ 3.72Å; D565-K569 PolarHBondContact OD1-NZ 3.02Å; D565-K569 VanDerWaalsContact OD1-NZ 3.12Å; D565-K569 IonicContact OD2-NZ 3.82Å; D565-K569 PolarHBondContact OD2-NZ 2.92Å; I566-K569 PolarHBondContact O-N 2.79Å; K569-G571 PolarHBondContact O-N 3.29Å
570	L	91.6	Very high	91	Very high	80 Å²	80	36.6 Å²	36.6	42%	0.419	20%	0.202	S	C	.	.	H	α-helix	trans	-72.1	-15.8	171	-76	168.7	0	0	0	113.1	Y539 L543 I566 Y567	Y539-L570 HydrophobicContact CD2-CD2 4.17Å; Y539-L570 HydrophobicContact CG-CD2 4.19Å; Y539-L570 HydrophobicContact CG-CG 4.32Å; L543-L570 HydrophobicContact CD1-CD1 3.71Å; I566-L570 HydrophobicContact CG2-CD1 3.98Å; I566-L570 HydrophobicContact CG2-CG 4.4Å; I566-L570 WeakPolarHBondContact O-CB 3.07Å; I566-L570 WeakPolarHBondContact O-CG 3.43Å; I566-L570 PolarHBondContact O-N 2.85Å; Y567-L570 HydrophobicContact CD1-CD1 4.36Å; Y567-L570 PolarHBondContact O-N 3.23Å
571	G	88.5	Confident	91	Very high	55 Å²	55	40.1 Å²	40.1	57%	0.567	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.8	12.6	-177.3	0	0	0	0	0	114.8	Y567 E568 K569 S573	Y567-G571 PolarHBondContact O-N 3.27Å; Y567-G571 VanDerWaalsContact O-N 3.14Å; E568-G571 PolarHBondContact O-N 3.06Å; E568-G571 VanDerWaalsContact O-N 3.09Å; K569-G571 PolarHBondContact O-N 3.29Å; G571-S573 PolarHBondContact O-N 3.06Å
572	D	89.9	Confident	90.9	Very high	61 Å²	61	42.5 Å²	42.5	33%	0.326	23%	0.231	S	C	.	.			trans	-86.9	79.9	170.6	-172	-15.4	0	0	0	109.7	Y567 T574 Q575 A576	Y567-D572 HydrophobicContact CD1-CB 4.23Å; Y567-D572 PolarHBondContact O-N 3.17Å; Y567-D572 VanDerWaalsContact O-N 3.1Å; D572-T574 PolarHBondContact O-N 3.38Å; D572-T574 VanDerWaalsContact O-N 3.1Å; D572-T574 PolarHBondContact OD1-N 3.32Å; D572-T574 VanDerWaalsContact OD1-N 3.08Å; D572-T574 PolarHBondContact OD1-OG1 3.1Å; D572-Q575 HydrophobicContact CB-CB 4.45Å; D572-Q575 PolarHBondContact O-N 3.19Å; D572-Q575 PolarHBondContact OD1-N 3.3Å; D572-Q575 WeakPolarHBondContact OD2-CG 3.29Å; D572-A576 WeakPolarHBondContact O-CB 3.43Å; D572-A576 PolarHBondContact O-N 2.9Å
573	S	87.1	Confident	90.9	Very high	73 Å²	73	42 Å²	42	51%	0.51	23%	0.229	S	C	.	.	H	α-helix	trans	-53.6	-29.1	176.5	-53.9	0	0	0	0	112.9	G571 Q577	G571-S573 PolarHBondContact O-N 3.06Å; S573-Q577 VanDerWaalsContact O-CB 3.27Å; S573-Q577 WeakPolarHBondContact O-CB 3.43Å; S573-Q577 PolarHBondContact O-N 3.29Å
574	T	90	Very high	90.7	Very high	88 Å²	88	44.5 Å²	44.5	54%	0.54	24%	0.24	S	C	.	.	H	α-helix	trans	-74.3	-44	-176.6	73.3	0	0	0	0	111.9	D572 E578	D572-T574 PolarHBondContact O-N 3.38Å; D572-T574 VanDerWaalsContact O-N 3.1Å; D572-T574 PolarHBondContact OD1-N 3.32Å; D572-T574 VanDerWaalsContact OD1-N 3.08Å; D572-T574 PolarHBondContact OD1-OG1 3.1Å; T574-E578 PolarHBondContact O-N 3.37Å; T574-E578 VanDerWaalsContact O-N 3.08Å
575	Q	90	Very high	90.6	Very high	36 Å²	36	47.5 Å²	47.5	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-71.6	-39.4	174.2	-69.1	-60.7	-84.1	0	0	111.3	Y567 D572 Q577 E578 W579	Y567-Q575 HydrophobicContact CD1-CB 3.57Å; Y567-Q575 HydrophobicContact CD1-CG 4.3Å; Y567-Q575 HydrophobicContact CD2-CB 4.19Å; Y567-Q575 HydrophobicContact CE1-CB 3.84Å; Y567-Q575 HydrophobicContact CE1-CG 4.14Å; Y567-Q575 HydrophobicContact CE2-CB 4.44Å; Y567-Q575 HydrophobicContact CG-CB 3.77Å; D572-Q575 HydrophobicContact CB-CB 4.45Å; D572-Q575 PolarHBondContact O-N 3.19Å; D572-Q575 PolarHBondContact OD1-N 3.3Å; D572-Q575 WeakPolarHBondContact OD2-CG 3.29Å; Q575-Q577 VanDerWaalsContact C-N 3.33Å; Q575-Q577 PolarHBondContact O-N 3.24Å; Q575-E578 PolarHBondContact NE2-OE2 2.94Å; Q575-E578 PolarHBondContact O-N 3.47Å; Q575-W579 PolarHBondContact O-N 3.46Å
576	A	91.3	Very high	90.3	Very high	4 Å²	4	49.6 Å²	49.6	3%	0.033	28%	0.281	C	S	.	.	H	α-helix	trans	-53.9	-48.8	173.3	0	0	0	0	0	111.8	E568 D572 W579 A580	E568-A576 HydrophobicContact CG-CB 3.6Å; D572-A576 WeakPolarHBondContact O-CB 3.43Å; D572-A576 PolarHBondContact O-N 2.9Å; A576-W579 PolarHBondContact O-N 3.31Å; A576-A580 WeakPolarHBondContact O-CB 3.37Å; A576-A580 PolarHBondContact O-N 3.14Å
577	Q	90.2	Very high	90	Very high	25 Å²	25	52 Å²	52	12%	0.117	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-42.6	177.4	-165.2	-157.9	47.6	0	0	112.4	S573 Q575 W579 A580 M581 E604	S573-Q577 VanDerWaalsContact O-CB 3.27Å; S573-Q577 WeakPolarHBondContact O-CB 3.43Å; S573-Q577 PolarHBondContact O-N 3.29Å; Q575-Q577 VanDerWaalsContact C-N 3.33Å; Q575-Q577 PolarHBondContact O-N 3.24Å; Q577-W579 VanDerWaalsContact C-N 3.29Å; Q577-W579 PolarHBondContact O-N 3.05Å; Q577-A580 PolarHBondContact O-N 3.17Å; Q577-M581 HydrophobicContact CG-CE 3.81Å; Q577-M581 WeakPolarHBondContact O-CG 3.49Å; Q577-M581 PolarHBondContact O-N 2.77Å; Q577-E604 VanDerWaalsContact NE2-CD 3.26Å; Q577-E604 PolarHBondContact NE2-OE1 3.04Å; Q577-E604 PolarHBondContact NE2-OE2 3.02Å; Q577-E604 PolarHBondContact OE1-OE1 3.29Å
578	E	91.4	Very high	89.8	Confident	82 Å²	82	53.6 Å²	53.6	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-57.4	-40.1	174.1	-79.2	-172.2	171.3	0	0	111.6	K44 T574 Q575 Q582	K44-E578 IonicContact NZ-OE1 3.39Å; K44-E578 PolarHBondContact NZ-OE1 2.76Å; K44-E578 IonicContact NZ-OE2 2.8Å; K44-E578 PolarHBondContact NZ-OE2 2.85Å; K44-E578 VanDerWaalsContact NZ-OE2 3.07Å; T574-E578 PolarHBondContact O-N 3.37Å; T574-E578 VanDerWaalsContact O-N 3.08Å; Q575-E578 PolarHBondContact NE2-OE2 2.94Å; Q575-E578 PolarHBondContact O-N 3.47Å; E578-Q582 WeakPolarHBondContact O-CG 3.49Å; E578-Q582 PolarHBondContact O-N 3.11Å
579	W	91.5	Very high	89.7	Confident	11 Å²	11	54.1 Å²	54.1	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-75.1	-39.2	176.3	-69.9	114.1	0	0	0	113.3	F547 Y550 V560 L563 M564 Y567 Q575 A576 Q577 M581 Q582 L583	F547-W579 HydrophobicContact CE1-CH2 4.03Å; F547-W579 AromaticContact CE1-CZ2 3.59Å; F547-W579 HydrophobicContact CE1-CZ2 3.59Å; F547-W579 HydrophobicContact CZ-CZ2 4Å; Y550-W579 HydrophobicContact CE1-CH2 4.4Å; Y550-W579 HydrophobicContact CE2-CZ3 4.32Å; V560-W579 HydrophobicContact CG1-CE3 4.01Å; L563-W579 HydrophobicContact CB-CD2 4.42Å; L563-W579 HydrophobicContact CB-CG 4.5Å; L563-W579 HydrophobicContact CD1-CE3 4.38Å; L563-W579 HydrophobicContact CD1-CH2 4.16Å; L563-W579 HydrophobicContact CD1-CZ2 4.35Å; L563-W579 HydrophobicContact CD1-CZ3 4.18Å; M564-W579 HydrophobicContact CB-CB 4.01Å; Y567-W579 AromaticContact CD2-CD1 3.4Å; Y567-W579 AromaticContact CD2-NE1 3.54Å; Y567-W579 AromaticContact CE2-CD1 3.66Å; Y567-W579 AromaticContact CE2-NE1 3.24Å; Q575-W579 PolarHBondContact O-N 3.46Å; A576-W579 PolarHBondContact O-N 3.31Å; Q577-W579 VanDerWaalsContact C-N 3.29Å; Q577-W579 PolarHBondContact O-N 3.05Å; W579-M581 VanDerWaalsContact C-N 3.31Å; W579-M581 PolarHBondContact O-N 3.31Å; W579-Q582 WeakPolarHBondContact O-CB 3.24Å; W579-Q582 PolarHBondContact O-N 2.95Å; W579-Q582 VanDerWaalsContact O-N 3.13Å; W579-L583 PolarHBondContact O-N 3.05Å
580	A	91.5	Very high	89.7	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-40.1	175.2	0	0	0	0	0	111.8	M564 A576 Q577 L583 H584 L593 L597	M564-A580 HydrophobicContact CG-CB 4.1Å; M564-A580 HydrophobicContact SD-CB 3.7Å; A576-A580 WeakPolarHBondContact O-CB 3.37Å; A576-A580 PolarHBondContact O-N 3.14Å; Q577-A580 PolarHBondContact O-N 3.17Å; A580-L583 PolarHBondContact O-N 3.27Å; A580-H584 WeakPolarHBondContact O-CB 3.44Å; A580-H584 PolarHBondContact O-N 3.14Å; A580-L593 HydrophobicContact CB-CD1 4.07Å; A580-L597 HydrophobicContact CB-CD2 3.62Å; A580-L597 HydrophobicContact CB-CG 4.17Å
581	M	91.4	Very high	89.6	Confident	74 Å²	74	47.8 Å²	47.8	37%	0.365	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-39.4	173.3	-69.7	-167.6	-157.8	0	0	112.7	Q577 W579 H584 G585 L597 Y601	Q577-M581 HydrophobicContact CG-CE 3.81Å; Q577-M581 WeakPolarHBondContact O-CG 3.49Å; Q577-M581 PolarHBondContact O-N 2.77Å; W579-M581 VanDerWaalsContact C-N 3.31Å; W579-M581 PolarHBondContact O-N 3.31Å; M581-H584 PolarHBondContact O-N 2.9Å; M581-G585 PolarHBondContact O-N 3.41Å; M581-G585 VanDerWaalsContact O-N 3.08Å; M581-L597 HydrophobicContact CG-CD2 4.23Å; M581-Y601 HydrophobicContact CE-CE2 4.49Å; M581-Y601 WeakPolarHBondContact CE-OH 3.27Å
582	Q	90.1	Very high	89.7	Confident	74 Å²	74	47.7 Å²	47.7	35%	0.346	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-42.8	174.2	-73.6	-178.2	56.3	0	0	111.5	V560 E578 W579 G585 M586	V560-Q582 HydrophobicContact CG1-CB 4.43Å; E578-Q582 WeakPolarHBondContact O-CG 3.49Å; E578-Q582 PolarHBondContact O-N 3.11Å; W579-Q582 WeakPolarHBondContact O-CB 3.24Å; W579-Q582 PolarHBondContact O-N 2.95Å; W579-Q582 VanDerWaalsContact O-N 3.13Å; Q582-G585 PolarHBondContact O-N 3.2Å; Q582-M586 PolarHBondContact O-N 3.14Å
583	L	90.5	Very high	89.8	Confident	7 Å²	7	45 Å²	45	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-41.8	176.8	-172.7	60.1	0	0	0	111.7	A557 V560 Y561 M564 W579 A580 G585 M586 V587 L593	A557-L583 HydrophobicContact CB-CD1 3.73Å; A557-L583 VanDerWaalsContact O-CD1 3.27Å; A557-L583 WeakPolarHBondContact O-CD1 3.38Å; V560-L583 HydrophobicContact CB-CD1 4.19Å; V560-L583 HydrophobicContact CG1-CB 3.87Å; V560-L583 HydrophobicContact CG1-CD1 4.35Å; Y561-L583 HydrophobicContact CD2-CD2 3.97Å; Y561-L583 HydrophobicContact CG-CD2 4.42Å; M564-L583 HydrophobicContact SD-CD2 4.47Å; W579-L583 PolarHBondContact O-N 3.05Å; A580-L583 PolarHBondContact O-N 3.27Å; L583-G585 PolarHBondContact O-N 3.11Å; L583-M586 CarbonylContact O-C 3.55Å; L583-M586 WeakPolarHBondContact O-CA 3.5Å; L583-M586 WeakPolarHBondContact O-CB 3.23Å; L583-M586 PolarHBondContact O-N 3.15Å; L583-V587 PolarHBondContact O-N 3.24Å; L583-L593 HydrophobicContact CB-CD1 4.5Å; L583-L593 HydrophobicContact CB-CD2 3.94Å; L583-L593 HydrophobicContact CD2-CD1 3.96Å; L583-L593 HydrophobicContact CD2-CD2 3.81Å; L583-L593 HydrophobicContact CD2-CG 4.47Å; L583-L593 HydrophobicContact CG-CD1 4.48Å; L583-L593 HydrophobicContact CG-CD2 3.59Å
584	H	89.9	Confident	90.1	Very high	52 Å²	52	41.7 Å²	41.7	24%	0.241	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-34.9	175.2	174.9	73.8	0	0	0	111.6	A580 M581 M586 V587 P588 L593 L597	A580-H584 WeakPolarHBondContact O-CB 3.44Å; A580-H584 PolarHBondContact O-N 3.14Å; M581-H584 PolarHBondContact O-N 2.9Å; H584-M586 PolarHBondContact O-N 3.43Å; H584-V587 CarbonylContact O-C 3.58Å; H584-P588 VanDerWaalsContact O-CA 3.31Å; H584-P588 WeakPolarHBondContact O-CA 3.44Å; H584-P588 WeakPolarHBondContact O-CB 3.41Å; H584-L593 HydrophobicContact CB-CD2 4.1Å; H584-L597 HydrophobicContact CB-CD1 3.89Å
585	G	88.9	Confident	90.2	Very high	62 Å²	62	38.9 Å²	38.9	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.4	170.9	0	0	0	0	0	115	M581 Q582 L583	M581-G585 PolarHBondContact O-N 3.41Å; M581-G585 VanDerWaalsContact O-N 3.08Å; Q582-G585 PolarHBondContact O-N 3.2Å; L583-G585 PolarHBondContact O-N 3.11Å
586	M	86.4	Confident	90.2	Very high	58 Å²	58	38.9 Å²	38.9	29%	0.286	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-42.6	174.6	-57.4	-179	-165.3	0	0	112	N555 A557 V560 Q582 L583 H584	N555-M586 HydrophobicContact CB-CE 4.13Å; N555-M586 HydrophobicContact CB-SD 4.22Å; A557-M586 HydrophobicContact CB-CB 4.48Å; A557-M586 HydrophobicContact CB-SD 4.49Å; V560-M586 HydrophobicContact CG2-CE 4.02Å; V560-M586 HydrophobicContact CG2-SD 4.34Å; Q582-M586 PolarHBondContact O-N 3.14Å; L583-M586 CarbonylContact O-C 3.55Å; L583-M586 WeakPolarHBondContact O-CA 3.5Å; L583-M586 WeakPolarHBondContact O-CB 3.23Å; L583-M586 PolarHBondContact O-N 3.15Å; H584-M586 PolarHBondContact O-N 3.43Å
587	V	86.9	Confident	90.2	Very high	52 Å²	52	38.7 Å²	38.7	32%	0.315	21%	0.214	S	C	.	.			trans	-128	76.2	-176.7	-168	0	0	0	0	109.9	A557 L583 H584 T589 D590	A557-V587 HydrophobicContact CB-CG2 3.81Å; L583-V587 PolarHBondContact O-N 3.24Å; H584-V587 CarbonylContact O-C 3.58Å; V587-T589 PolarHBondContact O-N 2.96Å; V587-D590 HydrophobicContact CG1-CB 3.94Å
588	P	88.3	Confident	90.3	Very high	64 Å²	64	37.5 Å²	37.5	42%	0.416	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.6	-175.6	29.7	-36.3	0	0	0	114.1	H584	H584-P588 VanDerWaalsContact O-CA 3.31Å; H584-P588 WeakPolarHBondContact O-CA 3.44Å; H584-P588 WeakPolarHBondContact O-CB 3.41Å
589	T	88.3	Confident	90.4	Very high	77 Å²	77	35.1 Å²	35.1	47%	0.472	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	1.4	-174.1	58.5	0	0	0	0	114	V587 P591 Y620	V587-T589 PolarHBondContact O-N 2.96Å; T589-P591 WeakPolarHBondContact O-CD 3.43Å; T589-Y620 HydrophobicContact CG2-CE1 3.97Å
590	D	89.6	Confident	90.3	Very high	27 Å²	27	35.7 Å²	35.7	14%	0.144	20%	0.204	C	C	.	.			trans	-81.4	117.3	-177.5	-174	58.4	0	0	0	111.7	V587 F592 L593 L594	V587-D590 HydrophobicContact CG1-CB 3.94Å; D590-F592 PolarHBondContact O-N 3.32Å; D590-L593 HydrophobicContact CB-CB 4.11Å; D590-L593 WeakPolarHBondContact OD2-CB 3.35Å; D590-L593 PolarHBondContact OD2-N 3.08Å; D590-L594 VanDerWaalsContact O-CG 3.28Å; D590-L594 WeakPolarHBondContact O-CG 3.42Å; D590-L594 PolarHBondContact O-N 2.68Å; D590-L594 VanDerWaalsContact O-N 3.15Å
591	P	90.5	Very high	90.3	Very high	19 Å²	19	37.1 Å²	37.1	12%	0.123	21%	0.209	C	C	.	.	H	α-helix	trans	-67.8	-33.6	-173.5	-13.4	25.2	0	0	0	113.7	T589 L594 Q595 S617 Y621	T589-P591 WeakPolarHBondContact O-CD 3.43Å; P591-L594 PolarHBondContact O-N 3.15Å; P591-Q595 PolarHBondContact O-N 3.27Å; P591-S617 PolarHBondContact O-OG 3.13Å; P591-Y621 VanDerWaalsContact CG-CB 3.48Å; P591-Y621 HydrophobicContact CG-CG 4.49Å
592	F	90.1	Very high	90.3	Very high	53 Å²	53	36.3 Å²	36.3	23%	0.232	20%	0.204	C	C	.	.	H	α-helix	trans	-73.3	-42.1	-177.9	-62.8	-72.3	0	0	0	111	T3 D590 L594 Q595 R596 Y621	T3-F592 HydrophobicContact CG2-CE2 4.19Å; T3-F592 HydrophobicContact CG2-CZ 4.46Å; D590-F592 PolarHBondContact O-N 3.32Å; F592-L594 VanDerWaalsContact C-N 3.34Å; F592-L594 PolarHBondContact O-N 3.29Å; F592-Q595 WeakPolarHBondContact O-CB 3.35Å; F592-Q595 PolarHBondContact O-N 3.31Å; F592-R596 PolarHBondContact O-N 2.84Å; F592-Y621 HydrophobicContact CZ-CE1 4.46Å
593	L	91.6	Very high	90.3	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-42.1	170.2	-179.6	60.1	0	0	0	112.9	M564 A580 L583 H584 D590 Q595 R596 L597	M564-L593 HydrophobicContact SD-CD1 3.86Å; A580-L593 HydrophobicContact CB-CD1 4.07Å; L583-L593 HydrophobicContact CB-CD1 4.5Å; L583-L593 HydrophobicContact CB-CD2 3.94Å; L583-L593 HydrophobicContact CD2-CD1 3.96Å; L583-L593 HydrophobicContact CD2-CD2 3.81Å; L583-L593 HydrophobicContact CD2-CG 4.47Å; L583-L593 HydrophobicContact CG-CD1 4.48Å; L583-L593 HydrophobicContact CG-CD2 3.59Å; H584-L593 HydrophobicContact CB-CD2 4.1Å; D590-L593 HydrophobicContact CB-CB 4.11Å; D590-L593 WeakPolarHBondContact OD2-CB 3.35Å; D590-L593 PolarHBondContact OD2-N 3.08Å; L593-Q595 VanDerWaalsContact C-N 3.3Å; L593-Q595 PolarHBondContact O-N 2.97Å; L593-R596 PolarHBondContact O-N 2.83Å; L593-L597 PolarHBondContact O-N 3.4Å
594	L	92.7	Very high	90.2	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-37	175.2	-70.2	167.3	0	0	0	111.5	D590 P591 F592 G598 Y613 D616 Y620	D590-L594 VanDerWaalsContact O-CG 3.28Å; D590-L594 WeakPolarHBondContact O-CG 3.42Å; D590-L594 PolarHBondContact O-N 2.68Å; D590-L594 VanDerWaalsContact O-N 3.15Å; P591-L594 PolarHBondContact O-N 3.15Å; F592-L594 VanDerWaalsContact C-N 3.34Å; F592-L594 PolarHBondContact O-N 3.29Å; L594-G598 PolarHBondContact O-N 3.46Å; L594-Y613 HydrophobicContact CD2-CD1 3.82Å; L594-Y613 HydrophobicContact CD2-CE1 4.42Å; L594-D616 HydrophobicContact CD1-CB 4.28Å; L594-Y620 HydrophobicContact CD1-CD2 3.61Å; L594-Y620 HydrophobicContact CD1-CE2 3.9Å
595	Q	92.2	Very high	90.2	Very high	29 Å²	29	44.7 Å²	44.7	14%	0.136	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-50.8	171.2	173.5	177.9	-1	0	0	111.4	P591 F592 L593 L597 G598 D599 Y614 N624 V627	P591-Q595 PolarHBondContact O-N 3.27Å; F592-Q595 WeakPolarHBondContact O-CB 3.35Å; F592-Q595 PolarHBondContact O-N 3.31Å; L593-Q595 VanDerWaalsContact C-N 3.3Å; L593-Q595 PolarHBondContact O-N 2.97Å; Q595-L597 VanDerWaalsContact C-N 3.27Å; Q595-L597 PolarHBondContact O-N 2.94Å; Q595-G598 CarbonylContact O-C 3.59Å; Q595-G598 WeakPolarHBondContact O-CA 3.29Å; Q595-G598 PolarHBondContact O-N 2.83Å; Q595-D599 WeakPolarHBondContact CG-OD2 3.41Å; Q595-D599 PolarHBondContact O-N 3.15Å; Q595-Y614 HydrophobicContact CG-CE1 4.2Å; Q595-N624 PolarHBondContact OE1-ND2 3.08Å; Q595-V627 HydrophobicContact CB-CG2 4.18Å; Q595-V627 HydrophobicContact CG-CG2 4.15Å
596	R	90.6	Very high	90.3	Very high	37 Å²	37	44.6 Å²	44.6	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-35.7	179.4	-67.1	-169.2	-168.9	-165.7	8.3	113	D4 Y561 E568 F592 L593 S600	D4-R596 IonicContact OD1-NH2 2.83Å; D4-R596 PolarHBondContact OD1-NH2 3.45Å; D4-R596 IonicContact OD2-CZ 2.68Å; D4-R596 IonicContact OD2-NH2 2.66Å; D4-R596 PolarHBondContact OD2-NH2 3.29Å; Y561-R596 PolarHBondContact OH-NH2 2.86Å; E568-R596 IonicContact OE2-CZ 2.84Å; E568-R596 IonicContact OE2-NH1 3.24Å; E568-R596 PolarHBondContact OE2-NH1 3.24Å; F592-R596 PolarHBondContact O-N 2.84Å; L593-R596 PolarHBondContact O-N 2.83Å; R596-S600 WeakPolarHBondContact O-CB 3.3Å; R596-S600 PolarHBondContact O-N 3.18Å; R596-S600 PolarHBondContact O-OG 3.15Å
597	L	92.1	Very high	90.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.5	-41.7	171.5	-75.3	171.4	0	0	0	111.7	A580 M581 H584 L593 Q595 S600 Y601 Y613	A580-L597 HydrophobicContact CB-CD2 3.62Å; A580-L597 HydrophobicContact CB-CG 4.17Å; M581-L597 HydrophobicContact CG-CD2 4.23Å; H584-L597 HydrophobicContact CB-CD1 3.89Å; L593-L597 PolarHBondContact O-N 3.4Å; Q595-L597 VanDerWaalsContact C-N 3.27Å; Q595-L597 PolarHBondContact O-N 2.94Å; L597-S600 WeakPolarHBondContact O-CB 3.49Å; L597-S600 PolarHBondContact O-N 3.02Å; L597-Y601 VanDerWaalsContact O-CD2 3.27Å; L597-Y601 WeakPolarHBondContact O-CD2 3.16Å; L597-Y601 PolarHBondContact O-N 3.24Å; L597-Y613 HydrophobicContact CB-CD1 3.95Å; L597-Y613 HydrophobicContact CB-CD2 4.4Å; L597-Y613 HydrophobicContact CB-CE1 4.3Å; L597-Y613 HydrophobicContact CB-CG 4.02Å; L597-Y613 HydrophobicContact CD1-CD1 4.08Å; L597-Y613 HydrophobicContact CD1-CE1 3.81Å
598	G	92.4	Very high	90.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-49.1	172.2	0	0	0	0	0	112.7	L594 Q595 S600 Y601 E602	L594-G598 PolarHBondContact O-N 3.46Å; Q595-G598 CarbonylContact O-C 3.59Å; Q595-G598 WeakPolarHBondContact O-CA 3.29Å; Q595-G598 PolarHBondContact O-N 2.83Å; G598-S600 VanDerWaalsContact C-N 3.28Å; G598-S600 PolarHBondContact O-N 3.48Å; G598-Y601 PolarHBondContact O-N 2.71Å; G598-E602 WeakPolarHBondContact O-CB 3.47Å; G598-E602 PolarHBondContact O-N 3.13Å
599	D	91.7	Very high	91	Very high	32 Å²	32	47.9 Å²	47.9	17%	0.171	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-34.6	175.8	-72.5	-53	0	0	0	112.4	Q595 Q603 Y614 R828	Q595-D599 WeakPolarHBondContact CG-OD2 3.41Å; Q595-D599 PolarHBondContact O-N 3.15Å; D599-Q603 VanDerWaalsContact O-CG 3.3Å; D599-Q603 WeakPolarHBondContact O-CG 3.45Å; D599-Q603 PolarHBondContact O-N 3.14Å; D599-Q603 VanDerWaalsContact O-N 3.11Å; D599-Q603 PolarHBondContact O-NE2 3.06Å; D599-Q603 VanDerWaalsContact O-NE2 3.11Å; D599-Y614 WeakPolarHBondContact CA-OH 3.42Å; D599-Y614 PolarHBondContact N-OH 2.98Å; D599-Y614 PolarHBondContact OD1-OH 3.39Å; D599-R828 IonicContact OD1-CZ 2.65Å; D599-R828 IonicContact OD1-NH2 2.78Å; D599-R828 PolarHBondContact OD1-NH2 3.01Å
600	S	90	Very high	91.3	Very high	22 Å²	22	44.2 Å²	44.2	15%	0.154	23%	0.232	C	C	.	.	H	α-helix	trans	-68.5	-48.4	176.2	-59.3	0	0	0	0	111.5	R596 L597 G598 E602 Q603 E604	R596-S600 WeakPolarHBondContact O-CB 3.3Å; R596-S600 PolarHBondContact O-N 3.18Å; R596-S600 PolarHBondContact O-OG 3.15Å; L597-S600 WeakPolarHBondContact O-CB 3.49Å; L597-S600 PolarHBondContact O-N 3.02Å; G598-S600 VanDerWaalsContact C-N 3.28Å; G598-S600 PolarHBondContact O-N 3.48Å; S600-E602 VanDerWaalsContact C-N 3.31Å; S600-E602 PolarHBondContact O-N 2.69Å; S600-Q603 WeakPolarHBondContact O-CB 3.19Å; S600-Q603 PolarHBondContact O-N 3.15Å; S600-E604 PolarHBondContact O-N 3.11Å
601	Y	91.9	Very high	91.5	Very high	32 Å²	32	45.1 Å²	45.1	13%	0.125	24%	0.235	C	C	.	.	H	α-helix	trans	-68	-29.8	177.2	-80.6	-66.2	0	0	0	113.1	M581 L597 G598 E604 G605 D606 Q609 Y613	M581-Y601 HydrophobicContact CE-CE2 4.49Å; M581-Y601 WeakPolarHBondContact CE-OH 3.27Å; L597-Y601 VanDerWaalsContact O-CD2 3.27Å; L597-Y601 WeakPolarHBondContact O-CD2 3.16Å; L597-Y601 PolarHBondContact O-N 3.24Å; G598-Y601 PolarHBondContact O-N 2.71Å; Y601-E604 VanDerWaalsContact CD1-OE2 3.27Å; Y601-E604 WeakPolarHBondContact CD1-OE2 3.41Å; Y601-E604 WeakPolarHBondContact CE1-OE2 3.43Å; Y601-E604 PolarHBondContact O-N 3.33Å; Y601-G605 PolarHBondContact O-N 3.3Å; Y601-D606 HydrophobicContact CD1-CB 4.25Å; Y601-D606 PolarHBondContact O-N 3.49Å; Y601-Q609 HydrophobicContact CD1-CB 3.72Å; Y601-Q609 HydrophobicContact CD1-CG 4.29Å; Y601-Q609 HydrophobicContact CD2-CB 3.96Å; Y601-Q609 HydrophobicContact CE1-CB 4.03Å; Y601-Q609 HydrophobicContact CE1-CG 4.2Å; Y601-Q609 HydrophobicContact CE2-CB 4.27Å; Y601-Q609 HydrophobicContact CG-CB 3.67Å; Y601-Y613 AromaticContact CD2-CD2 3.64Å; Y601-Y613 HydrophobicContact CD2-CD2 3.64Å; Y601-Y613 AromaticContact CD2-CE2 3.59Å; Y601-Y613 HydrophobicContact CD2-CE2 3.59Å; Y601-Y613 AromaticContact CE2-CD2 3.85Å; Y601-Y613 HydrophobicContact CE2-CD2 3.85Å; Y601-Y613 AromaticContact CE2-CE2 3.27Å; Y601-Y613 HydrophobicContact CE2-CE2 3.27Å
602	E	91.9	Very high	91.7	Very high	57 Å²	57	46.8 Å²	46.8	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-64.2	-42.4	170.7	-177.2	178	-165.1	0	0	111.6	G598 S600 E604 G605 A610 Y614 W630 R828	G598-E602 WeakPolarHBondContact O-CB 3.47Å; G598-E602 PolarHBondContact O-N 3.13Å; S600-E602 VanDerWaalsContact C-N 3.31Å; S600-E602 PolarHBondContact O-N 2.69Å; E602-E604 VanDerWaalsContact C-N 3.33Å; E602-E604 PolarHBondContact O-N 2.94Å; E602-G605 PolarHBondContact O-N 2.84Å; E602-G605 VanDerWaalsContact O-N 3.09Å; E602-A610 HydrophobicContact CB-CB 4.42Å; E602-Y614 PolarHBondContact OE2-OH 3.19Å; E602-W630 PolarHBondContact OE1-NE1 2.82Å; E602-W630 PolarHBondContact OE2-NE1 2.97Å; E602-R828 IonicContact OE1-CZ 3.01Å; E602-R828 IonicContact OE1-NH1 3.86Å; E602-R828 PolarHBondContact OE1-NH1 2.93Å; E602-R828 IonicContact OE2-CZ 2.7Å; E602-R828 IonicContact OE2-NH1 2.85Å; E602-R828 PolarHBondContact OE2-NH1 3Å; E602-R828 IonicContact OE2-NH2 2.67Å; E602-R828 PolarHBondContact OE2-NH2 2.87Å
603	Q	89.2	Confident	91.8	Very high	139 Å²	139	46 Å²	46	65%	0.65	24%	0.242	S	C	*	.	H	α-helix	trans	-65.5	-33.2	174.8	-74.8	170.2	66.5	0	0	113	D599 S600 G605	D599-Q603 VanDerWaalsContact O-CG 3.3Å; D599-Q603 WeakPolarHBondContact O-CG 3.45Å; D599-Q603 PolarHBondContact O-N 3.14Å; D599-Q603 VanDerWaalsContact O-N 3.11Å; D599-Q603 PolarHBondContact O-NE2 3.06Å; D599-Q603 VanDerWaalsContact O-NE2 3.11Å; S600-Q603 WeakPolarHBondContact O-CB 3.19Å; S600-Q603 PolarHBondContact O-N 3.15Å; Q603-G605 VanDerWaalsContact C-N 3.28Å
604	E	88.9	Confident	92	Very high	117 Å²	117	45.8 Å²	45.8	55%	0.547	24%	0.241	S	C	.	.	H	α-helix	trans	-73.7	-18.1	171.5	-69.2	-179.5	165.1	0	0	113.4	Q577 S600 Y601 E602	Q577-E604 VanDerWaalsContact NE2-CD 3.26Å; Q577-E604 PolarHBondContact NE2-OE1 3.04Å; Q577-E604 PolarHBondContact NE2-OE2 3.02Å; Q577-E604 PolarHBondContact OE1-OE1 3.29Å; S600-E604 PolarHBondContact O-N 3.11Å; Y601-E604 VanDerWaalsContact CD1-OE2 3.27Å; Y601-E604 WeakPolarHBondContact CD1-OE2 3.41Å; Y601-E604 WeakPolarHBondContact CE1-OE2 3.43Å; Y601-E604 PolarHBondContact O-N 3.33Å; E602-E604 VanDerWaalsContact C-N 3.33Å; E602-E604 PolarHBondContact O-N 2.94Å
605	G	89.4	Confident	92.1	Very high	54 Å²	54	50.8 Å²	50.8	56%	0.557	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	2.6	-177.5	0	0	0	0	0	115.4	Y601 E602 Q603 K607	Y601-G605 PolarHBondContact O-N 3.3Å; E602-G605 PolarHBondContact O-N 2.84Å; E602-G605 VanDerWaalsContact O-N 3.09Å; Q603-G605 VanDerWaalsContact C-N 3.28Å; G605-K607 VanDerWaalsContact C-N 3.29Å; G605-K607 PolarHBondContact O-N 2.98Å
606	D	92.4	Very high	92.1	Very high	60 Å²	60	51.7 Å²	51.7	32%	0.321	27%	0.267	S	S	.	.			trans	-80.3	78.4	172.8	-166.9	-20.5	0	0	0	110.8	Y601 S608 Q609 A610	Y601-D606 HydrophobicContact CD1-CB 4.25Å; Y601-D606 PolarHBondContact O-N 3.49Å; D606-S608 PolarHBondContact O-N 3.39Å; D606-S608 WeakPolarHBondContact OD1-CA 3.36Å; D606-S608 WeakPolarHBondContact OD1-CB 3.43Å; D606-S608 PolarHBondContact OD1-N 3.49Å; D606-S608 PolarHBondContact OD1-OG 3.49Å; D606-Q609 HydrophobicContact CB-CB 4.44Å; D606-Q609 PolarHBondContact O-N 3.47Å; D606-Q609 PolarHBondContact OD1-N 3.27Å; D606-Q609 VanDerWaalsContact OD2-CG 3.31Å; D606-Q609 WeakPolarHBondContact OD2-CG 3.19Å; D606-A610 WeakPolarHBondContact O-CB 3.48Å; D606-A610 PolarHBondContact O-N 3.22Å
607	K	91.3	Very high	92.3	Very high	99 Å²	99	50 Å²	50	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-54	-22.8	173.8	-66.2	-170.7	174.5	-172.3	0	113.2	G605 F611 Y634 E637	G605-K607 VanDerWaalsContact C-N 3.29Å; G605-K607 PolarHBondContact O-N 2.98Å; K607-F611 VanDerWaalsContact O-CB 3.31Å; K607-F611 WeakPolarHBondContact O-CB 3.42Å; K607-F611 PolarHBondContact O-N 3.14Å; K607-Y634 HydrophobicContact CB-CE2 4.29Å; K607-E637 IonicContact NZ-OE1 3.25Å; K607-E637 PolarHBondContact NZ-OE1 3.09Å; K607-E637 IonicContact NZ-OE2 3.12Å; K607-E637 PolarHBondContact NZ-OE2 3.41Å
608	S	91.8	Very high	92.3	Very high	70 Å²	70	51.1 Å²	51.1	49%	0.49	27%	0.265	S	S	.	.	H	α-helix	trans	-79.5	-41.9	-177.5	80.2	0	0	0	0	112.7	D606 S612	D606-S608 PolarHBondContact O-N 3.39Å; D606-S608 WeakPolarHBondContact OD1-CA 3.36Å; D606-S608 WeakPolarHBondContact OD1-CB 3.43Å; D606-S608 PolarHBondContact OD1-N 3.49Å; D606-S608 PolarHBondContact OD1-OG 3.49Å; S608-S612 PolarHBondContact O-N 2.93Å
609	Q	91.8	Very high	92.3	Very high	74 Å²	74	56.8 Å²	56.8	35%	0.346	29%	0.29	S	S	.	.	H	α-helix	trans	-71.1	-44.4	172	-67.1	-60	-32.2	0	0	110.7	Y601 D606 F611 S612 Y613	Y601-Q609 HydrophobicContact CD1-CB 3.72Å; Y601-Q609 HydrophobicContact CD1-CG 4.29Å; Y601-Q609 HydrophobicContact CD2-CB 3.96Å; Y601-Q609 HydrophobicContact CE1-CB 4.03Å; Y601-Q609 HydrophobicContact CE1-CG 4.2Å; Y601-Q609 HydrophobicContact CE2-CB 4.27Å; Y601-Q609 HydrophobicContact CG-CB 3.67Å; D606-Q609 HydrophobicContact CB-CB 4.44Å; D606-Q609 PolarHBondContact O-N 3.47Å; D606-Q609 PolarHBondContact OD1-N 3.27Å; D606-Q609 VanDerWaalsContact OD2-CG 3.31Å; D606-Q609 WeakPolarHBondContact OD2-CG 3.19Å; Q609-F611 VanDerWaalsContact C-N 3.27Å; Q609-F611 PolarHBondContact O-N 3.38Å; Q609-S612 WeakPolarHBondContact O-CB 3.39Å; Q609-S612 PolarHBondContact O-N 3.39Å; Q609-Y613 HydrophobicContact CB-CE2 4.49Å; Q609-Y613 VanDerWaalsContact O-CD2 3.22Å; Q609-Y613 WeakPolarHBondContact O-CD2 3.31Å; Q609-Y613 PolarHBondContact O-N 3.23Å; Q609-Y613 VanDerWaalsContact O-N 3.09Å
610	A	94.5	Very high	92.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-51.8	-47.3	174.6	0	0	0	0	0	111.2	E602 D606 S612 Y613 Y614 W630	E602-A610 HydrophobicContact CB-CB 4.42Å; D606-A610 WeakPolarHBondContact O-CB 3.48Å; D606-A610 PolarHBondContact O-N 3.22Å; A610-S612 VanDerWaalsContact C-N 3.34Å; A610-S612 PolarHBondContact O-N 2.89Å; A610-Y613 PolarHBondContact O-N 3.09Å; A610-Y614 HydrophobicContact CB-CD2 4.2Å; A610-Y614 HydrophobicContact CB-CE2 4.18Å; A610-Y614 WeakPolarHBondContact O-CB 3.43Å; A610-Y614 WeakPolarHBondContact O-CD2 3.47Å; A610-Y614 PolarHBondContact O-N 3.42Å; A610-W630 HydrophobicContact CB-CH2 3.88Å; A610-W630 HydrophobicContact CB-CZ2 3.68Å
611	F	94.2	Very high	92.3	Very high	46 Å²	46	63.9 Å²	63.9	20%	0.202	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-41.6	175.8	174.1	-94.4	0	0	0	113.4	K607 Q609 Y615 W630 L631 Y634 Y635	K607-F611 VanDerWaalsContact O-CB 3.31Å; K607-F611 WeakPolarHBondContact O-CB 3.42Å; K607-F611 PolarHBondContact O-N 3.14Å; Q609-F611 VanDerWaalsContact C-N 3.27Å; Q609-F611 PolarHBondContact O-N 3.38Å; F611-Y615 HydrophobicContact CZ-CD2 4.21Å; F611-Y615 HydrophobicContact CZ-CG 4.41Å; F611-Y615 WeakPolarHBondContact O-CB 3.33Å; F611-Y615 PolarHBondContact O-N 3.41Å; F611-W630 HydrophobicContact CB-CH2 3.88Å; F611-W630 HydrophobicContact CB-CZ3 3.9Å; F611-W630 HydrophobicContact CD2-CZ3 4.16Å; F611-L631 HydrophobicContact CD2-CD2 3.82Å; F611-L631 HydrophobicContact CE2-CD2 3.8Å; F611-Y634 HydrophobicContact CB-CD2 4.45Å; F611-Y634 HydrophobicContact CB-CE1 4.21Å; F611-Y634 HydrophobicContact CB-CE2 4.03Å; F611-Y634 AromaticContact CD2-CD1 3.36Å; F611-Y634 HydrophobicContact CD2-CD1 3.36Å; F611-Y634 AromaticContact CD2-CE1 3.27Å; F611-Y634 HydrophobicContact CD2-CE1 3.27Å; F611-Y634 HydrophobicContact CD2-CE2 4.47Å; F611-Y634 HydrophobicContact CD2-CG 4.03Å; F611-Y634 AromaticContact CD2-CZ 3.88Å; F611-Y634 AromaticContact CE2-CD1 3.84Å; F611-Y634 HydrophobicContact CE2-CD1 3.84Å; F611-Y634 AromaticContact CE2-CE1 3.75Å; F611-Y634 HydrophobicContact CE2-CE1 3.75Å; F611-Y634 HydrophobicContact CG-CD1 4.19Å; F611-Y634 AromaticContact CG-CE1 3.72Å; F611-Y634 HydrophobicContact CG-CE1 3.72Å; F611-Y634 HydrophobicContact CG-CE2 4.44Å; F611-Y634 AromaticContact CG-CZ 3.87Å; F611-Y635 HydrophobicContact CE2-CE1 4.41Å; F611-Y635 HydrophobicContact CE2-CE2 4.07Å; F611-Y635 AromaticContact CE2-CZ 3.76Å; F611-Y635 WeakPolarHBondContact CZ-OH 3.48Å
612	S	94.3	Very high	92.2	Very high	53 Å²	53	63.7 Å²	63.7	37%	0.371	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-47	177.8	-162.4	0	0	0	0	111.7	S608 Q609 A610 Y615 D616	S608-S612 PolarHBondContact O-N 2.93Å; Q609-S612 WeakPolarHBondContact O-CB 3.39Å; Q609-S612 PolarHBondContact O-N 3.39Å; A610-S612 VanDerWaalsContact C-N 3.34Å; A610-S612 PolarHBondContact O-N 2.89Å; S612-Y615 PolarHBondContact O-N 2.87Å; S612-D616 PolarHBondContact O-N 3.21Å
613	Y	94	Very high	92	Very high	37 Å²	37	62.6 Å²	62.6	15%	0.145	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-42.8	-178.7	-73.2	-70.3	0	0	0	112.8	L594 L597 Y601 Q609 A610 Y615 D616 S617	L594-Y613 HydrophobicContact CD2-CD1 3.82Å; L594-Y613 HydrophobicContact CD2-CE1 4.42Å; L597-Y613 HydrophobicContact CB-CD1 3.95Å; L597-Y613 HydrophobicContact CB-CD2 4.4Å; L597-Y613 HydrophobicContact CB-CE1 4.3Å; L597-Y613 HydrophobicContact CB-CG 4.02Å; L597-Y613 HydrophobicContact CD1-CD1 4.08Å; L597-Y613 HydrophobicContact CD1-CE1 3.81Å; Y601-Y613 AromaticContact CD2-CD2 3.64Å; Y601-Y613 HydrophobicContact CD2-CD2 3.64Å; Y601-Y613 AromaticContact CD2-CE2 3.59Å; Y601-Y613 HydrophobicContact CD2-CE2 3.59Å; Y601-Y613 AromaticContact CE2-CD2 3.85Å; Y601-Y613 HydrophobicContact CE2-CD2 3.85Å; Y601-Y613 AromaticContact CE2-CE2 3.27Å; Y601-Y613 HydrophobicContact CE2-CE2 3.27Å; Q609-Y613 HydrophobicContact CB-CE2 4.49Å; Q609-Y613 VanDerWaalsContact O-CD2 3.22Å; Q609-Y613 WeakPolarHBondContact O-CD2 3.31Å; Q609-Y613 PolarHBondContact O-N 3.23Å; Q609-Y613 VanDerWaalsContact O-N 3.09Å; A610-Y613 PolarHBondContact O-N 3.09Å; Y613-Y615 PolarHBondContact O-N 2.9Å; Y613-D616 PolarHBondContact O-N 3.34Å; Y613-S617 WeakPolarHBondContact O-CB 3.43Å; Y613-S617 PolarHBondContact O-N 3.05Å
614	Y	95.2	Very high	92	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-38.7	174.1	-75.6	-59.2	0	0	0	112.3	Q595 D599 E602 A610 S617 F618 V627 W630	Q595-Y614 HydrophobicContact CG-CE1 4.2Å; D599-Y614 WeakPolarHBondContact CA-OH 3.42Å; D599-Y614 PolarHBondContact N-OH 2.98Å; D599-Y614 PolarHBondContact OD1-OH 3.39Å; E602-Y614 PolarHBondContact OE2-OH 3.19Å; A610-Y614 HydrophobicContact CB-CD2 4.2Å; A610-Y614 HydrophobicContact CB-CE2 4.18Å; A610-Y614 WeakPolarHBondContact O-CB 3.43Å; A610-Y614 WeakPolarHBondContact O-CD2 3.47Å; A610-Y614 PolarHBondContact O-N 3.42Å; Y614-S617 PolarHBondContact O-N 3.29Å; Y614-F618 WeakPolarHBondContact O-CB 3.45Å; Y614-F618 PolarHBondContact O-N 2.98Å; Y614-V627 HydrophobicContact CD1-CB 4.34Å; Y614-V627 HydrophobicContact CD1-CG1 4.03Å; Y614-V627 HydrophobicContact CD1-CG2 3.98Å; Y614-V627 HydrophobicContact CE1-CG2 4.38Å; Y614-V627 VanDerWaalsContact O-CG1 3.24Å; Y614-V627 WeakPolarHBondContact O-CG1 3.28Å; Y614-W630 AromaticContact CD2-CD2 3.26Å; Y614-W630 HydrophobicContact CD2-CD2 3.26Å; Y614-W630 AromaticContact CD2-CE2 3.62Å; Y614-W630 AromaticContact CD2-CE3 3.26Å; Y614-W630 HydrophobicContact CD2-CE3 3.26Å; Y614-W630 AromaticContact CD2-CG 3.85Å; Y614-W630 HydrophobicContact CD2-CG 3.85Å; Y614-W630 AromaticContact CD2-CH2 3.96Å; Y614-W630 HydrophobicContact CD2-CH2 3.96Å; Y614-W630 AromaticContact CD2-CZ2 3.94Å; Y614-W630 HydrophobicContact CD2-CZ2 3.94Å; Y614-W630 AromaticContact CD2-CZ3 3.64Å; Y614-W630 HydrophobicContact CD2-CZ3 3.64Å; Y614-W630 HydrophobicContact CE1-CG 4.48Å; Y614-W630 HydrophobicContact CE2-CB 4.41Å; Y614-W630 AromaticContact CE2-CD1 3.7Å; Y614-W630 AromaticContact CE2-CD2 3.35Å; Y614-W630 HydrophobicContact CE2-CD2 3.35Å; Y614-W630 AromaticContact CE2-CE2 3.39Å; Y614-W630 AromaticContact CE2-CE3 3.89Å; Y614-W630 HydrophobicContact CE2-CE3 3.89Å; Y614-W630 AromaticContact CE2-CG 3.57Å; Y614-W630 HydrophobicContact CE2-CG 3.57Å; Y614-W630 HydrophobicContact CE2-CH2 4.44Å; Y614-W630 AromaticContact CE2-CZ2 3.96Å; Y614-W630 HydrophobicContact CE2-CZ2 3.96Å; Y614-W630 HydrophobicContact CE2-CZ3 4.41Å; Y614-W630 AromaticContact CE2-NE1 3.6Å; Y614-W630 HydrophobicContact CG-CD2 4.04Å; Y614-W630 AromaticContact CG-CE3 3.8Å; Y614-W630 HydrophobicContact CG-CE3 3.8Å; Y614-W630 HydrophobicContact CG-CG 4.41Å; Y614-W630 HydrophobicContact CG-CZ3 4.35Å; Y614-W630 AromaticContact CZ-CD1 3.96Å; Y614-W630 AromaticContact CZ-CG 3.9Å
615	Y	93.8	Very high	92.1	Very high	107 Å²	107	53.6 Å²	53.6	42%	0.42	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-44.1	176.4	-178.9	-96.9	0	0	0	112.2	F611 S612 Y613 F618 K619	F611-Y615 HydrophobicContact CZ-CD2 4.21Å; F611-Y615 HydrophobicContact CZ-CG 4.41Å; F611-Y615 WeakPolarHBondContact O-CB 3.33Å; F611-Y615 PolarHBondContact O-N 3.41Å; S612-Y615 PolarHBondContact O-N 2.87Å; Y613-Y615 PolarHBondContact O-N 2.9Å; Y615-F618 PolarHBondContact O-N 3.43Å; Y615-K619 WeakPolarHBondContact O-CB 3.21Å; Y615-K619 PolarHBondContact O-N 3.08Å
616	D	93.2	Very high	92.2	Very high	48 Å²	48	55.8 Å²	55.8	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-68.2	-35.9	174.3	-84.7	-43.4	0	0	0	112	L594 S612 Y613 K619 Y620	L594-D616 HydrophobicContact CD1-CB 4.28Å; S612-D616 PolarHBondContact O-N 3.21Å; Y613-D616 PolarHBondContact O-N 3.34Å; D616-K619 WeakPolarHBondContact O-CB 3.4Å; D616-K619 PolarHBondContact O-N 2.96Å; D616-K619 IonicContact OD1-NZ 3.12Å; D616-K619 PolarHBondContact OD1-NZ 2.9Å; D616-Y620 WeakPolarHBondContact O-CD2 3.43Å; D616-Y620 PolarHBondContact O-N 3.44Å
617	S	93.9	Very high	92.2	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-50.9	171.8	-178.7	0	0	0	0	111.6	P591 Y613 Y614 K619 Y620 Y621	P591-S617 PolarHBondContact O-OG 3.13Å; Y613-S617 WeakPolarHBondContact O-CB 3.43Å; Y613-S617 PolarHBondContact O-N 3.05Å; Y614-S617 PolarHBondContact O-N 3.29Å; S617-K619 VanDerWaalsContact C-N 3.27Å; S617-K619 PolarHBondContact O-N 3.33Å; S617-Y620 PolarHBondContact O-N 3.49Å; S617-Y620 VanDerWaalsContact O-N 3.11Å; S617-Y621 PolarHBondContact O-N 3.02Å
618	F	92.9	Very high	92.3	Very high	25 Å²	25	48.2 Å²	48.2	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-35.6	177.5	176.2	-98.9	0	0	0	113	Y614 Y615 Y620 Y621 P622 V627 I628 L631 Y647	Y614-F618 WeakPolarHBondContact O-CB 3.45Å; Y614-F618 PolarHBondContact O-N 2.98Å; Y615-F618 PolarHBondContact O-N 3.43Å; F618-Y620 VanDerWaalsContact C-N 3.33Å; F618-Y620 PolarHBondContact O-N 3.28Å; F618-Y621 CarbonylContact O-C 3.41Å; F618-P622 HydrophobicContact CD2-CB 4.32Å; F618-P622 HydrophobicContact CE2-CB 3.96Å; F618-P622 HydrophobicContact CZ-CB 4.14Å; F618-P622 VanDerWaalsContact O-CA 3.23Å; F618-P622 WeakPolarHBondContact O-CA 3.32Å; F618-P622 WeakPolarHBondContact O-CB 3.45Å; F618-P622 WeakPolarHBondContact O-CD 3.47Å; F618-P622 WeakPolarHBondContact O-CG 3.47Å; F618-P622 VanDerWaalsContact O-N 3.14Å; F618-V627 HydrophobicContact CB-CG1 3.91Å; F618-I628 HydrophobicContact CD2-CD1 4.47Å; F618-I628 HydrophobicContact CD2-CG1 3.82Å; F618-I628 HydrophobicContact CE2-CD1 4.03Å; F618-I628 HydrophobicContact CE2-CG1 3.67Å; F618-L631 HydrophobicContact CB-CD1 3.65Å; F618-L631 HydrophobicContact CD2-CD1 4.45Å; F618-L631 HydrophobicContact CG-CD1 3.98Å; F618-Y647 HydrophobicContact CD1-CD1 4.25Å; F618-Y647 AromaticContact CD1-CE1 3.71Å; F618-Y647 HydrophobicContact CD1-CE1 3.71Å; F618-Y647 HydrophobicContact CD2-CD1 4.28Å; F618-Y647 HydrophobicContact CD2-CE1 4.49Å; F618-Y647 AromaticContact CE1-CD1 3.82Å; F618-Y647 HydrophobicContact CE1-CD1 3.82Å; F618-Y647 AromaticContact CE1-CE1 3.48Å; F618-Y647 HydrophobicContact CE1-CE1 3.48Å; F618-Y647 VanDerWaalsContact CE1-CE1 3.48Å; F618-Y647 AromaticContact CE2-CD1 3.87Å; F618-Y647 HydrophobicContact CE2-CD1 3.87Å; F618-Y647 HydrophobicContact CE2-CE1 4.31Å; F618-Y647 HydrophobicContact CG-CD1 4.45Å; F618-Y647 HydrophobicContact CG-CE1 4.2Å; F618-Y647 AromaticContact CZ-CD1 3.6Å; F618-Y647 HydrophobicContact CZ-CD1 3.6Å; F618-Y647 AromaticContact CZ-CE1 3.8Å; F618-Y647 HydrophobicContact CZ-CE1 3.8Å
619	K	92.6	Very high	92.3	Very high	119 Å²	119	47.1 Å²	47.1	52%	0.517	22%	0.221	S	C	.	.	H	α-helix	trans	-65.3	-33.2	176.8	170	-173.6	163.8	-158.8	0	112.9	Y615 D616 S617	Y615-K619 WeakPolarHBondContact O-CB 3.21Å; Y615-K619 PolarHBondContact O-N 3.08Å; D616-K619 WeakPolarHBondContact O-CB 3.4Å; D616-K619 PolarHBondContact O-N 2.96Å; D616-K619 IonicContact OD1-NZ 3.12Å; D616-K619 PolarHBondContact OD1-NZ 2.9Å; S617-K619 VanDerWaalsContact C-N 3.27Å; S617-K619 PolarHBondContact O-N 3.33Å
620	Y	90.7	Very high	92.4	Very high	101 Å²	101	44.7 Å²	44.7	40%	0.396	21%	0.208	S	C	.	.	H	α-helix	trans	-87.1	-40.4	176.1	-66.9	-65.7	0	0	0	113.1	T589 L594 D616 S617 F618	T589-Y620 HydrophobicContact CG2-CE1 3.97Å; L594-Y620 HydrophobicContact CD1-CD2 3.61Å; L594-Y620 HydrophobicContact CD1-CE2 3.9Å; D616-Y620 WeakPolarHBondContact O-CD2 3.43Å; D616-Y620 PolarHBondContact O-N 3.44Å; S617-Y620 PolarHBondContact O-N 3.49Å; S617-Y620 VanDerWaalsContact O-N 3.11Å; F618-Y620 VanDerWaalsContact C-N 3.33Å; F618-Y620 PolarHBondContact O-N 3.28Å
621	Y	90.9	Very high	92.4	Very high	101 Å²	101	44.7 Å²	44.7	40%	0.396	21%	0.208	S	C	.	.			trans	-130.6	84.8	176.3	-174.7	-122.7	0	0	0	112	P591 F592 S617 F618 C623 N624	P591-Y621 VanDerWaalsContact CG-CB 3.48Å; P591-Y621 HydrophobicContact CG-CG 4.49Å; F592-Y621 HydrophobicContact CZ-CE1 4.46Å; S617-Y621 PolarHBondContact O-N 3.02Å; F618-Y621 CarbonylContact O-C 3.41Å; Y621-C623 HydrophobicContact CD2-CB 4.28Å; Y621-C623 HydrophobicContact CE1-CB 4.14Å; Y621-C623 HydrophobicContact CE2-CB 3.73Å; Y621-C623 PolarHBondContact O-N 3.18Å; Y621-N624 HydrophobicContact CD1-CB 3.79Å; Y621-N624 HydrophobicContact CE1-CB 4.1Å; Y621-N624 PolarHBondContact O-N 3.38Å
622	P	88.8	Confident	92.3	Very high	28 Å²	28	42.5 Å²	42.5	18%	0.182	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	11.7	-175.9	-15.1	28	0	0	0	115.8	F618 R650	F618-P622 HydrophobicContact CD2-CB 4.32Å; F618-P622 HydrophobicContact CE2-CB 3.96Å; F618-P622 HydrophobicContact CZ-CB 4.14Å; F618-P622 VanDerWaalsContact O-CA 3.23Å; F618-P622 WeakPolarHBondContact O-CA 3.32Å; F618-P622 WeakPolarHBondContact O-CB 3.45Å; F618-P622 WeakPolarHBondContact O-CD 3.47Å; F618-P622 WeakPolarHBondContact O-CG 3.47Å; F618-P622 VanDerWaalsContact O-N 3.14Å; P622-R650 VanDerWaalsContact CB-NH2 3.28Å; P622-R650 PolarHBondContact O-NE 3.42Å
623	C	87.8	Confident	92.2	Very high	34 Å²	34	42.1 Å²	42.1	23%	0.23	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-2.3	-178.5	-53.2	0	0	0	0	112.2	Y621 F625 M654	Y621-C623 HydrophobicContact CD2-CB 4.28Å; Y621-C623 HydrophobicContact CE1-CB 4.14Å; Y621-C623 HydrophobicContact CE2-CB 3.73Å; Y621-C623 PolarHBondContact O-N 3.18Å; C623-F625 PolarHBondContact O-N 3.17Å; C623-M654 HydrophobicContact CB-CE 4.02Å; C623-M654 VanDerWaalsContact SG-CE 3.6Å
624	N	89.7	Confident	92.1	Very high	11 Å²	11	42.8 Å²	42.8	6%	0.059	20%	0.202	C	C	.	.			trans	-73.8	113.5	179.5	-166.2	-32.3	0	0	0	111	Q595 Y621 D626 V627 I628	Q595-N624 PolarHBondContact OE1-ND2 3.08Å; Y621-N624 HydrophobicContact CD1-CB 3.79Å; Y621-N624 HydrophobicContact CE1-CB 4.1Å; Y621-N624 PolarHBondContact O-N 3.38Å; N624-D626 PolarHBondContact OD1-N 3.42Å; N624-D626 VanDerWaalsContact OD1-N 3.17Å; N624-V627 HydrophobicContact CB-CB 4.07Å; N624-V627 HydrophobicContact CB-CG2 3.97Å; N624-V627 VanDerWaalsContact CG-CG2 3.47Å; N624-V627 WeakPolarHBondContact ND2-CG2 3.5Å; N624-V627 PolarHBondContact OD1-N 2.99Å; N624-I628 WeakPolarHBondContact O-CD1 3.45Å; N624-I628 VanDerWaalsContact O-CG1 3.26Å; N624-I628 WeakPolarHBondContact O-CG1 3.41Å; N624-I628 PolarHBondContact O-N 3.42Å; N624-I628 VanDerWaalsContact O-N 3.13Å
625	F	91.4	Very high	92	Very high	57 Å²	57	43.9 Å²	43.9	25%	0.25	21%	0.206	C	C	.	.	H	α-helix	trans	-70.4	-36.2	-176.6	-60.8	-72.1	0	0	0	112.8	C623 I628 E629 A651 M654 Q655 W661	C623-F625 PolarHBondContact O-N 3.17Å; F625-I628 PolarHBondContact O-N 3.45Å; F625-E629 WeakPolarHBondContact O-CB 3.3Å; F625-E629 PolarHBondContact O-N 3.18Å; F625-A651 HydrophobicContact CD1-CB 4.26Å; F625-A651 HydrophobicContact CE1-CB 4.42Å; F625-M654 HydrophobicContact CE1-CB 3.98Å; F625-M654 HydrophobicContact CZ-CB 3.97Å; F625-Q655 HydrophobicContact CE1-CG 3.71Å; F625-Q655 HydrophobicContact CE2-CG 4.41Å; F625-Q655 HydrophobicContact CZ-CG 3.61Å; F625-W661 HydrophobicContact CB-CH2 4.34Å; F625-W661 HydrophobicContact CB-CZ2 4.12Å; F625-W661 AromaticContact CD1-CZ2 3.87Å; F625-W661 HydrophobicContact CD1-CZ2 3.87Å; F625-W661 HydrophobicContact CG-CZ2 4.33Å
626	D	90.4	Very high	91.9	Very high	100 Å²	100	39.2 Å²	39.2	54%	0.535	19%	0.188	S	C	.	.	H	α-helix	trans	-67.1	-43	-178.4	-56.3	-34.7	0	0	0	110.5	N624 E629 W630	N624-D626 PolarHBondContact OD1-N 3.42Å; N624-D626 VanDerWaalsContact OD1-N 3.17Å; D626-E629 PolarHBondContact O-N 3.25Å; D626-W630 PolarHBondContact O-N 2.89Å
627	V	93.7	Very high	91.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-39.1	175.5	179.8	0	0	0	0	111.5	Q595 Y614 F618 N624 L631	Q595-V627 HydrophobicContact CB-CG2 4.18Å; Q595-V627 HydrophobicContact CG-CG2 4.15Å; Y614-V627 HydrophobicContact CD1-CB 4.34Å; Y614-V627 HydrophobicContact CD1-CG1 4.03Å; Y614-V627 HydrophobicContact CD1-CG2 3.98Å; Y614-V627 HydrophobicContact CE1-CG2 4.38Å; Y614-V627 VanDerWaalsContact O-CG1 3.24Å; Y614-V627 WeakPolarHBondContact O-CG1 3.28Å; F618-V627 HydrophobicContact CB-CG1 3.91Å; N624-V627 HydrophobicContact CB-CB 4.07Å; N624-V627 HydrophobicContact CB-CG2 3.97Å; N624-V627 VanDerWaalsContact CG-CG2 3.47Å; N624-V627 WeakPolarHBondContact ND2-CG2 3.5Å; N624-V627 PolarHBondContact OD1-N 2.99Å; V627-L631 HydrophobicContact CG1-CD1 3.96Å; V627-L631 HydrophobicContact CG1-CG 4.41Å; V627-L631 WeakPolarHBondContact O-CB 3.45Å; V627-L631 VanDerWaalsContact O-CG 3.3Å; V627-L631 WeakPolarHBondContact O-CG 3.26Å; V627-L631 PolarHBondContact O-N 3.18Å
628	I	93.1	Very high	91.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-43.6	174.8	-74.8	165.5	0	0	0	111.2	F618 N624 F625 G632 Y647 F648 A651	F618-I628 HydrophobicContact CD2-CD1 4.47Å; F618-I628 HydrophobicContact CD2-CG1 3.82Å; F618-I628 HydrophobicContact CE2-CD1 4.03Å; F618-I628 HydrophobicContact CE2-CG1 3.67Å; N624-I628 WeakPolarHBondContact O-CD1 3.45Å; N624-I628 VanDerWaalsContact O-CG1 3.26Å; N624-I628 WeakPolarHBondContact O-CG1 3.41Å; N624-I628 PolarHBondContact O-N 3.42Å; N624-I628 VanDerWaalsContact O-N 3.13Å; F625-I628 PolarHBondContact O-N 3.45Å; I628-G632 PolarHBondContact O-N 3.08Å; I628-Y647 WeakPolarHBondContact CG2-O 3.41Å; I628-F648 HydrophobicContact CG2-CD1 4.31Å; I628-A651 HydrophobicContact CD1-CB 4.37Å; I628-A651 HydrophobicContact CG2-CB 3.98Å
629	E	92.4	Very high	91.3	Very high	46 Å²	46	49.3 Å²	49.3	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-45.4	177.9	-178.5	159.4	177.4	0	0	111.2	F625 D626 G632 A633 K660 W661	F625-E629 WeakPolarHBondContact O-CB 3.3Å; F625-E629 PolarHBondContact O-N 3.18Å; D626-E629 PolarHBondContact O-N 3.25Å; E629-G632 PolarHBondContact O-N 2.87Å; E629-A633 WeakPolarHBondContact O-CB 3.46Å; E629-A633 PolarHBondContact O-N 3.15Å; E629-K660 IonicContact OE1-NZ 2.73Å; E629-K660 PolarHBondContact OE1-NZ 2.86Å; E629-K660 IonicContact OE2-NZ 3.71Å; E629-K660 PolarHBondContact OE2-NZ 2.82Å; E629-W661 HydrophobicContact CB-CH2 4.32Å; E629-W661 HydrophobicContact CB-CZ3 4.34Å
630	W	93.7	Very high	91.1	Very high	23 Å²	23	49.2 Å²	49.2	9%	0.087	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-50.6	176.4	-166.5	93.8	0	0	0	112.8	E602 A610 F611 Y614 D626 G632 A633 Y634	E602-W630 PolarHBondContact OE1-NE1 2.82Å; E602-W630 PolarHBondContact OE2-NE1 2.97Å; A610-W630 HydrophobicContact CB-CH2 3.88Å; A610-W630 HydrophobicContact CB-CZ2 3.68Å; F611-W630 HydrophobicContact CB-CH2 3.88Å; F611-W630 HydrophobicContact CB-CZ3 3.9Å; F611-W630 HydrophobicContact CD2-CZ3 4.16Å; Y614-W630 AromaticContact CD2-CD2 3.26Å; Y614-W630 HydrophobicContact CD2-CD2 3.26Å; Y614-W630 AromaticContact CD2-CE2 3.62Å; Y614-W630 AromaticContact CD2-CE3 3.26Å; Y614-W630 HydrophobicContact CD2-CE3 3.26Å; Y614-W630 AromaticContact CD2-CG 3.85Å; Y614-W630 HydrophobicContact CD2-CG 3.85Å; Y614-W630 AromaticContact CD2-CH2 3.96Å; Y614-W630 HydrophobicContact CD2-CH2 3.96Å; Y614-W630 AromaticContact CD2-CZ2 3.94Å; Y614-W630 HydrophobicContact CD2-CZ2 3.94Å; Y614-W630 AromaticContact CD2-CZ3 3.64Å; Y614-W630 HydrophobicContact CD2-CZ3 3.64Å; Y614-W630 HydrophobicContact CE1-CG 4.48Å; Y614-W630 HydrophobicContact CE2-CB 4.41Å; Y614-W630 AromaticContact CE2-CD1 3.7Å; Y614-W630 AromaticContact CE2-CD2 3.35Å; Y614-W630 HydrophobicContact CE2-CD2 3.35Å; Y614-W630 AromaticContact CE2-CE2 3.39Å; Y614-W630 AromaticContact CE2-CE3 3.89Å; Y614-W630 HydrophobicContact CE2-CE3 3.89Å; Y614-W630 AromaticContact CE2-CG 3.57Å; Y614-W630 HydrophobicContact CE2-CG 3.57Å; Y614-W630 HydrophobicContact CE2-CH2 4.44Å; Y614-W630 AromaticContact CE2-CZ2 3.96Å; Y614-W630 HydrophobicContact CE2-CZ2 3.96Å; Y614-W630 HydrophobicContact CE2-CZ3 4.41Å; Y614-W630 AromaticContact CE2-NE1 3.6Å; Y614-W630 HydrophobicContact CG-CD2 4.04Å; Y614-W630 AromaticContact CG-CE3 3.8Å; Y614-W630 HydrophobicContact CG-CE3 3.8Å; Y614-W630 HydrophobicContact CG-CG 4.41Å; Y614-W630 HydrophobicContact CG-CZ3 4.35Å; Y614-W630 AromaticContact CZ-CD1 3.96Å; Y614-W630 AromaticContact CZ-CG 3.9Å; D626-W630 PolarHBondContact O-N 2.89Å; W630-G632 VanDerWaalsContact C-N 3.29Å; W630-G632 PolarHBondContact O-N 3.33Å; W630-A633 PolarHBondContact O-N 3.09Å; W630-Y634 AromaticContact CH2-CD2 3.6Å; W630-Y634 HydrophobicContact CH2-CD2 3.6Å; W630-Y634 HydrophobicContact CH2-CE2 4.28Å; W630-Y634 HydrophobicContact CH2-CG 4.02Å; W630-Y634 HydrophobicContact CZ2-CD2 4.35Å; W630-Y634 AromaticContact CZ3-CD2 3.96Å; W630-Y634 HydrophobicContact CZ3-CD2 3.96Å; W630-Y634 AromaticContact CZ3-CG 3.88Å; W630-Y634 HydrophobicContact CZ3-CG 3.88Å; W630-Y634 WeakPolarHBondContact O-CB 3.24Å; W630-Y634 PolarHBondContact O-N 3.43Å
631	L	93.7	Very high	91.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-39.5	178.9	-74	172.2	0	0	0	111.7	F611 F618 V627 Y635 Y647	F611-L631 HydrophobicContact CD2-CD2 3.82Å; F611-L631 HydrophobicContact CE2-CD2 3.8Å; F618-L631 HydrophobicContact CB-CD1 3.65Å; F618-L631 HydrophobicContact CD2-CD1 4.45Å; F618-L631 HydrophobicContact CG-CD1 3.98Å; V627-L631 HydrophobicContact CG1-CD1 3.96Å; V627-L631 HydrophobicContact CG1-CG 4.41Å; V627-L631 WeakPolarHBondContact O-CB 3.45Å; V627-L631 VanDerWaalsContact O-CG 3.3Å; V627-L631 WeakPolarHBondContact O-CG 3.26Å; V627-L631 PolarHBondContact O-N 3.18Å; L631-Y635 WeakPolarHBondContact O-CD2 3.42Å; L631-Y635 PolarHBondContact O-N 2.84Å; L631-Y647 HydrophobicContact CB-CD1 4.47Å; L631-Y647 HydrophobicContact CD1-CD1 4.26Å; L631-Y647 HydrophobicContact CD1-CE1 3.9Å
632	G	92.3	Very high	91	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-46.8	175.3	0	0	0	0	0	112.6	I628 E629 W630 Y635 I636 F648	I628-G632 PolarHBondContact O-N 3.08Å; E629-G632 PolarHBondContact O-N 2.87Å; W630-G632 VanDerWaalsContact C-N 3.29Å; W630-G632 PolarHBondContact O-N 3.33Å; G632-Y635 PolarHBondContact O-N 3.43Å; G632-I636 VanDerWaalsContact O-CG1 3.3Å; G632-I636 WeakPolarHBondContact O-CG1 3.5Å; G632-I636 PolarHBondContact O-N 2.85Å; G632-F648 VanDerWaalsContact CA-CZ 3.42Å
633	A	91.6	Very high	91.1	Very high	45 Å²	45	50.8 Å²	50.8	37%	0.372	25%	0.25	S	C	.	.	H	α-helix	trans	-61	-45.1	175.2	0	0	0	0	0	112	E629 W630 Y635 I636 E637	E629-A633 WeakPolarHBondContact O-CB 3.46Å; E629-A633 PolarHBondContact O-N 3.15Å; W630-A633 PolarHBondContact O-N 3.09Å; A633-Y635 VanDerWaalsContact C-N 3.34Å; A633-Y635 PolarHBondContact O-N 2.97Å; A633-I636 WeakPolarHBondContact O-CB 3.23Å; A633-I636 PolarHBondContact O-N 3.06Å; A633-I636 VanDerWaalsContact O-N 3.09Å; A633-E637 PolarHBondContact O-N 2.94Å
634	Y	92.9	Very high	91.3	Very high	52 Å²	52	49.2 Å²	49.2	20%	0.204	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-42.4	176.3	177.2	-90.4	0	0	0	112.6	K607 F611 W630 S638	K607-Y634 HydrophobicContact CB-CE2 4.29Å; F611-Y634 HydrophobicContact CB-CD2 4.45Å; F611-Y634 HydrophobicContact CB-CE1 4.21Å; F611-Y634 HydrophobicContact CB-CE2 4.03Å; F611-Y634 AromaticContact CD2-CD1 3.36Å; F611-Y634 HydrophobicContact CD2-CD1 3.36Å; F611-Y634 AromaticContact CD2-CE1 3.27Å; F611-Y634 HydrophobicContact CD2-CE1 3.27Å; F611-Y634 HydrophobicContact CD2-CE2 4.47Å; F611-Y634 HydrophobicContact CD2-CG 4.03Å; F611-Y634 AromaticContact CD2-CZ 3.88Å; F611-Y634 AromaticContact CE2-CD1 3.84Å; F611-Y634 HydrophobicContact CE2-CD1 3.84Å; F611-Y634 AromaticContact CE2-CE1 3.75Å; F611-Y634 HydrophobicContact CE2-CE1 3.75Å; F611-Y634 HydrophobicContact CG-CD1 4.19Å; F611-Y634 AromaticContact CG-CE1 3.72Å; F611-Y634 HydrophobicContact CG-CE1 3.72Å; F611-Y634 HydrophobicContact CG-CE2 4.44Å; F611-Y634 AromaticContact CG-CZ 3.87Å; W630-Y634 AromaticContact CH2-CD2 3.6Å; W630-Y634 HydrophobicContact CH2-CD2 3.6Å; W630-Y634 HydrophobicContact CH2-CE2 4.28Å; W630-Y634 HydrophobicContact CH2-CG 4.02Å; W630-Y634 HydrophobicContact CZ2-CD2 4.35Å; W630-Y634 AromaticContact CZ3-CD2 3.96Å; W630-Y634 HydrophobicContact CZ3-CD2 3.96Å; W630-Y634 AromaticContact CZ3-CG 3.88Å; W630-Y634 HydrophobicContact CZ3-CG 3.88Å; W630-Y634 WeakPolarHBondContact O-CB 3.24Å; W630-Y634 PolarHBondContact O-N 3.43Å; Y634-S638 VanDerWaalsContact O-CB 3.25Å; Y634-S638 WeakPolarHBondContact O-CB 3.46Å; Y634-S638 PolarHBondContact O-N 3.07Å; Y634-S638 PolarHBondContact O-OG 2.94Å
635	Y	93.2	Very high	91.4	Very high	25 Å²	25	49.5 Å²	49.5	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-70.8	-30	175.7	-79.4	-58	0	0	0	113.2	F611 L631 G632 A633 S638 Q639 F640 K643 Y647	F611-Y635 HydrophobicContact CE2-CE1 4.41Å; F611-Y635 HydrophobicContact CE2-CE2 4.07Å; F611-Y635 AromaticContact CE2-CZ 3.76Å; F611-Y635 WeakPolarHBondContact CZ-OH 3.48Å; L631-Y635 WeakPolarHBondContact O-CD2 3.42Å; L631-Y635 PolarHBondContact O-N 2.84Å; G632-Y635 PolarHBondContact O-N 3.43Å; A633-Y635 VanDerWaalsContact C-N 3.34Å; A633-Y635 PolarHBondContact O-N 2.97Å; Y635-S638 CarbonylContact O-C 3.42Å; Y635-Q639 PolarHBondContact O-N 3.12Å; Y635-F640 HydrophobicContact CD1-CB 4.01Å; Y635-F640 CarbonylContact O-C 3.59Å; Y635-F640 PolarHBondContact O-N 3.33Å; Y635-K643 HydrophobicContact CD1-CB 4.08Å; Y635-K643 HydrophobicContact CD1-CD 4.19Å; Y635-K643 HydrophobicContact CD2-CB 4.29Å; Y635-K643 HydrophobicContact CE1-CB 4.27Å; Y635-K643 HydrophobicContact CE1-CD 3.8Å; Y635-K643 HydrophobicContact CE2-CB 4.48Å; Y635-K643 HydrophobicContact CG-CB 4.09Å; Y635-Y647 HydrophobicContact CD2-CD2 4.11Å; Y635-Y647 AromaticContact CD2-CE2 3.65Å; Y635-Y647 HydrophobicContact CD2-CE2 3.65Å; Y635-Y647 HydrophobicContact CE2-CD2 4.19Å; Y635-Y647 AromaticContact CE2-CE2 3.29Å; Y635-Y647 HydrophobicContact CE2-CE2 3.29Å; Y635-Y647 AromaticContact CE2-CZ 3.76Å
636	I	91.1	Very high	91.4	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-47.8	173	-70.9	167.9	0	0	0	110.9	G632 A633 S638 Q639 A644 F648 R671 F834	G632-I636 VanDerWaalsContact O-CG1 3.3Å; G632-I636 WeakPolarHBondContact O-CG1 3.5Å; G632-I636 PolarHBondContact O-N 2.85Å; A633-I636 WeakPolarHBondContact O-CB 3.23Å; A633-I636 PolarHBondContact O-N 3.06Å; A633-I636 VanDerWaalsContact O-N 3.09Å; I636-S638 VanDerWaalsContact C-N 3.27Å; I636-S638 PolarHBondContact O-N 3.03Å; I636-Q639 PolarHBondContact O-N 3.42Å; I636-A644 HydrophobicContact CG1-CB 4.05Å; I636-F648 HydrophobicContact CD1-CE2 3.91Å; I636-F648 HydrophobicContact CD1-CZ 4.15Å; I636-R671 VanDerWaalsContact CG2-CZ 3.44Å; I636-R671 PolarHBondContact O-NH2 2.98Å; I636-F834 HydrophobicContact CD1-CZ 4.24Å; I636-F834 HydrophobicContact CG2-CZ 4.44Å
637	E	90.1	Very high	91.5	Very high	111 Å²	111	46 Å²	46	52%	0.519	23%	0.231	S	C	.	.	H	α-helix	trans	-57.7	-42.4	172.9	-76.8	-169.4	129.6	0	0	111.3	K607 A633 Q639	K607-E637 IonicContact NZ-OE1 3.25Å; K607-E637 PolarHBondContact NZ-OE1 3.09Å; K607-E637 IonicContact NZ-OE2 3.12Å; K607-E637 PolarHBondContact NZ-OE2 3.41Å; A633-E637 PolarHBondContact O-N 2.94Å; E637-Q639 PolarHBondContact O-N 3.05Å; E637-Q639 VanDerWaalsContact O-N 3.13Å
638	S	89	Confident	91.5	Very high	43 Å²	43	46 Å²	46	30%	0.301	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	6.4	177.9	-55.5	0	0	0	0	114.2	Y634 Y635 I636 F640	Y634-S638 VanDerWaalsContact O-CB 3.25Å; Y634-S638 WeakPolarHBondContact O-CB 3.46Å; Y634-S638 PolarHBondContact O-N 3.07Å; Y634-S638 PolarHBondContact O-OG 2.94Å; Y635-S638 CarbonylContact O-C 3.42Å; I636-S638 VanDerWaalsContact C-N 3.27Å; I636-S638 PolarHBondContact O-N 3.03Å; S638-F640 WeakPolarHBondContact O-CD2 3.41Å; S638-F640 PolarHBondContact O-N 2.84Å; S638-F640 VanDerWaalsContact O-N 3.11Å
639	Q	87.2	Confident	91.5	Very high	131 Å²	131	50.6 Å²	50.6	61%	0.612	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	12.8	-177.7	-55.1	-69.7	9.8	0	0	115.9	Y635 I636 E637 C641	Y635-Q639 PolarHBondContact O-N 3.12Å; I636-Q639 PolarHBondContact O-N 3.42Å; E637-Q639 PolarHBondContact O-N 3.05Å; E637-Q639 VanDerWaalsContact O-N 3.13Å; Q639-C641 VanDerWaalsContact C-N 3.33Å; Q639-C641 PolarHBondContact O-N 3.48Å
640	F	90.3	Very high	91.4	Very high	118 Å²	118	53.5 Å²	53.5	52%	0.518	26%	0.261	S	S	.	.			trans	-93.4	55.8	177.1	-66.4	-66.2	0	0	0	111.9	Y635 S638 E642 K643 A644	Y635-F640 HydrophobicContact CD1-CB 4.01Å; Y635-F640 CarbonylContact O-C 3.59Å; Y635-F640 PolarHBondContact O-N 3.33Å; S638-F640 WeakPolarHBondContact O-CD2 3.41Å; S638-F640 PolarHBondContact O-N 2.84Å; S638-F640 VanDerWaalsContact O-N 3.11Å; F640-E642 PolarHBondContact O-N 3.1Å; F640-E642 VanDerWaalsContact O-N 3.15Å; F640-K643 HydrophobicContact CB-CD 4.35Å; F640-K643 PolarHBondContact O-N 3.02Å; F640-A644 PolarHBondContact O-N 3.13Å
641	C	90.4	Very high	91.3	Very high	4 Å²	4	52.4 Å²	52.4	3%	0.027	26%	0.257	C	S	.	.	H	α-helix	trans	-57	-32.3	-173	-68	0	0	0	0	114.1	Q639 K643 A644 I645 C668 R671 S672	Q639-C641 VanDerWaalsContact C-N 3.33Å; Q639-C641 PolarHBondContact O-N 3.48Å; C641-K643 VanDerWaalsContact C-N 3.28Å; C641-K643 PolarHBondContact O-N 3.47Å; C641-A644 WeakPolarHBondContact O-CB 3.48Å; C641-A644 PolarHBondContact O-N 3.01Å; C641-I645 WeakPolarHBondContact O-CG1 3.44Å; C641-I645 PolarHBondContact O-N 3.26Å; C641-C668 HydrophobicContact CB-CB 4.26Å; C641-R671 VanDerWaalsContact SG-CB 3.55Å; C641-S672 VanDerWaalsContact CB-OG 3.31Å; C641-S672 WeakPolarHBondContact CB-OG 3.26Å
642	E	87.7	Confident	91.1	Very high	149 Å²	149	53.5 Å²	53.5	70%	0.696	27%	0.265	S	S	*	.	H	α-helix	trans	-59.3	-36.2	175.6	-61.7	-175.4	155.7	0	0	113.3	F640	F640-E642 PolarHBondContact O-N 3.1Å; F640-E642 VanDerWaalsContact O-N 3.15Å
643	K	90.4	Very high	91	Very high	110 Å²	110	60.1 Å²	60.1	48%	0.478	30%	0.299	S	S	.	.	H	α-helix	trans	-73.9	-37.6	177.8	-68.7	179	-177.8	170.3	0	111.2	Y635 F640 C641 I645 A646 Y647	Y635-K643 HydrophobicContact CD1-CB 4.08Å; Y635-K643 HydrophobicContact CD1-CD 4.19Å; Y635-K643 HydrophobicContact CD2-CB 4.29Å; Y635-K643 HydrophobicContact CE1-CB 4.27Å; Y635-K643 HydrophobicContact CE1-CD 3.8Å; Y635-K643 HydrophobicContact CE2-CB 4.48Å; Y635-K643 HydrophobicContact CG-CB 4.09Å; F640-K643 HydrophobicContact CB-CD 4.35Å; F640-K643 PolarHBondContact O-N 3.02Å; C641-K643 VanDerWaalsContact C-N 3.28Å; C641-K643 PolarHBondContact O-N 3.47Å; K643-I645 VanDerWaalsContact C-N 3.3Å; K643-I645 PolarHBondContact O-N 3.49Å; K643-A646 PolarHBondContact O-N 3.36Å; K643-Y647 WeakPolarHBondContact O-CD2 3.45Å
644	A	93.1	Very high	90.9	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-39.9	177.7	0	0	0	0	0	112	I636 F640 C641 A646 Y647 F648	I636-A644 HydrophobicContact CG1-CB 4.05Å; F640-A644 PolarHBondContact O-N 3.13Å; C641-A644 WeakPolarHBondContact O-CB 3.48Å; C641-A644 PolarHBondContact O-N 3.01Å; A644-A646 VanDerWaalsContact C-N 3.3Å; A644-A646 PolarHBondContact O-N 3.19Å; A644-Y647 PolarHBondContact O-N 3.49Å; A644-Y647 VanDerWaalsContact O-N 3.1Å; A644-F648 HydrophobicContact CB-CD2 4.36Å; A644-F648 HydrophobicContact CB-CE2 3.88Å; A644-F648 VanDerWaalsContact O-CD2 3.24Å; A644-F648 WeakPolarHBondContact O-CD2 3.5Å; A644-F648 PolarHBondContact O-N 2.98Å; A644-F648 VanDerWaalsContact O-N 3.14Å
645	I	92.1	Very high	90.7	Very high	17 Å²	17	63.4 Å²	63.4	9%	0.087	31%	0.31	C	S	.	.	H	α-helix	trans	-52.1	-47	176.8	-68.7	168	0	0	0	111.3	C641 K643 Y647 F648 E649 I665 C668	C641-I645 WeakPolarHBondContact O-CG1 3.44Å; C641-I645 PolarHBondContact O-N 3.26Å; K643-I645 VanDerWaalsContact C-N 3.3Å; K643-I645 PolarHBondContact O-N 3.49Å; I645-Y647 VanDerWaalsContact C-N 3.27Å; I645-Y647 PolarHBondContact O-N 3.29Å; I645-F648 PolarHBondContact O-N 3.28Å; I645-F648 VanDerWaalsContact O-N 3.15Å; I645-E649 HydrophobicContact CG2-CG 3.89Å; I645-E649 WeakPolarHBondContact O-CB 3.44Å; I645-E649 WeakPolarHBondContact O-CG 3.41Å; I645-E649 PolarHBondContact O-N 2.87Å; I645-I665 HydrophobicContact CG2-CG2 4.18Å; I645-C668 HydrophobicContact CD1-CB 3.87Å; I645-C668 HydrophobicContact CG1-CB 3.41Å; I645-C668 VanDerWaalsContact CG1-CB 3.41Å
646	A	91.9	Very high	90.3	Very high	59 Å²	59	64.9 Å²	64.9	49%	0.488	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-31.2	-178	0	0	0	0	0	113.9	K643 A644 R650	K643-A646 PolarHBondContact O-N 3.36Å; A644-A646 VanDerWaalsContact C-N 3.3Å; A644-A646 PolarHBondContact O-N 3.19Å; A646-R650 PolarHBondContact O-N 3.29Å
647	Y	92.3	Very high	90	Very high	26 Å²	26	71 Å²	71	10%	0.102	36%	0.355	C	S	.	.	H	α-helix	trans	-75.6	-42.9	174.8	-63.1	-86.4	0	0	0	111.3	F618 I628 L631 Y635 K643 A644 I645 R650 A651	F618-Y647 HydrophobicContact CD1-CD1 4.25Å; F618-Y647 AromaticContact CD1-CE1 3.71Å; F618-Y647 HydrophobicContact CD1-CE1 3.71Å; F618-Y647 HydrophobicContact CD2-CD1 4.28Å; F618-Y647 HydrophobicContact CD2-CE1 4.49Å; F618-Y647 AromaticContact CE1-CD1 3.82Å; F618-Y647 HydrophobicContact CE1-CD1 3.82Å; F618-Y647 AromaticContact CE1-CE1 3.48Å; F618-Y647 HydrophobicContact CE1-CE1 3.48Å; F618-Y647 VanDerWaalsContact CE1-CE1 3.48Å; F618-Y647 AromaticContact CE2-CD1 3.87Å; F618-Y647 HydrophobicContact CE2-CD1 3.87Å; F618-Y647 HydrophobicContact CE2-CE1 4.31Å; F618-Y647 HydrophobicContact CG-CD1 4.45Å; F618-Y647 HydrophobicContact CG-CE1 4.2Å; F618-Y647 AromaticContact CZ-CD1 3.6Å; F618-Y647 HydrophobicContact CZ-CD1 3.6Å; F618-Y647 AromaticContact CZ-CE1 3.8Å; F618-Y647 HydrophobicContact CZ-CE1 3.8Å; I628-Y647 WeakPolarHBondContact CG2-O 3.41Å; L631-Y647 HydrophobicContact CB-CD1 4.47Å; L631-Y647 HydrophobicContact CD1-CD1 4.26Å; L631-Y647 HydrophobicContact CD1-CE1 3.9Å; Y635-Y647 HydrophobicContact CD2-CD2 4.11Å; Y635-Y647 AromaticContact CD2-CE2 3.65Å; Y635-Y647 HydrophobicContact CD2-CE2 3.65Å; Y635-Y647 HydrophobicContact CE2-CD2 4.19Å; Y635-Y647 AromaticContact CE2-CE2 3.29Å; Y635-Y647 HydrophobicContact CE2-CE2 3.29Å; Y635-Y647 AromaticContact CE2-CZ 3.76Å; K643-Y647 WeakPolarHBondContact O-CD2 3.45Å; A644-Y647 PolarHBondContact O-N 3.49Å; A644-Y647 VanDerWaalsContact O-N 3.1Å; I645-Y647 VanDerWaalsContact C-N 3.27Å; I645-Y647 PolarHBondContact O-N 3.29Å; Y647-R650 WeakPolarHBondContact O-CB 3.49Å; Y647-R650 PolarHBondContact O-N 2.84Å; Y647-A651 PolarHBondContact O-N 3.29Å; Y647-A651 VanDerWaalsContact O-N 3.09Å
648	F	93.6	Very high	89.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-71	-34.8	178.1	-59.5	-47.1	0	0	0	113.4	I628 G632 I636 A644 I645 R650 A651 S652 W661 M664 I665	I628-F648 HydrophobicContact CG2-CD1 4.31Å; G632-F648 VanDerWaalsContact CA-CZ 3.42Å; I636-F648 HydrophobicContact CD1-CE2 3.91Å; I636-F648 HydrophobicContact CD1-CZ 4.15Å; A644-F648 HydrophobicContact CB-CD2 4.36Å; A644-F648 HydrophobicContact CB-CE2 3.88Å; A644-F648 VanDerWaalsContact O-CD2 3.24Å; A644-F648 WeakPolarHBondContact O-CD2 3.5Å; A644-F648 PolarHBondContact O-N 2.98Å; A644-F648 VanDerWaalsContact O-N 3.14Å; I645-F648 PolarHBondContact O-N 3.28Å; I645-F648 VanDerWaalsContact O-N 3.15Å; F648-R650 VanDerWaalsContact C-N 3.27Å; F648-R650 PolarHBondContact O-N 3.01Å; F648-A651 PolarHBondContact O-N 3.04Å; F648-S652 WeakPolarHBondContact O-CB 3.22Å; F648-S652 PolarHBondContact O-N 3Å; F648-W661 HydrophobicContact CD1-CE3 4.03Å; F648-W661 HydrophobicContact CD1-CZ3 4.32Å; F648-M664 HydrophobicContact CD1-CB 4.21Å; F648-M664 HydrophobicContact CD1-CE 4.31Å; F648-M664 HydrophobicContact CD1-SD 4Å; F648-M664 HydrophobicContact CD2-CB 3.83Å; F648-M664 HydrophobicContact CE1-CB 4.35Å; F648-M664 HydrophobicContact CE1-CE 3.41Å; F648-M664 VanDerWaalsContact CE1-CE 3.41Å; F648-M664 HydrophobicContact CE1-SD 3.68Å; F648-M664 HydrophobicContact CE2-CB 3.98Å; F648-M664 HydrophobicContact CE2-CE 4.28Å; F648-M664 HydrophobicContact CG-CB 3.95Å; F648-M664 HydrophobicContact CZ-CB 4.22Å; F648-M664 HydrophobicContact CZ-CE 3.38Å; F648-M664 HydrophobicContact CZ-SD 4.09Å; F648-I665 HydrophobicContact CB-CD1 4.25Å; F648-I665 HydrophobicContact CB-CG1 3.62Å
649	E	91.6	Very high	89.9	Confident	95 Å²	95	70 Å²	70	44%	0.444	35%	0.347	S	S	.	.	H	α-helix	trans	-56.4	-45.8	170.5	-79.9	-177.4	159.9	0	0	110	I645 A651 S652 L653 I665	I645-E649 HydrophobicContact CG2-CG 3.89Å; I645-E649 WeakPolarHBondContact O-CB 3.44Å; I645-E649 WeakPolarHBondContact O-CG 3.41Å; I645-E649 PolarHBondContact O-N 2.87Å; E649-A651 PolarHBondContact O-N 2.85Å; E649-S652 PolarHBondContact O-N 3.11Å; E649-S652 VanDerWaalsContact O-N 3.15Å; E649-S652 PolarHBondContact O-OG 3.39Å; E649-L653 WeakPolarHBondContact O-CG 3.28Å; E649-L653 PolarHBondContact O-N 3.36Å; E649-I665 HydrophobicContact CB-CD1 4.42Å; E649-I665 HydrophobicContact CG-CD1 3.81Å; E649-I665 HydrophobicContact CG-CG1 4.34Å
650	R	90.1	Very high	90	Very high	108 Å²	108	67.2 Å²	67.2	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-58.9	-47.9	175	-164.3	176.5	-167.3	137.4	8.2	112	P622 A646 Y647 F648 S652 L653 M654	P622-R650 VanDerWaalsContact CB-NH2 3.28Å; P622-R650 PolarHBondContact O-NE 3.42Å; A646-R650 PolarHBondContact O-N 3.29Å; Y647-R650 WeakPolarHBondContact O-CB 3.49Å; Y647-R650 PolarHBondContact O-N 2.84Å; F648-R650 VanDerWaalsContact C-N 3.27Å; F648-R650 PolarHBondContact O-N 3.01Å; R650-S652 VanDerWaalsContact C-N 3.3Å; R650-S652 PolarHBondContact O-N 2.97Å; R650-L653 PolarHBondContact O-N 2.94Å; R650-M654 WeakPolarHBondContact O-CG 3.49Å; R650-M654 PolarHBondContact O-N 3.17Å
651	A	92	Very high	90.1	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-37.4	174.9	0	0	0	0	0	112.8	F625 I628 Y647 F648 E649 L653 M654 Q655 W661	F625-A651 HydrophobicContact CD1-CB 4.26Å; F625-A651 HydrophobicContact CE1-CB 4.42Å; I628-A651 HydrophobicContact CD1-CB 4.37Å; I628-A651 HydrophobicContact CG2-CB 3.98Å; Y647-A651 PolarHBondContact O-N 3.29Å; Y647-A651 VanDerWaalsContact O-N 3.09Å; F648-A651 PolarHBondContact O-N 3.04Å; E649-A651 PolarHBondContact O-N 2.85Å; A651-L653 VanDerWaalsContact C-N 3.33Å; A651-L653 PolarHBondContact O-N 3.33Å; A651-M654 PolarHBondContact O-N 3.04Å; A651-Q655 PolarHBondContact O-N 3.4Å; A651-W661 HydrophobicContact CB-CB 4.4Å; A651-W661 HydrophobicContact CB-CD2 3.58Å; A651-W661 HydrophobicContact CB-CE3 3.87Å; A651-W661 HydrophobicContact CB-CG 3.81Å; A651-W661 HydrophobicContact CB-CZ2 4.42Å; A651-W661 HydrophobicContact CB-CZ3 4.4Å
652	S	90.6	Very high	90.1	Very high	23 Å²	23	62.8 Å²	62.8	16%	0.161	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-30.9	179	84.1	0	0	0	0	113.5	F648 E649 R650 Q655 P656	F648-S652 WeakPolarHBondContact O-CB 3.22Å; F648-S652 PolarHBondContact O-N 3Å; E649-S652 PolarHBondContact O-N 3.11Å; E649-S652 VanDerWaalsContact O-N 3.15Å; E649-S652 PolarHBondContact O-OG 3.39Å; R650-S652 VanDerWaalsContact C-N 3.3Å; R650-S652 PolarHBondContact O-N 2.97Å; S652-Q655 CarbonylContact O-C 3.57Å; S652-P656 VanDerWaalsContact O-CA 3.31Å; S652-P656 WeakPolarHBondContact O-CA 3.45Å
653	L	90.6	Very high	90.2	Very high	138 Å²	138	56.4 Å²	56.4	72%	0.723	28%	0.283	S	S	*	.	H	α-helix	trans	-70.7	-36.4	172.6	-69.7	170.8	0	0	0	111.5	E649 R650 A651	E649-L653 WeakPolarHBondContact O-CG 3.28Å; E649-L653 PolarHBondContact O-N 3.36Å; R650-L653 PolarHBondContact O-N 2.94Å; A651-L653 VanDerWaalsContact C-N 3.33Å; A651-L653 PolarHBondContact O-N 3.33Å
654	M	88.5	Confident	90.2	Very high	101 Å²	101	52.7 Å²	52.7	50%	0.498	27%	0.268	S	S	.	.	H	α-helix	trans	-77.9	-35.5	179.4	-58.1	-63.7	-72.1	0	0	112.5	C623 F625 R650 A651 P656	C623-M654 HydrophobicContact CB-CE 4.02Å; C623-M654 VanDerWaalsContact SG-CE 3.6Å; F625-M654 HydrophobicContact CE1-CB 3.98Å; F625-M654 HydrophobicContact CZ-CB 3.97Å; R650-M654 WeakPolarHBondContact O-CG 3.49Å; R650-M654 PolarHBondContact O-N 3.17Å; A651-M654 PolarHBondContact O-N 3.04Å; M654-P656 VanDerWaalsContact C-CD 3.49Å; M654-P656 WeakPolarHBondContact O-CD 3.49Å
655	Q	87.9	Confident	90.1	Very high	66 Å²	66	53.5 Å²	53.5	31%	0.308	27%	0.272	S	S	.	.			trans	-121.3	71.7	176.6	-70.8	-176.5	-3.2	0	0	111.5	F625 A651 S652 N657 Q658	F625-Q655 HydrophobicContact CE1-CG 3.71Å; F625-Q655 HydrophobicContact CE2-CG 4.41Å; F625-Q655 HydrophobicContact CZ-CG 3.61Å; A651-Q655 PolarHBondContact O-N 3.4Å; S652-Q655 CarbonylContact O-C 3.57Å; Q655-N657 PolarHBondContact O-N 3.49Å; Q655-N657 VanDerWaalsContact O-N 3.1Å; Q655-Q658 HydrophobicContact CB-CB 3.97Å; Q655-Q658 PolarHBondContact O-N 2.94Å
656	P	86.3	Confident	90.1	Very high	55 Å²	55	52.7 Å²	52.7	36%	0.357	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.8	-174.7	27.5	-36.7	0	0	0	114.3	S652 M654 R688	S652-P656 VanDerWaalsContact O-CA 3.31Å; S652-P656 WeakPolarHBondContact O-CA 3.45Å; M654-P656 VanDerWaalsContact C-CD 3.49Å; M654-P656 WeakPolarHBondContact O-CD 3.49Å; P656-R688 PolarHBondContact O-NH2 3.02Å
657	N	84.7	Confident	89.9	Confident	136 Å²	136	50.3 Å²	50.3	73%	0.727	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-17.3	177.3	-66.6	-15.3	0	0	0	112.9	Q655	Q655-N657 PolarHBondContact O-N 3.49Å; Q655-N657 VanDerWaalsContact O-N 3.1Å
658	Q	87.9	Confident	89.9	Confident	96 Å²	96	49.1 Å²	49.1	45%	0.449	24%	0.243	S	C	.	.			trans	-91.2	114.1	-174.3	-172.8	61.7	5.2	0	0	110.9	Q655 K660	Q655-Q658 HydrophobicContact CB-CB 3.97Å; Q655-Q658 PolarHBondContact O-N 2.94Å; Q658-K660 VanDerWaalsContact C-N 3.28Å; Q658-K660 HydrophobicContact CG-CB 4.03Å; Q658-K660 PolarHBondContact O-N 2.71Å
659	I	88.9	Confident	89.8	Confident	38 Å²	38	50.4 Å²	50.4	20%	0.195	25%	0.249	C	C	.	.	H	α-helix	trans	-57.4	-37.2	179.1	-85.6	175.9	0	0	0	113.2	W661 Q662 L663 F689 N692	I659-W661 VanDerWaalsContact C-N 3.32Å; I659-W661 PolarHBondContact O-N 3.12Å; I659-Q662 PolarHBondContact O-N 3.37Å; I659-L663 HydrophobicContact CG2-CD1 3.45Å; I659-L663 VanDerWaalsContact CG2-CD1 3.45Å; I659-L663 HydrophobicContact CG2-CG 3.74Å; I659-L663 PolarHBondContact O-N 3.08Å; I659-L663 VanDerWaalsContact O-N 3.09Å; I659-F689 HydrophobicContact CD1-CB 3.5Å; I659-F689 HydrophobicContact CD1-CD1 3.66Å; I659-F689 HydrophobicContact CD1-CD2 3.94Å; I659-F689 HydrophobicContact CD1-CE1 4.3Å; I659-F689 HydrophobicContact CD1-CG 3.44Å; I659-F689 VanDerWaalsContact CD1-CG 3.44Å; I659-F689 HydrophobicContact CG1-CB 4.05Å; I659-F689 HydrophobicContact CG1-CD1 3.81Å; I659-F689 HydrophobicContact CG1-CD2 3.46Å; I659-F689 VanDerWaalsContact CG1-CD2 3.46Å; I659-F689 HydrophobicContact CG1-CE1 4.02Å; I659-F689 HydrophobicContact CG1-CE2 3.69Å; I659-F689 HydrophobicContact CG1-CG 3.51Å; I659-F689 HydrophobicContact CG1-CZ 3.96Å; I659-N692 HydrophobicContact CD1-CB 4.03Å; I659-N692 VanDerWaalsContact CG2-ND2 3.27Å; I659-N692 WeakPolarHBondContact CG2-ND2 3.29Å
660	K	89.5	Confident	89.7	Confident	72 Å²	72	48.8 Å²	48.8	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-45.8	-53.8	-170.7	-175.5	-177.8	-178.6	178.1	0	112	E629 Q658 Q662 L663 M664	E629-K660 IonicContact OE1-NZ 2.73Å; E629-K660 PolarHBondContact OE1-NZ 2.86Å; E629-K660 IonicContact OE2-NZ 3.71Å; E629-K660 PolarHBondContact OE2-NZ 2.82Å; Q658-K660 VanDerWaalsContact C-N 3.28Å; Q658-K660 HydrophobicContact CG-CB 4.03Å; Q658-K660 PolarHBondContact O-N 2.71Å; K660-Q662 VanDerWaalsContact C-N 3.32Å; K660-Q662 PolarHBondContact O-N 3.47Å; K660-L663 PolarHBondContact O-N 3.32Å; K660-M664 HydrophobicContact CG-SD 4.1Å; K660-M664 WeakPolarHBondContact O-CG 3.36Å; K660-M664 PolarHBondContact O-N 3.49Å
661	W	91.7	Very high	89.6	Confident	8 Å²	8	47.5 Å²	47.5	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-37.1	-176.8	-48.7	121.5	0	0	0	113	F625 E629 F648 A651 I659 M664 I665	F625-W661 HydrophobicContact CB-CH2 4.34Å; F625-W661 HydrophobicContact CB-CZ2 4.12Å; F625-W661 AromaticContact CD1-CZ2 3.87Å; F625-W661 HydrophobicContact CD1-CZ2 3.87Å; F625-W661 HydrophobicContact CG-CZ2 4.33Å; E629-W661 HydrophobicContact CB-CH2 4.32Å; E629-W661 HydrophobicContact CB-CZ3 4.34Å; F648-W661 HydrophobicContact CD1-CE3 4.03Å; F648-W661 HydrophobicContact CD1-CZ3 4.32Å; A651-W661 HydrophobicContact CB-CB 4.4Å; A651-W661 HydrophobicContact CB-CD2 3.58Å; A651-W661 HydrophobicContact CB-CE3 3.87Å; A651-W661 HydrophobicContact CB-CG 3.81Å; A651-W661 HydrophobicContact CB-CZ2 4.42Å; A651-W661 HydrophobicContact CB-CZ3 4.4Å; I659-W661 VanDerWaalsContact C-N 3.32Å; I659-W661 PolarHBondContact O-N 3.12Å; W661-M664 HydrophobicContact CE3-SD 3.85Å; W661-M664 HydrophobicContact CZ3-SD 3.98Å; W661-M664 PolarHBondContact O-N 3.12Å; W661-I665 VanDerWaalsContact O-CG1 3.31Å; W661-I665 WeakPolarHBondContact O-CG1 3.49Å; W661-I665 PolarHBondContact O-N 3.04Å; W661-I665 VanDerWaalsContact O-N 3.09Å
662	Q	90.2	Very high	89.4	Confident	22 Å²	22	49.4 Å²	49.4	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-71.3	-38.2	179.2	-60.5	171.5	18.7	0	0	111.4	I659 K660 I665 A666 I685 R688	I659-Q662 PolarHBondContact O-N 3.37Å; K660-Q662 VanDerWaalsContact C-N 3.32Å; K660-Q662 PolarHBondContact O-N 3.47Å; Q662-I665 PolarHBondContact O-N 3.04Å; Q662-A666 PolarHBondContact O-N 3.35Å; Q662-A666 VanDerWaalsContact O-N 3.07Å; Q662-I685 HydrophobicContact CB-CD1 3.77Å; Q662-I685 HydrophobicContact CB-CG1 3.82Å; Q662-I685 VanDerWaalsContact O-CD1 3.3Å; Q662-I685 WeakPolarHBondContact O-CD1 3.31Å; Q662-R688 VanDerWaalsContact NE2-NH1 3.18Å
663	L	90.5	Very high	89.2	Confident	14 Å²	14	50 Å²	50	7%	0.073	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-38.8	172.5	-67	177.4	0	0	0	112.2	I659 K660 A666 S667 Y682 I685 E694 C695	I659-L663 HydrophobicContact CG2-CD1 3.45Å; I659-L663 VanDerWaalsContact CG2-CD1 3.45Å; I659-L663 HydrophobicContact CG2-CG 3.74Å; I659-L663 PolarHBondContact O-N 3.08Å; I659-L663 VanDerWaalsContact O-N 3.09Å; K660-L663 PolarHBondContact O-N 3.32Å; L663-A666 PolarHBondContact O-N 3.21Å; L663-S667 VanDerWaalsContact O-CB 3.31Å; L663-S667 WeakPolarHBondContact O-CB 3.26Å; L663-S667 PolarHBondContact O-N 3.45Å; L663-Y682 HydrophobicContact CD2-CD1 4.3Å; L663-Y682 HydrophobicContact CD2-CE1 3.95Å; L663-I685 HydrophobicContact CD2-CD1 4.38Å; L663-I685 HydrophobicContact CD2-CG2 4.28Å; L663-E694 HydrophobicContact CD1-CB 4.12Å; L663-E694 WeakPolarHBondContact CD1-OE2 3.43Å; L663-C695 HydrophobicContact CD2-CB 3.98Å
664	M	90.4	Very high	89.1	Confident	32 Å²	32	46.5 Å²	46.5	16%	0.158	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-43.3	175.9	-67	178.3	95.9	0	0	111.2	F648 K660 W661 S667 C668	F648-M664 HydrophobicContact CD1-CB 4.21Å; F648-M664 HydrophobicContact CD1-CE 4.31Å; F648-M664 HydrophobicContact CD1-SD 4Å; F648-M664 HydrophobicContact CD2-CB 3.83Å; F648-M664 HydrophobicContact CE1-CB 4.35Å; F648-M664 HydrophobicContact CE1-CE 3.41Å; F648-M664 VanDerWaalsContact CE1-CE 3.41Å; F648-M664 HydrophobicContact CE1-SD 3.68Å; F648-M664 HydrophobicContact CE2-CB 3.98Å; F648-M664 HydrophobicContact CE2-CE 4.28Å; F648-M664 HydrophobicContact CG-CB 3.95Å; F648-M664 HydrophobicContact CZ-CB 4.22Å; F648-M664 HydrophobicContact CZ-CE 3.38Å; F648-M664 HydrophobicContact CZ-SD 4.09Å; K660-M664 HydrophobicContact CG-SD 4.1Å; K660-M664 WeakPolarHBondContact O-CG 3.36Å; K660-M664 PolarHBondContact O-N 3.49Å; W661-M664 HydrophobicContact CE3-SD 3.85Å; W661-M664 HydrophobicContact CZ3-SD 3.98Å; W661-M664 PolarHBondContact O-N 3.12Å; M664-S667 PolarHBondContact O-N 3.13Å; M664-C668 PolarHBondContact O-N 2.87Å; M664-C668 PolarHBondContact O-SG 3.48Å
665	I	91.8	Very high	89.1	Confident	18 Å²	18	47.3 Å²	47.3	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-49.8	173.5	-65.6	161.7	0	0	0	111.4	I645 F648 E649 W661 Q662 S667 C668 H669	I645-I665 HydrophobicContact CG2-CG2 4.18Å; F648-I665 HydrophobicContact CB-CD1 4.25Å; F648-I665 HydrophobicContact CB-CG1 3.62Å; E649-I665 HydrophobicContact CB-CD1 4.42Å; E649-I665 HydrophobicContact CG-CD1 3.81Å; E649-I665 HydrophobicContact CG-CG1 4.34Å; W661-I665 VanDerWaalsContact O-CG1 3.31Å; W661-I665 WeakPolarHBondContact O-CG1 3.49Å; W661-I665 PolarHBondContact O-N 3.04Å; W661-I665 VanDerWaalsContact O-N 3.09Å; Q662-I665 PolarHBondContact O-N 3.04Å; I665-S667 VanDerWaalsContact C-N 3.31Å; I665-S667 PolarHBondContact O-N 2.98Å; I665-C668 WeakPolarHBondContact O-CB 3.39Å; I665-C668 PolarHBondContact O-N 3.16Å; I665-C668 VanDerWaalsContact O-N 3.16Å; I665-H669 PolarHBondContact O-CD2 3.4Å; I665-H669 VanDerWaalsContact O-CD2 3.23Å; I665-H669 PolarHBondContact O-N 3.24Å
666	A	90.8	Very high	89.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-36.7	179.6	0	0	0	0	0	112.4	Q662 L663 H669 R670 Y682 I685	Q662-A666 PolarHBondContact O-N 3.35Å; Q662-A666 VanDerWaalsContact O-N 3.07Å; L663-A666 PolarHBondContact O-N 3.21Å; A666-H669 PolarHBondContact O-N 2.96Å; A666-R670 PolarHBondContact O-N 2.91Å; A666-Y682 HydrophobicContact CB-CD1 3.8Å; A666-Y682 HydrophobicContact CB-CD2 3.96Å; A666-Y682 HydrophobicContact CB-CE1 3.55Å; A666-Y682 HydrophobicContact CB-CE2 3.7Å; A666-Y682 HydrophobicContact CB-CG 3.99Å; A666-Y682 VanDerWaalsContact CB-CZ 3.48Å; A666-I685 HydrophobicContact CB-CD1 4.01Å
667	S	89.1	Confident	89.2	Confident	8 Å²	8	53.5 Å²	53.5	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-37.8	173.3	-172.6	0	0	0	0	112.2	L663 M664 I665 R670 R671	L663-S667 VanDerWaalsContact O-CB 3.31Å; L663-S667 WeakPolarHBondContact O-CB 3.26Å; L663-S667 PolarHBondContact O-N 3.45Å; M664-S667 PolarHBondContact O-N 3.13Å; I665-S667 VanDerWaalsContact C-N 3.31Å; I665-S667 PolarHBondContact O-N 2.98Å; S667-R670 WeakPolarHBondContact O-CB 3.38Å; S667-R670 PolarHBondContact O-N 2.91Å; S667-R671 PolarHBondContact O-N 3.21Å
668	C	91.2	Very high	89.5	Confident	1 Å²	1	47 Å²	47	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-43.6	172	-70.4	0	0	0	0	111.8	C641 I645 M664 I665 R670 R671 S672	C641-C668 HydrophobicContact CB-CB 4.26Å; I645-C668 HydrophobicContact CD1-CB 3.87Å; I645-C668 HydrophobicContact CG1-CB 3.41Å; I645-C668 VanDerWaalsContact CG1-CB 3.41Å; M664-C668 PolarHBondContact O-N 2.87Å; M664-C668 PolarHBondContact O-SG 3.48Å; I665-C668 WeakPolarHBondContact O-CB 3.39Å; I665-C668 PolarHBondContact O-N 3.16Å; I665-C668 VanDerWaalsContact O-N 3.16Å; C668-R670 VanDerWaalsContact C-N 3.29Å; C668-R670 PolarHBondContact O-N 3.42Å; C668-R671 PolarHBondContact O-N 3.45Å; C668-S672 PolarHBondContact O-N 3.01Å; C668-S672 PolarHBondContact O-OG 2.88Å
669	H	91.1	Very high	89.6	Confident	28 Å²	28	43 Å²	43	13%	0.13	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-38	174	-74.9	-73.2	0	0	0	112.4	I665 A666 G673 N674 Q677 A678	I665-H669 PolarHBondContact O-CD2 3.4Å; I665-H669 VanDerWaalsContact O-CD2 3.23Å; I665-H669 PolarHBondContact O-N 3.24Å; A666-H669 PolarHBondContact O-N 2.96Å; H669-G673 PolarHBondContact O-N 3.35Å; H669-N674 PolarHBondContact O-N 2.98Å; H669-Q677 HydrophobicContact CB-CB 4.47Å; H669-Q677 PolarHBondContact ND1-OE1 3.47Å; H669-Q677 VanDerWaalsContact ND1-OE1 3.1Å; H669-A678 HydrophobicContact CB-CB 3.87Å
670	R	89.8	Confident	89.7	Confident	61 Å²	61	44.5 Å²	44.5	23%	0.23	22%	0.215	C	C	.	.	H	α-helix	trans	-62.3	-49.8	173.7	-172.6	-174	71.3	83.6	-5.8	111.2	A666 S667 C668 S672 G673 Y675 A678 L702	A666-R670 PolarHBondContact O-N 2.91Å; S667-R670 WeakPolarHBondContact O-CB 3.38Å; S667-R670 PolarHBondContact O-N 2.91Å; C668-R670 VanDerWaalsContact C-N 3.29Å; C668-R670 PolarHBondContact O-N 3.42Å; R670-S672 VanDerWaalsContact C-N 3.32Å; R670-S672 PolarHBondContact O-N 3.14Å; R670-G673 PolarHBondContact O-N 3.3Å; R670-Y675 HydrophobicContact CG-CE1 4.27Å; R670-A678 HydrophobicContact CB-CB 4.24Å; R670-L702 HydrophobicContact CG-CD2 4.46Å
671	R	87.6	Confident	89.7	Confident	81 Å²	81	42.7 Å²	42.7	31%	0.306	21%	0.21	S	C	.	.	H	α-helix	trans	-66.9	-28.3	179.2	-73	-174.6	66.2	144.9	-3.1	113.6	I636 C641 S667 C668 G673	I636-R671 VanDerWaalsContact CG2-CZ 3.44Å; I636-R671 PolarHBondContact O-NH2 2.98Å; C641-R671 VanDerWaalsContact SG-CB 3.55Å; S667-R671 PolarHBondContact O-N 3.21Å; C668-R671 PolarHBondContact O-N 3.45Å; R671-G673 PolarHBondContact O-N 3.09Å
672	S	87.7	Confident	89.7	Confident	40 Å²	40	42.3 Å²	42.3	28%	0.28	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-5.1	169.5	-68.8	0	0	0	0	114.2	C641 C668 R670 N674	C641-S672 VanDerWaalsContact CB-OG 3.31Å; C641-S672 WeakPolarHBondContact CB-OG 3.26Å; C668-S672 PolarHBondContact O-N 3.01Å; C668-S672 PolarHBondContact O-OG 2.88Å; R670-S672 VanDerWaalsContact C-N 3.32Å; R670-S672 PolarHBondContact O-N 3.14Å; S672-N674 VanDerWaalsContact C-N 3.27Å; S672-N674 PolarHBondContact O-N 3.34Å
673	G	86.3	Confident	89.7	Confident	35 Å²	35	43.8 Å²	43.8	36%	0.361	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	4.2	-175.1	0	0	0	0	0	114.9	H669 R670 R671 Y675	H669-G673 PolarHBondContact O-N 3.35Å; R670-G673 PolarHBondContact O-N 3.3Å; R671-G673 PolarHBondContact O-N 3.09Å; G673-Y675 WeakPolarHBondContact O-CD2 3.39Å; G673-Y675 PolarHBondContact O-N 3.39Å
674	N	88.8	Confident	89.7	Confident	64 Å²	64	47.4 Å²	47.4	34%	0.342	23%	0.231	S	C	.	.			trans	-84.6	58.6	-179.7	-71.1	-9.4	0	0	0	111.1	H669 S672 Q676 Q677 A678	H669-N674 PolarHBondContact O-N 2.98Å; S672-N674 VanDerWaalsContact C-N 3.27Å; S672-N674 PolarHBondContact O-N 3.34Å; N674-Q676 PolarHBondContact O-N 3.36Å; N674-Q676 VanDerWaalsContact O-N 3.09Å; N674-Q677 HydrophobicContact CB-CB 4.18Å; N674-Q677 HydrophobicContact CB-CG 4.32Å; N674-Q677 PolarHBondContact ND2-OE1 2.88Å; N674-Q677 PolarHBondContact O-N 3.24Å; N674-A678 PolarHBondContact O-N 3.38Å
675	Y	88.4	Confident	89.7	Confident	119 Å²	119	46.1 Å²	46.1	47%	0.467	23%	0.225	S	C	.	.	H	α-helix	trans	-52.3	-35.9	-173	-62.4	-72.9	0	0	0	114.2	R670 G673 A678 L679 L702	R670-Y675 HydrophobicContact CG-CE1 4.27Å; G673-Y675 WeakPolarHBondContact O-CD2 3.39Å; G673-Y675 PolarHBondContact O-N 3.39Å; Y675-A678 PolarHBondContact O-N 3.49Å; Y675-L679 VanDerWaalsContact O-CB 3.31Å; Y675-L679 WeakPolarHBondContact O-CB 3.35Å; Y675-L679 PolarHBondContact O-N 3.39Å; Y675-L702 HydrophobicContact CD1-CD2 3.74Å; Y675-L702 HydrophobicContact CE1-CD2 4.49Å
676	Q	88.6	Confident	89.5	Confident	153 Å²	153	46.9 Å²	46.9	72%	0.715	23%	0.228	S	C	*	.	H	α-helix	trans	-68.1	-38.1	178.1	-66.2	143.1	0.8	0	0	112.5	N674 E680 M706	N674-Q676 PolarHBondContact O-N 3.36Å; N674-Q676 VanDerWaalsContact O-N 3.09Å; Q676-E680 PolarHBondContact O-N 3.14Å; Q676-E680 VanDerWaalsContact O-N 3.17Å; Q676-M706 HydrophobicContact CG-CE 4.17Å
677	Q	88.6	Confident	89.4	Confident	98 Å²	98	55.7 Å²	55.7	46%	0.458	26%	0.261	S	S	.	.	H	α-helix	trans	-72.4	-39.6	174.2	-65.1	178.5	-18.2	0	0	111.1	H669 N674 L679 E680 T681	H669-Q677 HydrophobicContact CB-CB 4.47Å; H669-Q677 PolarHBondContact ND1-OE1 3.47Å; H669-Q677 VanDerWaalsContact ND1-OE1 3.1Å; N674-Q677 HydrophobicContact CB-CB 4.18Å; N674-Q677 HydrophobicContact CB-CG 4.32Å; N674-Q677 PolarHBondContact ND2-OE1 2.88Å; N674-Q677 PolarHBondContact O-N 3.24Å; Q677-L679 VanDerWaalsContact C-N 3.35Å; Q677-E680 PolarHBondContact O-N 3.46Å; Q677-T681 WeakPolarHBondContact O-CB 3.43Å; Q677-T681 WeakPolarHBondContact O-CG2 3.38Å; Q677-T681 PolarHBondContact O-N 2.75Å; Q677-T681 PolarHBondContact O-OG1 3.05Å
678	A	90.4	Very high	89.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-47.9	173.3	0	0	0	0	0	110.7	H669 R670 N674 Y675 E680 T681 Y682 L702	H669-A678 HydrophobicContact CB-CB 3.87Å; R670-A678 HydrophobicContact CB-CB 4.24Å; N674-A678 PolarHBondContact O-N 3.38Å; Y675-A678 PolarHBondContact O-N 3.49Å; A678-E680 PolarHBondContact O-N 3.3Å; A678-T681 WeakPolarHBondContact CA-OG1 3.18Å; A678-T681 PolarHBondContact O-N 2.93Å; A678-T681 PolarHBondContact O-OG1 3.31Å; A678-Y682 HydrophobicContact CB-CD2 4.48Å; A678-Y682 HydrophobicContact CB-CE2 4.41Å; A678-Y682 WeakPolarHBondContact O-CB 3.49Å; A678-Y682 WeakPolarHBondContact O-CD2 3.29Å; A678-Y682 PolarHBondContact O-N 2.98Å; A678-L702 HydrophobicContact CB-CD1 4.19Å
679	L	89.7	Confident	88.9	Confident	12 Å²	12	63.7 Å²	63.7	6%	0.063	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-43.7	-179.5	-169.9	150	0	0	0	112.6	Y675 Q677 Y682 R683 L702 M706 L708	Y675-L679 VanDerWaalsContact O-CB 3.31Å; Y675-L679 WeakPolarHBondContact O-CB 3.35Å; Y675-L679 PolarHBondContact O-N 3.39Å; Q677-L679 VanDerWaalsContact C-N 3.35Å; L679-Y682 PolarHBondContact O-N 3.17Å; L679-R683 HydrophobicContact CD2-CG 4.27Å; L679-R683 WeakPolarHBondContact O-CG 3.37Å; L679-R683 PolarHBondContact O-N 3.28Å; L679-L702 HydrophobicContact CD1-CB 4.45Å; L679-M706 HydrophobicContact CD1-SD 3.9Å; L679-L708 HydrophobicContact CD1-CD1 3.42Å; L679-L708 VanDerWaalsContact CD1-CD1 3.42Å
680	E	90.7	Very high	88.5	Confident	69 Å²	69	65.9 Å²	65.9	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-70.6	-37.1	178.1	-167	58.7	-154.6	0	0	112.2	Q676 Q677 A678 R683 I684	Q676-E680 PolarHBondContact O-N 3.14Å; Q676-E680 VanDerWaalsContact O-N 3.17Å; Q677-E680 PolarHBondContact O-N 3.46Å; A678-E680 PolarHBondContact O-N 3.3Å; E680-R683 WeakPolarHBondContact O-CB 3.3Å; E680-R683 PolarHBondContact O-N 3.04Å; E680-R683 VanDerWaalsContact OE2-CD 3.24Å; E680-R683 WeakPolarHBondContact OE2-CD 2.93Å; E680-R683 IonicContact OE2-CZ 3.61Å; E680-R683 IonicContact OE2-NH1 3.88Å; E680-R683 PolarHBondContact OE2-NH1 3.38Å; E680-I684 HydrophobicContact CG-CD1 4.34Å; E680-I684 VanDerWaalsContact O-CG1 3.29Å; E680-I684 WeakPolarHBondContact O-CG1 3.31Å; E680-I684 PolarHBondContact O-N 2.9Å
681	T	90.3	Very high	88	Confident	34 Å²	34	68.1 Å²	68.1	21%	0.209	32%	0.321	C	S	.	.	H	α-helix	trans	-63.7	-44.6	173.1	48.9	0	0	0	0	111.5	Q677 A678 R683 I684 I685	Q677-T681 WeakPolarHBondContact O-CB 3.43Å; Q677-T681 WeakPolarHBondContact O-CG2 3.38Å; Q677-T681 PolarHBondContact O-N 2.75Å; Q677-T681 PolarHBondContact O-OG1 3.05Å; A678-T681 WeakPolarHBondContact CA-OG1 3.18Å; A678-T681 PolarHBondContact O-N 2.93Å; A678-T681 PolarHBondContact O-OG1 3.31Å; T681-R683 PolarHBondContact O-N 3.11Å; T681-I684 PolarHBondContact O-N 2.94Å; T681-I685 VanDerWaalsContact O-CG1 3.27Å; T681-I685 WeakPolarHBondContact O-CG1 3.22Å; T681-I685 PolarHBondContact O-N 3.34Å
682	Y	92.1	Very high	87.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-37.8	172.3	-76.9	-63.1	0	0	0	113.2	L663 A666 A678 L679 I685 H686 C695 F698 L702	L663-Y682 HydrophobicContact CD2-CD1 4.3Å; L663-Y682 HydrophobicContact CD2-CE1 3.95Å; A666-Y682 HydrophobicContact CB-CD1 3.8Å; A666-Y682 HydrophobicContact CB-CD2 3.96Å; A666-Y682 HydrophobicContact CB-CE1 3.55Å; A666-Y682 HydrophobicContact CB-CE2 3.7Å; A666-Y682 HydrophobicContact CB-CG 3.99Å; A666-Y682 VanDerWaalsContact CB-CZ 3.48Å; A678-Y682 HydrophobicContact CB-CD2 4.48Å; A678-Y682 HydrophobicContact CB-CE2 4.41Å; A678-Y682 WeakPolarHBondContact O-CB 3.49Å; A678-Y682 WeakPolarHBondContact O-CD2 3.29Å; A678-Y682 PolarHBondContact O-N 2.98Å; L679-Y682 PolarHBondContact O-N 3.17Å; Y682-I685 HydrophobicContact CD1-CD1 4.43Å; Y682-I685 PolarHBondContact O-N 3.02Å; Y682-H686 WeakPolarHBondContact O-CB 3.46Å; Y682-H686 PolarHBondContact O-N 2.92Å; Y682-C695 PolarHBondContact O-SG 3.47Å; Y682-F698 HydrophobicContact CD1-CB 4.18Å; Y682-F698 HydrophobicContact CD2-CB 4.38Å; Y682-F698 HydrophobicContact CE1-CB 3.66Å; Y682-F698 AromaticContact CE1-CD2 3.85Å; Y682-F698 HydrophobicContact CE1-CD2 3.85Å; Y682-F698 AromaticContact CE1-CG 4Å; Y682-F698 HydrophobicContact CE1-CG 4Å; Y682-F698 HydrophobicContact CE2-CB 3.92Å; Y682-F698 HydrophobicContact CE2-CG 4.48Å; Y682-F698 AromaticContact CZ-CD2 3.94Å; Y682-F698 AromaticContact CZ-CG 3.75Å; Y682-F698 WeakPolarHBondContact OH-CG 3.29Å; Y682-L702 HydrophobicContact CD2-CD1 3.43Å; Y682-L702 VanDerWaalsContact CD2-CD1 3.43Å; Y682-L702 HydrophobicContact CE2-CD1 3.58Å
683	R	90.6	Very high	87.8	Confident	52 Å²	52	64.9 Å²	64.9	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-42.1	172.6	-80.7	173.2	169.1	161	0.2	112.2	L679 E680 T681 H686 R687 L699 E710	L679-R683 HydrophobicContact CD2-CG 4.27Å; L679-R683 WeakPolarHBondContact O-CG 3.37Å; L679-R683 PolarHBondContact O-N 3.28Å; E680-R683 WeakPolarHBondContact O-CB 3.3Å; E680-R683 PolarHBondContact O-N 3.04Å; E680-R683 VanDerWaalsContact OE2-CD 3.24Å; E680-R683 WeakPolarHBondContact OE2-CD 2.93Å; E680-R683 IonicContact OE2-CZ 3.61Å; E680-R683 IonicContact OE2-NH1 3.88Å; E680-R683 PolarHBondContact OE2-NH1 3.38Å; T681-R683 PolarHBondContact O-N 3.11Å; R683-H686 PolarHBondContact O-N 3.49Å; R683-R687 WeakPolarHBondContact O-CG 3.4Å; R683-R687 PolarHBondContact O-N 3.25Å; R683-L699 HydrophobicContact CG-CD2 4.31Å; R683-E710 IonicContact CZ-OE1 3.95Å; R683-E710 IonicContact CZ-OE2 2.69Å; R683-E710 IonicContact NE-OE2 2.71Å; R683-E710 PolarHBondContact NE-OE2 3.19Å; R683-E710 IonicContact NH2-OE1 3.96Å; R683-E710 PolarHBondContact NH2-OE1 3.12Å; R683-E710 IonicContact NH2-OE2 2.71Å; R683-E710 PolarHBondContact NH2-OE2 3.41Å
684	I	90.2	Very high	87.8	Confident	90 Å²	90	68.2 Å²	68.2	46%	0.462	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-44.2	176.4	-68.7	162.8	0	0	0	110.3	E680 T681 R687 R688	E680-I684 HydrophobicContact CG-CD1 4.34Å; E680-I684 VanDerWaalsContact O-CG1 3.29Å; E680-I684 WeakPolarHBondContact O-CG1 3.31Å; E680-I684 PolarHBondContact O-N 2.9Å; T681-I684 PolarHBondContact O-N 2.94Å; I684-R687 PolarHBondContact O-N 2.86Å; I684-R688 PolarHBondContact O-N 2.82Å
685	I	89.3	Confident	87.8	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-48.6	176.1	-64.3	163.6	0	0	0	110.6	Q662 L663 A666 T681 Y682 R687 R688 F689 C695	Q662-I685 HydrophobicContact CB-CD1 3.77Å; Q662-I685 HydrophobicContact CB-CG1 3.82Å; Q662-I685 VanDerWaalsContact O-CD1 3.3Å; Q662-I685 WeakPolarHBondContact O-CD1 3.31Å; L663-I685 HydrophobicContact CD2-CD1 4.38Å; L663-I685 HydrophobicContact CD2-CG2 4.28Å; A666-I685 HydrophobicContact CB-CD1 4.01Å; T681-I685 VanDerWaalsContact O-CG1 3.27Å; T681-I685 WeakPolarHBondContact O-CG1 3.22Å; T681-I685 PolarHBondContact O-N 3.34Å; Y682-I685 HydrophobicContact CD1-CD1 4.43Å; Y682-I685 PolarHBondContact O-N 3.02Å; I685-R687 PolarHBondContact O-N 2.82Å; I685-R688 CarbonylContact O-C 3.55Å; I685-R688 PolarHBondContact O-N 3.33Å; I685-F689 PolarHBondContact O-N 3.08Å; I685-C695 HydrophobicContact CG2-CB 4.32Å
686	H	87.8	Confident	87.7	Confident	34 Å²	34	59.5 Å²	59.5	16%	0.157	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-36.2	179.7	-180	66.4	0	0	0	113.3	Y682 R683 R688 F689 P690 L699	Y682-H686 WeakPolarHBondContact O-CB 3.46Å; Y682-H686 PolarHBondContact O-N 2.92Å; R683-H686 PolarHBondContact O-N 3.49Å; H686-R688 PolarHBondContact O-N 3.01Å; H686-F689 CarbonylContact O-C 3.59Å; H686-P690 VanDerWaalsContact CE1-C 3.48Å; H686-P690 VanDerWaalsContact CE1-CA 3.45Å; H686-P690 WeakPolarHBondContact CE1-CA 3.42Å; H686-P690 PolarHBondContact CE1-O 3.22Å; H686-P690 WeakPolarHBondContact O-CA 3.48Å; H686-L699 HydrophobicContact CB-CD1 3.64Å
687	R	88.6	Confident	87.8	Confident	184 Å²	184	56.6 Å²	56.6	69%	0.694	26%	0.26	S	S	*	.	H	α-helix	trans	-61	-34.8	172.2	-77.2	175.6	-177.4	154.9	6.6	112.2	R683 I684 I685	R683-R687 WeakPolarHBondContact O-CG 3.4Å; R683-R687 PolarHBondContact O-N 3.25Å; I684-R687 PolarHBondContact O-N 2.86Å; I685-R687 PolarHBondContact O-N 2.82Å
688	R	85.8	Confident	87.7	Confident	132 Å²	132	54.3 Å²	54.3	50%	0.498	25%	0.249	S	C	.	.	H	α-helix	trans	-86.5	-31	-178	-160.6	173	-179.3	-164.4	-4.9	112.7	P656 Q662 I684 I685 H686	P656-R688 PolarHBondContact O-NH2 3.02Å; Q662-R688 VanDerWaalsContact NE2-NH1 3.18Å; I684-R688 PolarHBondContact O-N 2.82Å; I685-R688 CarbonylContact O-C 3.55Å; I685-R688 PolarHBondContact O-N 3.33Å; H686-R688 PolarHBondContact O-N 3.01Å
689	F	84.7	Confident	87.6	Confident	46 Å²	46	54.4 Å²	54.4	20%	0.202	25%	0.25	C	C	.	.			trans	-137.8	74.3	-175.6	-60.7	-76.6	0	0	0	112.1	I659 I685 H686 E691 N692	I659-F689 HydrophobicContact CD1-CB 3.5Å; I659-F689 HydrophobicContact CD1-CD1 3.66Å; I659-F689 HydrophobicContact CD1-CD2 3.94Å; I659-F689 HydrophobicContact CD1-CE1 4.3Å; I659-F689 HydrophobicContact CD1-CG 3.44Å; I659-F689 VanDerWaalsContact CD1-CG 3.44Å; I659-F689 HydrophobicContact CG1-CB 4.05Å; I659-F689 HydrophobicContact CG1-CD1 3.81Å; I659-F689 HydrophobicContact CG1-CD2 3.46Å; I659-F689 VanDerWaalsContact CG1-CD2 3.46Å; I659-F689 HydrophobicContact CG1-CE1 4.02Å; I659-F689 HydrophobicContact CG1-CE2 3.69Å; I659-F689 HydrophobicContact CG1-CG 3.51Å; I659-F689 HydrophobicContact CG1-CZ 3.96Å; I685-F689 PolarHBondContact O-N 3.08Å; H686-F689 CarbonylContact O-C 3.59Å; F689-E691 VanDerWaalsContact C-N 3.27Å; F689-E691 PolarHBondContact O-N 2.91Å; F689-N692 PolarHBondContact O-N 3.43Å
690	P	82	Confident	87.5	Confident	74 Å²	74	55.2 Å²	55.2	48%	0.481	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.6	-169.8	28.9	-37.1	0	0	0	115.4	H686	H686-P690 VanDerWaalsContact CE1-C 3.48Å; H686-P690 VanDerWaalsContact CE1-CA 3.45Å; H686-P690 WeakPolarHBondContact CE1-CA 3.42Å; H686-P690 PolarHBondContact CE1-O 3.22Å; H686-P690 WeakPolarHBondContact O-CA 3.48Å
691	E	79.3	Confident	87.4	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.5	178.6	-65.4	-162.4	162.9	0	0	114	F689 I693 R728	F689-E691 VanDerWaalsContact C-N 3.27Å; F689-E691 PolarHBondContact O-N 2.91Å; E691-I693 PolarHBondContact O-N 3.34Å; E691-R728 VanDerWaalsContact CD-NH2 3.29Å; E691-R728 IonicContact OE1-CZ 4Å; E691-R728 IonicContact OE1-NH2 3Å; E691-R728 PolarHBondContact OE1-NH2 2.9Å; E691-R728 IonicContact OE2-CZ 3.21Å; E691-R728 IonicContact OE2-NH1 2.72Å; E691-R728 PolarHBondContact OE2-NH1 3.26Å; E691-R728 IonicContact OE2-NH2 2.77Å; E691-R728 PolarHBondContact OE2-NH2 3.42Å
692	N	85.8	Confident	87.2	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.134	26%	0.257	C	S	.	.			trans	-77.3	122.2	-174.9	-173.3	5.4	0	0	0	112.5	I659 F689 E694 C695 L696	I659-N692 HydrophobicContact CD1-CB 4.03Å; I659-N692 VanDerWaalsContact CG2-ND2 3.27Å; I659-N692 WeakPolarHBondContact CG2-ND2 3.29Å; F689-N692 PolarHBondContact O-N 3.43Å; N692-E694 PolarHBondContact OD1-N 3.22Å; N692-E694 VanDerWaalsContact OD1-N 3.12Å; N692-C695 HydrophobicContact CB-CB 4.16Å; N692-L696 WeakPolarHBondContact O-CG 3.36Å; N692-L696 PolarHBondContact O-N 3.38Å
693	I	86.9	Confident	87	Confident	27 Å²	27	57.5 Å²	57.5	14%	0.138	26%	0.257	C	S	.	.	H	α-helix	trans	-71.5	-43	-179.2	-62.5	173.2	0	0	0	111.7	E691 C695 L696 Q697 A721 E722 K725	E691-I693 PolarHBondContact O-N 3.34Å; I693-C695 PolarHBondContact O-N 3.25Å; I693-L696 CarbonylContact O-C 3.57Å; I693-L696 WeakPolarHBondContact O-CB 3.47Å; I693-L696 PolarHBondContact O-N 2.96Å; I693-L696 VanDerWaalsContact O-N 3.09Å; I693-Q697 HydrophobicContact CG2-CG 4.2Å; I693-Q697 WeakPolarHBondContact O-CG 3.49Å; I693-Q697 PolarHBondContact O-N 3.37Å; I693-A721 HydrophobicContact CG1-CB 4.02Å; I693-E722 HydrophobicContact CD1-CG 4.39Å; I693-E722 HydrophobicContact CG2-CG 4.38Å; I693-K725 HydrophobicContact CD1-CB 3.84Å; I693-K725 HydrophobicContact CD1-CD 3.41Å; I693-K725 VanDerWaalsContact CD1-CD 3.41Å; I693-K725 HydrophobicContact CD1-CG 4.24Å
694	E	85	Confident	86.9	Confident	105 Å²	105	57.9 Å²	57.9	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-46.8	-178.2	-67.6	161.6	-157.8	0	0	110.7	L663 N692 L696 Q697 F698	L663-E694 HydrophobicContact CD1-CB 4.12Å; L663-E694 WeakPolarHBondContact CD1-OE2 3.43Å; N692-E694 PolarHBondContact OD1-N 3.22Å; N692-E694 VanDerWaalsContact OD1-N 3.12Å; E694-L696 VanDerWaalsContact C-N 3.28Å; E694-L696 PolarHBondContact O-N 2.91Å; E694-Q697 PolarHBondContact O-N 3.47Å; E694-F698 WeakPolarHBondContact O-CD2 3.49Å; E694-F698 PolarHBondContact O-N 3.33Å
695	C	88.7	Confident	86.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-38.6	175	-169.2	0	0	0	0	112.4	L663 Y682 I685 N692 I693 L699	L663-C695 HydrophobicContact CD2-CB 3.98Å; Y682-C695 PolarHBondContact O-SG 3.47Å; I685-C695 HydrophobicContact CG2-CB 4.32Å; N692-C695 HydrophobicContact CB-CB 4.16Å; I693-C695 PolarHBondContact O-N 3.25Å; C695-L699 WeakPolarHBondContact O-CB 3.35Å; C695-L699 VanDerWaalsContact O-CG 3.32Å; C695-L699 WeakPolarHBondContact O-CG 3.38Å; C695-L699 PolarHBondContact O-N 2.87Å
696	L	87.7	Confident	86.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-71.8	-37.3	177.9	-79.2	168.2	0	0	0	112.2	N692 I693 E694 L699 V700 Y714 K717 L718 A721	N692-L696 WeakPolarHBondContact O-CG 3.36Å; N692-L696 PolarHBondContact O-N 3.38Å; I693-L696 CarbonylContact O-C 3.57Å; I693-L696 WeakPolarHBondContact O-CB 3.47Å; I693-L696 PolarHBondContact O-N 2.96Å; I693-L696 VanDerWaalsContact O-N 3.09Å; E694-L696 VanDerWaalsContact C-N 3.28Å; E694-L696 PolarHBondContact O-N 2.91Å; L696-L699 PolarHBondContact O-N 3.25Å; L696-V700 VanDerWaalsContact O-CG2 3.31Å; L696-V700 WeakPolarHBondContact O-CG2 3.37Å; L696-V700 PolarHBondContact O-N 3.49Å; L696-Y714 HydrophobicContact CD2-CD1 4.27Å; L696-K717 HydrophobicContact CD1-CB 4.3Å; L696-K717 HydrophobicContact CD2-CB 3.78Å; L696-K717 HydrophobicContact CD2-CD 4.35Å; L696-L718 HydrophobicContact CB-CB 4.22Å; L696-L718 HydrophobicContact CB-CD1 4.32Å; L696-A721 HydrophobicContact CD1-CB 3.9Å
697	Q	88.9	Confident	86.3	Confident	92 Å²	92	67.6 Å²	67.6	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-61.9	-47.8	175	-75.5	169.6	-28	0	0	110.9	I693 E694 V700 R701 L718	I693-Q697 HydrophobicContact CG2-CG 4.2Å; I693-Q697 WeakPolarHBondContact O-CG 3.49Å; I693-Q697 PolarHBondContact O-N 3.37Å; E694-Q697 PolarHBondContact O-N 3.47Å; Q697-V700 PolarHBondContact O-N 2.99Å; Q697-R701 PolarHBondContact O-N 3.27Å; Q697-L718 HydrophobicContact CB-CD1 4.28Å; Q697-L718 HydrophobicContact CG-CD1 3.56Å
698	F	87.1	Confident	86.1	Confident	50 Å²	50	61.2 Å²	61.2	22%	0.219	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-37.3	176.1	-69	-59.8	0	0	0	113.2	Y682 E694 R701 L702	Y682-F698 HydrophobicContact CD1-CB 4.18Å; Y682-F698 HydrophobicContact CD2-CB 4.38Å; Y682-F698 HydrophobicContact CE1-CB 3.66Å; Y682-F698 AromaticContact CE1-CD2 3.85Å; Y682-F698 HydrophobicContact CE1-CD2 3.85Å; Y682-F698 AromaticContact CE1-CG 4Å; Y682-F698 HydrophobicContact CE1-CG 4Å; Y682-F698 HydrophobicContact CE2-CB 3.92Å; Y682-F698 HydrophobicContact CE2-CG 4.48Å; Y682-F698 AromaticContact CZ-CD2 3.94Å; Y682-F698 AromaticContact CZ-CG 3.75Å; Y682-F698 WeakPolarHBondContact OH-CG 3.29Å; E694-F698 WeakPolarHBondContact O-CD2 3.49Å; E694-F698 PolarHBondContact O-N 3.33Å; F698-R701 PolarHBondContact O-N 3.24Å; F698-L702 WeakPolarHBondContact O-CB 3.41Å; F698-L702 WeakPolarHBondContact O-CG 3.05Å; F698-L702 PolarHBondContact O-N 2.98Å
699	L	88.3	Confident	85.9	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-44.2	173.3	-81.7	169.5	0	0	0	112.2	R683 H686 C695 L696 S703 Y714	R683-L699 HydrophobicContact CG-CD2 4.31Å; H686-L699 HydrophobicContact CB-CD1 3.64Å; C695-L699 WeakPolarHBondContact O-CB 3.35Å; C695-L699 VanDerWaalsContact O-CG 3.32Å; C695-L699 WeakPolarHBondContact O-CG 3.38Å; C695-L699 PolarHBondContact O-N 2.87Å; L696-L699 PolarHBondContact O-N 3.25Å; L699-S703 WeakPolarHBondContact O-CB 3.31Å; L699-S703 PolarHBondContact O-N 2.67Å; L699-S703 PolarHBondContact O-OG 3.42Å; L699-Y714 HydrophobicContact CB-CD1 4.14Å; L699-Y714 HydrophobicContact CB-CD2 4.35Å; L699-Y714 HydrophobicContact CB-CG 4.07Å; L699-Y714 HydrophobicContact CD1-CD1 3.98Å; L699-Y714 HydrophobicContact CD1-CE1 3.87Å
700	V	88.9	Confident	85.8	Confident	29 Å²	29	61.4 Å²	61.4	18%	0.176	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-52.8	175.8	168.3	0	0	0	0	109.9	L696 Q697 S703 S704 I715 L718	L696-V700 VanDerWaalsContact O-CG2 3.31Å; L696-V700 WeakPolarHBondContact O-CG2 3.37Å; L696-V700 PolarHBondContact O-N 3.49Å; Q697-V700 PolarHBondContact O-N 2.99Å; V700-S703 WeakPolarHBondContact CA-OG 3.3Å; V700-S703 PolarHBondContact O-N 3.13Å; V700-S703 PolarHBondContact O-OG 3.34Å; V700-S704 PolarHBondContact O-N 3.28Å; V700-S704 PolarHBondContact O-OG 3.09Å; V700-I715 HydrophobicContact CB-CG1 4.45Å; V700-I715 HydrophobicContact CG1-CD1 4.34Å; V700-I715 HydrophobicContact CG1-CG1 3.68Å; V700-I715 HydrophobicContact CG2-CG1 3.85Å; V700-L718 HydrophobicContact CG2-CD1 4.2Å
701	R	87.3	Confident	85.8	Confident	145 Å²	145	58.5 Å²	58.5	55%	0.547	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-52.7	-178.9	-160.2	168.8	-168.6	155.5	-0.1	112.1	Q697 F698 S703 S704 D705	Q697-R701 PolarHBondContact O-N 3.27Å; F698-R701 PolarHBondContact O-N 3.24Å; R701-S703 VanDerWaalsContact C-N 3.26Å; R701-S703 PolarHBondContact O-N 3.43Å; R701-S704 PolarHBondContact O-N 2.84Å; R701-S704 PolarHBondContact O-OG 2.71Å; R701-D705 WeakPolarHBondContact O-CB 3.31Å; R701-D705 PolarHBondContact O-N 2.93Å; R701-D705 VanDerWaalsContact O-OD1 3.05Å
702	L	87.4	Confident	86	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-32.6	177.1	-72.8	168.9	0	0	0	113.4	R670 Y675 A678 L679 Y682 F698 M706	R670-L702 HydrophobicContact CG-CD2 4.46Å; Y675-L702 HydrophobicContact CD1-CD2 3.74Å; Y675-L702 HydrophobicContact CE1-CD2 4.49Å; A678-L702 HydrophobicContact CB-CD1 4.19Å; L679-L702 HydrophobicContact CD1-CB 4.45Å; Y682-L702 HydrophobicContact CD2-CD1 3.43Å; Y682-L702 VanDerWaalsContact CD2-CD1 3.43Å; Y682-L702 HydrophobicContact CE2-CD1 3.58Å; F698-L702 WeakPolarHBondContact O-CB 3.41Å; F698-L702 WeakPolarHBondContact O-CG 3.05Å; F698-L702 PolarHBondContact O-N 2.98Å; L702-M706 WeakPolarHBondContact O-CB 3.39Å; L702-M706 VanDerWaalsContact O-CG 3.32Å; L702-M706 WeakPolarHBondContact O-CG 3.28Å; L702-M706 PolarHBondContact O-N 3.47Å
703	S	87.2	Confident	86.1	Confident	1 Å²	1	63 Å²	63	1%	0.007	32%	0.323	C	S	.	.	H	α-helix	trans	-77.7	-29.4	178.3	68.5	0	0	0	0	113.7	L699 V700 R701 D707 L708 A711	L699-S703 WeakPolarHBondContact O-CB 3.31Å; L699-S703 PolarHBondContact O-N 2.67Å; L699-S703 PolarHBondContact O-OG 3.42Å; V700-S703 WeakPolarHBondContact CA-OG 3.3Å; V700-S703 PolarHBondContact O-N 3.13Å; V700-S703 PolarHBondContact O-OG 3.34Å; R701-S703 VanDerWaalsContact C-N 3.26Å; R701-S703 PolarHBondContact O-N 3.43Å; S703-D707 PolarHBondContact O-N 2.96Å; S703-L708 PolarHBondContact O-N 2.88Å; S703-A711 WeakPolarHBondContact OG-CA 3.31Å; S703-A711 WeakPolarHBondContact OG-CB 3.29Å
704	S	87.8	Confident	86.1	Confident	61 Å²	61	62.6 Å²	62.6	43%	0.427	32%	0.32	S	S	.	.	H	α-helix	trans	-72.8	-44.2	170.4	51	0	0	0	0	111.2	V700 R701 M706 D707	V700-S704 PolarHBondContact O-N 3.28Å; V700-S704 PolarHBondContact O-OG 3.09Å; R701-S704 PolarHBondContact O-N 2.84Å; R701-S704 PolarHBondContact O-OG 2.71Å; S704-M706 PolarHBondContact O-N 3.2Å; S704-M706 VanDerWaalsContact O-N 3.14Å; S704-D707 PolarHBondContact O-N 3.01Å; S704-D707 VanDerWaalsContact O-N 3.15Å
705	D	87.1	Confident	86.2	Confident	109 Å²	109	59.7 Å²	59.7	58%	0.583	31%	0.308	S	S	*	.	H	α-helix	trans	-68.2	-15.7	-176.9	-55.3	-8.5	0	0	0	112.4	R701	R701-D705 WeakPolarHBondContact O-CB 3.31Å; R701-D705 PolarHBondContact O-N 2.93Å; R701-D705 VanDerWaalsContact O-OD1 3.05Å
706	M	84.2	Confident	86.2	Confident	69 Å²	69	62.7 Å²	62.7	34%	0.34	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	9.9	177.5	-64.9	-174.7	63.8	0	0	114.2	Q676 L679 L702 S704 L708	Q676-M706 HydrophobicContact CG-CE 4.17Å; L679-M706 HydrophobicContact CD1-SD 3.9Å; L702-M706 WeakPolarHBondContact O-CB 3.39Å; L702-M706 VanDerWaalsContact O-CG 3.32Å; L702-M706 WeakPolarHBondContact O-CG 3.28Å; L702-M706 PolarHBondContact O-N 3.47Å; S704-M706 PolarHBondContact O-N 3.2Å; S704-M706 VanDerWaalsContact O-N 3.14Å; M706-L708 HydrophobicContact CB-CD1 4.07Å; M706-L708 HydrophobicContact CB-CG 4Å; M706-L708 PolarHBondContact O-N 3.21Å; M706-L708 VanDerWaalsContact O-N 3.17Å
707	D	83.8	Confident	86.2	Confident	155 Å²	155	65.5 Å²	65.5	83%	0.829	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	36	-178.7	-74.6	-46.8	0	0	0	114.8	S703 S704	S703-D707 PolarHBondContact O-N 2.96Å; S704-D707 PolarHBondContact O-N 3.01Å; S704-D707 VanDerWaalsContact O-N 3.15Å
708	L	85.2	Confident	86.2	Confident	50 Å²	50	62.3 Å²	62.3	26%	0.262	32%	0.324	S	S	.	.			trans	-84.5	135.2	-176.7	-68.9	172.4	0	0	0	111.8	L679 S703 M706 E710 A711	L679-L708 HydrophobicContact CD1-CD1 3.42Å; L679-L708 VanDerWaalsContact CD1-CD1 3.42Å; S703-L708 PolarHBondContact O-N 2.88Å; M706-L708 HydrophobicContact CB-CD1 4.07Å; M706-L708 HydrophobicContact CB-CG 4Å; M706-L708 PolarHBondContact O-N 3.21Å; M706-L708 VanDerWaalsContact O-N 3.17Å; L708-E710 PolarHBondContact O-N 2.85Å; L708-E710 VanDerWaalsContact O-N 3.08Å; L708-A711 VanDerWaalsContact O-CB 3.29Å; L708-A711 WeakPolarHBondContact O-CB 3.43Å; L708-A711 PolarHBondContact O-N 3.36Å
709	P	80.3	Confident	86.3	Confident	118 Å²	118	65.7 Å²	65.7	77%	0.766	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.4	-177.9	26.5	-35.6	0	0	0	113.4	A711	P709-A711 PolarHBondContact O-N 3.39Å
710	E	82.2	Confident	86.3	Confident	65 Å²	65	74.2 Å²	74.2	30%	0.304	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.9	174.4	-60.7	177.8	-160.8	0	0	113.5	R683 L708 Q712 D713 Y714	R683-E710 IonicContact CZ-OE1 3.95Å; R683-E710 IonicContact CZ-OE2 2.69Å; R683-E710 IonicContact NE-OE2 2.71Å; R683-E710 PolarHBondContact NE-OE2 3.19Å; R683-E710 IonicContact NH2-OE1 3.96Å; R683-E710 PolarHBondContact NH2-OE1 3.12Å; R683-E710 IonicContact NH2-OE2 2.71Å; R683-E710 PolarHBondContact NH2-OE2 3.41Å; L708-E710 PolarHBondContact O-N 2.85Å; L708-E710 VanDerWaalsContact O-N 3.08Å; E710-Q712 VanDerWaalsContact C-N 3.29Å; E710-Q712 PolarHBondContact O-N 2.96Å; E710-D713 WeakPolarHBondContact O-CB 3.41Å; E710-D713 PolarHBondContact O-N 2.86Å; E710-Y714 HydrophobicContact CB-CD2 4.04Å; E710-Y714 HydrophobicContact CB-CE2 3.46Å; E710-Y714 VanDerWaalsContact CB-CE2 3.46Å; E710-Y714 HydrophobicContact CG-CE2 4.46Å; E710-Y714 WeakPolarHBondContact O-CD2 3.22Å; E710-Y714 PolarHBondContact O-N 2.69Å; E710-Y714 WeakPolarHBondContact OE2-CE2 3.41Å; E710-Y714 PolarHBondContact OE2-OH 3.45Å
711	A	83	Confident	86.2	Confident	13 Å²	13	73.6 Å²	73.6	11%	0.107	37%	0.368	C	S	.	.	H	α-helix	trans	-55.9	-42.1	-178.1	0	0	0	0	0	112.8	S703 L708 P709 D713 Y714 I715	S703-A711 WeakPolarHBondContact OG-CA 3.31Å; S703-A711 WeakPolarHBondContact OG-CB 3.29Å; L708-A711 VanDerWaalsContact O-CB 3.29Å; L708-A711 WeakPolarHBondContact O-CB 3.43Å; L708-A711 PolarHBondContact O-N 3.36Å; P709-A711 PolarHBondContact O-N 3.39Å; A711-D713 VanDerWaalsContact C-N 3.3Å; A711-D713 PolarHBondContact O-N 3.04Å; A711-Y714 PolarHBondContact O-N 3.45Å; A711-I715 WeakPolarHBondContact O-CB 3.41Å; A711-I715 WeakPolarHBondContact O-CD1 3.47Å; A711-I715 VanDerWaalsContact O-CG1 3.22Å; A711-I715 WeakPolarHBondContact O-CG1 3.35Å; A711-I715 PolarHBondContact O-N 3.2Å
712	Q	84	Confident	86.3	Confident	131 Å²	131	69.8 Å²	69.8	61%	0.612	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-36.4	177.2	-64.4	-62.7	-23.2	0	0	112	E710 I715 T716	E710-Q712 VanDerWaalsContact C-N 3.29Å; E710-Q712 PolarHBondContact O-N 2.96Å; Q712-I715 PolarHBondContact O-N 3.4Å; Q712-T716 WeakPolarHBondContact O-CG2 3.09Å; Q712-T716 PolarHBondContact O-N 3.18Å; Q712-T716 PolarHBondContact O-OG1 3.01Å
713	D	87.4	Confident	86.3	Confident	97 Å²	97	76.7 Å²	76.7	52%	0.519	39%	0.386	S	S	.	.	H	α-helix	trans	-67.4	-41.7	175.9	-77.7	-8.5	0	0	0	111.7	E710 A711 T716 K717	E710-D713 WeakPolarHBondContact O-CB 3.41Å; E710-D713 PolarHBondContact O-N 2.86Å; A711-D713 VanDerWaalsContact C-N 3.3Å; A711-D713 PolarHBondContact O-N 3.04Å; D713-T716 PolarHBondContact O-N 3.25Å; D713-T716 PolarHBondContact O-OG1 3.18Å; D713-K717 WeakPolarHBondContact O-CD 3.49Å; D713-K717 VanDerWaalsContact O-CG 3.25Å; D713-K717 WeakPolarHBondContact O-CG 3.43Å; D713-K717 PolarHBondContact O-N 2.98Å
714	Y	87	Confident	86.3	Confident	18 Å²	18	80.1 Å²	80.1	7%	0.071	40%	0.404	C	S	.	.	H	α-helix	trans	-68	-39.1	175.5	-60.9	-61.1	0	0	0	112	L696 L699 E710 A711 T716 K717 L718	L696-Y714 HydrophobicContact CD2-CD1 4.27Å; L699-Y714 HydrophobicContact CB-CD1 4.14Å; L699-Y714 HydrophobicContact CB-CD2 4.35Å; L699-Y714 HydrophobicContact CB-CG 4.07Å; L699-Y714 HydrophobicContact CD1-CD1 3.98Å; L699-Y714 HydrophobicContact CD1-CE1 3.87Å; E710-Y714 HydrophobicContact CB-CD2 4.04Å; E710-Y714 HydrophobicContact CB-CE2 3.46Å; E710-Y714 VanDerWaalsContact CB-CE2 3.46Å; E710-Y714 HydrophobicContact CG-CE2 4.46Å; E710-Y714 WeakPolarHBondContact O-CD2 3.22Å; E710-Y714 PolarHBondContact O-N 2.69Å; E710-Y714 WeakPolarHBondContact OE2-CE2 3.41Å; E710-Y714 PolarHBondContact OE2-OH 3.45Å; A711-Y714 PolarHBondContact O-N 3.45Å; Y714-T716 VanDerWaalsContact C-N 3.34Å; Y714-T716 PolarHBondContact O-N 3.16Å; Y714-K717 HydrophobicContact CD1-CD 4.19Å; Y714-K717 PolarHBondContact O-N 3.48Å; Y714-L718 WeakPolarHBondContact O-CB 3.39Å; Y714-L718 PolarHBondContact O-N 2.92Å
715	I	87.7	Confident	86.1	Confident	44 Å²	44	82.2 Å²	82.2	23%	0.226	41%	0.406	C	S	.	.	H	α-helix	trans	-59.9	-42.6	174.5	-69.5	163.5	0	0	0	111.2	V700 A711 Q712 K719	V700-I715 HydrophobicContact CB-CG1 4.45Å; V700-I715 HydrophobicContact CG1-CD1 4.34Å; V700-I715 HydrophobicContact CG1-CG1 3.68Å; V700-I715 HydrophobicContact CG2-CG1 3.85Å; A711-I715 WeakPolarHBondContact O-CB 3.41Å; A711-I715 WeakPolarHBondContact O-CD1 3.47Å; A711-I715 VanDerWaalsContact O-CG1 3.22Å; A711-I715 WeakPolarHBondContact O-CG1 3.35Å; A711-I715 PolarHBondContact O-N 3.2Å; Q712-I715 PolarHBondContact O-N 3.4Å; I715-K719 HydrophobicContact CG2-CD 4.18Å; I715-K719 WeakPolarHBondContact O-CG 3.29Å; I715-K719 PolarHBondContact O-N 3.35Å; I715-K719 VanDerWaalsContact O-N 3.11Å
716	T	88.6	Confident	86	Confident	62 Å²	62	82.2 Å²	82.2	38%	0.38	40%	0.402	S	S	.	.	H	α-helix	trans	-70.3	-33.8	177.5	62.9	0	0	0	0	112.8	Q712 D713 Y714 R720	Q712-T716 WeakPolarHBondContact O-CG2 3.09Å; Q712-T716 PolarHBondContact O-N 3.18Å; Q712-T716 PolarHBondContact O-OG1 3.01Å; D713-T716 PolarHBondContact O-N 3.25Å; D713-T716 PolarHBondContact O-OG1 3.18Å; Y714-T716 VanDerWaalsContact C-N 3.34Å; Y714-T716 PolarHBondContact O-N 3.16Å; T716-R720 VanDerWaalsContact O-CG 3.31Å; T716-R720 WeakPolarHBondContact O-CG 3.29Å; T716-R720 PolarHBondContact O-N 3.11Å
717	K	88	Confident	86	Confident	60 Å²	60	80.8 Å²	80.8	26%	0.261	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-46	173	-71.1	164.8	-172.1	164.3	0	111.8	L696 D713 Y714 K719 R720 A721	L696-K717 HydrophobicContact CD1-CB 4.3Å; L696-K717 HydrophobicContact CD2-CB 3.78Å; L696-K717 HydrophobicContact CD2-CD 4.35Å; D713-K717 WeakPolarHBondContact O-CD 3.49Å; D713-K717 VanDerWaalsContact O-CG 3.25Å; D713-K717 WeakPolarHBondContact O-CG 3.43Å; D713-K717 PolarHBondContact O-N 2.98Å; Y714-K717 HydrophobicContact CD1-CD 4.19Å; Y714-K717 PolarHBondContact O-N 3.48Å; K717-K719 PolarHBondContact O-N 2.62Å; K717-R720 WeakPolarHBondContact O-CA 3.41Å; K717-R720 WeakPolarHBondContact O-CB 3.3Å; K717-R720 PolarHBondContact O-N 3.45Å; K717-A721 PolarHBondContact O-N 3.33Å
718	L	88.7	Confident	86	Confident	24 Å²	24	79.5 Å²	79.5	13%	0.126	39%	0.385	C	S	.	.	H	α-helix	trans	-56.1	-52	176.6	178.8	143.2	0	0	0	111.1	L696 Q697 V700 Y714 R720 A721 E722	L696-L718 HydrophobicContact CB-CB 4.22Å; L696-L718 HydrophobicContact CB-CD1 4.32Å; Q697-L718 HydrophobicContact CB-CD1 4.28Å; Q697-L718 HydrophobicContact CG-CD1 3.56Å; V700-L718 HydrophobicContact CG2-CD1 4.2Å; Y714-L718 WeakPolarHBondContact O-CB 3.39Å; Y714-L718 PolarHBondContact O-N 2.92Å; L718-R720 PolarHBondContact O-N 3.07Å; L718-R720 VanDerWaalsContact O-N 3.09Å; L718-A721 PolarHBondContact O-N 2.93Å; L718-E722 VanDerWaalsContact CD2-CD 3.47Å; L718-E722 HydrophobicContact CD2-CG 4.41Å; L718-E722 WeakPolarHBondContact CD2-OE1 3.35Å; L718-E722 WeakPolarHBondContact CD2-OE2 3.36Å; L718-E722 WeakPolarHBondContact O-CG 3.34Å; L718-E722 PolarHBondContact O-N 3.11Å
719	K	88.9	Confident	85.7	Confident	121 Å²	121	81.5 Å²	81.5	53%	0.526	39%	0.393	S	S	.	.	H	α-helix	trans	-59.8	-23.4	176.1	-71.9	173.9	-179.7	173.9	0	113.8	I715 K717 K723	I715-K719 HydrophobicContact CG2-CD 4.18Å; I715-K719 WeakPolarHBondContact O-CG 3.29Å; I715-K719 PolarHBondContact O-N 3.35Å; I715-K719 VanDerWaalsContact O-N 3.11Å; K717-K719 PolarHBondContact O-N 2.62Å; K719-K723 WeakPolarHBondContact O-CD 3.49Å; K719-K723 VanDerWaalsContact O-CG 3.24Å; K719-K723 WeakPolarHBondContact O-CG 3.41Å
720	R	88.2	Confident	85.8	Confident	182 Å²	182	82.3 Å²	82.3	69%	0.687	39%	0.387	S	S	*	.	H	α-helix	trans	-81.4	-44.1	172.7	-71.8	170.8	-176.7	174.6	4.3	111.5	T716 K717 L718 K723 L724	T716-R720 VanDerWaalsContact O-CG 3.31Å; T716-R720 WeakPolarHBondContact O-CG 3.29Å; T716-R720 PolarHBondContact O-N 3.11Å; K717-R720 WeakPolarHBondContact O-CA 3.41Å; K717-R720 WeakPolarHBondContact O-CB 3.3Å; K717-R720 PolarHBondContact O-N 3.45Å; L718-R720 PolarHBondContact O-N 3.07Å; L718-R720 VanDerWaalsContact O-N 3.09Å; R720-K723 PolarHBondContact O-N 3.09Å; R720-L724 WeakPolarHBondContact O-CB 3.48Å; R720-L724 PolarHBondContact O-N 3.41Å
721	A	86.7	Confident	85.6	Confident	15 Å²	15	88 Å²	88	12%	0.124	41%	0.405	C	S	.	.	H	α-helix	trans	-63.5	-43.6	179.2	0	0	0	0	0	112.2	I693 L696 K717 L718 L724 K725	I693-A721 HydrophobicContact CG1-CB 4.02Å; L696-A721 HydrophobicContact CD1-CB 3.9Å; K717-A721 PolarHBondContact O-N 3.33Å; L718-A721 PolarHBondContact O-N 2.93Å; A721-L724 WeakPolarHBondContact O-CB 3.39Å; A721-L724 PolarHBondContact O-N 3.35Å; A721-L724 VanDerWaalsContact O-N 3.16Å; A721-K725 PolarHBondContact O-N 3.42Å
722	E	88.4	Confident	85.2	Confident	65 Å²	65	97 Å²	97	30%	0.304	44%	0.436	S	S	.	.	H	α-helix	trans	-61.5	-46.5	176.2	-69.3	174.7	152.5	0	0	112.2	I693 L718 L724 K725 Q726	I693-E722 HydrophobicContact CD1-CG 4.39Å; I693-E722 HydrophobicContact CG2-CG 4.38Å; L718-E722 VanDerWaalsContact CD2-CD 3.47Å; L718-E722 HydrophobicContact CD2-CG 4.41Å; L718-E722 WeakPolarHBondContact CD2-OE1 3.35Å; L718-E722 WeakPolarHBondContact CD2-OE2 3.36Å; L718-E722 WeakPolarHBondContact O-CG 3.34Å; L718-E722 PolarHBondContact O-N 3.11Å; E722-L724 VanDerWaalsContact C-N 3.26Å; E722-L724 PolarHBondContact O-N 2.95Å; E722-K725 PolarHBondContact O-N 3.38Å; E722-Q726 WeakPolarHBondContact O-CG 3.41Å; E722-Q726 PolarHBondContact O-N 2.85Å
723	K	87.8	Confident	84.7	Confident	150 Å²	150	96 Å²	96	65%	0.652	44%	0.435	S	S	*	.	H	α-helix	trans	-59.5	-37.3	174.1	-75.2	178.5	-178.4	-174.2	0	112	K719 R720 A727	K719-K723 WeakPolarHBondContact O-CD 3.49Å; K719-K723 VanDerWaalsContact O-CG 3.24Å; K719-K723 WeakPolarHBondContact O-CG 3.41Å; R720-K723 PolarHBondContact O-N 3.09Å; K723-A727 WeakPolarHBondContact O-CB 3.34Å; K723-A727 PolarHBondContact O-N 3.25Å
724	L	86.6	Confident	84.1	Confident	74 Å²	74	94.6 Å²	94.6	39%	0.387	43%	0.432	S	S	.	.	H	α-helix	trans	-67.1	-42.3	176.3	-158.6	86.6	0	0	0	111.6	R720 A721 E722 A727 R728	R720-L724 WeakPolarHBondContact O-CB 3.48Å; R720-L724 PolarHBondContact O-N 3.41Å; A721-L724 WeakPolarHBondContact O-CB 3.39Å; A721-L724 PolarHBondContact O-N 3.35Å; A721-L724 VanDerWaalsContact O-N 3.16Å; E722-L724 VanDerWaalsContact C-N 3.26Å; E722-L724 PolarHBondContact O-N 2.95Å; L724-A727 PolarHBondContact O-N 3.33Å; L724-R728 WeakPolarHBondContact O-CG 3.43Å; L724-R728 PolarHBondContact O-N 3.42Å
725	K	84	Confident	83	Confident	105 Å²	105	97.2 Å²	97.2	46%	0.457	45%	0.451	S	S	.	.	H	α-helix	trans	-62.1	-50.6	174.6	175.7	175.2	171.7	-177.1	0	111.4	I693 A721 E722 A727 R728 E729	I693-K725 HydrophobicContact CD1-CB 3.84Å; I693-K725 HydrophobicContact CD1-CD 3.41Å; I693-K725 VanDerWaalsContact CD1-CD 3.41Å; I693-K725 HydrophobicContact CD1-CG 4.24Å; A721-K725 PolarHBondContact O-N 3.42Å; E722-K725 PolarHBondContact O-N 3.38Å; K725-A727 VanDerWaalsContact C-N 3.29Å; K725-A727 PolarHBondContact O-N 2.96Å; K725-R728 WeakPolarHBondContact O-CA 3.38Å; K725-R728 WeakPolarHBondContact O-CB 3.49Å; K725-R728 PolarHBondContact O-N 3.13Å; K725-E729 WeakPolarHBondContact CE-OE1 3.25Å; K725-E729 HydrophobicContact CG-CG 4.47Å; K725-E729 WeakPolarHBondContact CG-OE1 3.49Å; K725-E729 PolarHBondContact O-N 2.62Å
726	Q	85.1	Confident	81.5	Confident	108 Å²	108	98 Å²	98	51%	0.505	46%	0.46	S	S	.	.	H	α-helix	trans	-55.9	-43.1	176.4	-70.7	172.8	-0.9	0	0	111.7	E722 E729 Q730	E722-Q726 WeakPolarHBondContact O-CG 3.41Å; E722-Q726 PolarHBondContact O-N 2.85Å; Q726-E729 PolarHBondContact O-N 3.08Å; Q726-Q730 WeakPolarHBondContact O-CB 3.3Å; Q726-Q730 VanDerWaalsContact O-CG 3.31Å; Q726-Q730 WeakPolarHBondContact O-CG 3.42Å; Q726-Q730 PolarHBondContact O-N 3.23Å
727	A	85.3	Confident	79.8	Confident	40 Å²	40	100.4 Å²	100.4	33%	0.331	47%	0.47	S	S	.	.	H	α-helix	trans	-66.1	-35.5	175.6	0	0	0	0	0	113.4	K723 L724 K725 R731	K723-A727 WeakPolarHBondContact O-CB 3.34Å; K723-A727 PolarHBondContact O-N 3.25Å; L724-A727 PolarHBondContact O-N 3.33Å; K725-A727 VanDerWaalsContact C-N 3.29Å; K725-A727 PolarHBondContact O-N 2.96Å; A727-R731 VanDerWaalsContact O-CG 3.3Å; A727-R731 WeakPolarHBondContact O-CG 3.35Å; A727-R731 PolarHBondContact O-N 3.3Å
728	R	82.6	Confident	78	Confident	128 Å²	128	107.7 Å²	107.7	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-41.4	173.7	-75.4	174.9	177.4	167.7	3.2	111.6	E691 L724 K725 R731 R732	E691-R728 VanDerWaalsContact CD-NH2 3.29Å; E691-R728 IonicContact OE1-CZ 4Å; E691-R728 IonicContact OE1-NH2 3Å; E691-R728 PolarHBondContact OE1-NH2 2.9Å; E691-R728 IonicContact OE2-CZ 3.21Å; E691-R728 IonicContact OE2-NH1 2.72Å; E691-R728 PolarHBondContact OE2-NH1 3.26Å; E691-R728 IonicContact OE2-NH2 2.77Å; E691-R728 PolarHBondContact OE2-NH2 3.42Å; L724-R728 WeakPolarHBondContact O-CG 3.43Å; L724-R728 PolarHBondContact O-N 3.42Å; K725-R728 WeakPolarHBondContact O-CA 3.38Å; K725-R728 WeakPolarHBondContact O-CB 3.49Å; K725-R728 PolarHBondContact O-N 3.13Å; R728-R731 PolarHBondContact O-N 3.39Å; R728-R732 PolarHBondContact O-N 3.01Å
729	E	79	Confident	75.9	Confident	92 Å²	92	116 Å²	116	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-67	-45.8	178.1	-73.4	169	175.9	0	0	112	K725 Q726 R731 R732 L733	K725-E729 WeakPolarHBondContact CE-OE1 3.25Å; K725-E729 HydrophobicContact CG-CG 4.47Å; K725-E729 WeakPolarHBondContact CG-OE1 3.49Å; K725-E729 PolarHBondContact O-N 2.62Å; Q726-E729 PolarHBondContact O-N 3.08Å; E729-R731 VanDerWaalsContact C-N 3.28Å; E729-R731 PolarHBondContact O-N 2.9Å; E729-R732 PolarHBondContact O-N 3.01Å; E729-R732 VanDerWaalsContact O-N 3.08Å; E729-L733 WeakPolarHBondContact O-CG 3.44Å; E729-L733 PolarHBondContact O-N 3.32Å
730	Q	81.8	Confident	73.8	Confident	135 Å²	135	114.4 Å²	114.4	63%	0.631	53%	0.53	S	S	*	.	H	α-helix	trans	-58.5	-38.2	173.7	-73.2	176.2	3.2	0	0	112.5	Q726 S734	Q726-Q730 WeakPolarHBondContact O-CB 3.3Å; Q726-Q730 VanDerWaalsContact O-CG 3.31Å; Q726-Q730 WeakPolarHBondContact O-CG 3.42Å; Q726-Q730 PolarHBondContact O-N 3.23Å; Q730-S734 WeakPolarHBondContact O-CB 3.34Å; Q730-S734 PolarHBondContact O-N 2.91Å; Q730-S734 PolarHBondContact O-OG 2.85Å
731	R	79.2	Confident	71.6	Confident	184 Å²	184	114.6 Å²	114.6	69%	0.694	54%	0.536	S	S	*	.	H	α-helix	trans	-66.2	-39.4	173.1	-75.4	177	-173.2	-173.1	3.7	112.7	A727 R728 E729 S734 T735	A727-R731 VanDerWaalsContact O-CG 3.3Å; A727-R731 WeakPolarHBondContact O-CG 3.35Å; A727-R731 PolarHBondContact O-N 3.3Å; R728-R731 PolarHBondContact O-N 3.39Å; E729-R731 VanDerWaalsContact C-N 3.28Å; E729-R731 PolarHBondContact O-N 2.9Å; R731-S734 WeakPolarHBondContact CA-OG 3.48Å; R731-S734 PolarHBondContact O-OG 2.75Å; R731-T735 WeakPolarHBondContact O-CB 3.46Å; R731-T735 PolarHBondContact O-N 3.46Å; R731-T735 VanDerWaalsContact O-N 3.08Å; R731-T735 PolarHBondContact O-OG1 3.27Å
732	R	74.4	Confident	69.2	Low	202 Å²	202	116.9 Å²	116.9	76%	0.762	56%	0.561	S	S	*	*	H	α-helix	trans	-62.9	-49.2	174.6	-81.8	-175.1	163.5	-169.4	-5.4	111.5	R728 E729 S734 T735 S736	R728-R732 PolarHBondContact O-N 3.01Å; E729-R732 PolarHBondContact O-N 3.01Å; E729-R732 VanDerWaalsContact O-N 3.08Å; R732-S734 PolarHBondContact O-N 3.05Å; R732-T735 PolarHBondContact O-N 3.17Å; R732-T735 VanDerWaalsContact O-N 3.08Å; R732-S736 PolarHBondContact O-N 3.1Å; R732-S736 PolarHBondContact O-OG 2.92Å
733	L	74.2	Confident	66.8	Low	111 Å²	111	121.5 Å²	121.5	58%	0.581	59%	0.587	S	S	*	*	H	α-helix	trans	-60.1	-42.6	178.5	-70.4	164.2	0	0	0	112.9	E729 T735 S736 N737	E729-L733 WeakPolarHBondContact O-CG 3.44Å; E729-L733 PolarHBondContact O-N 3.32Å; L733-T735 VanDerWaalsContact C-N 3.28Å; L733-T735 PolarHBondContact O-N 3.01Å; L733-S736 PolarHBondContact O-OG 3.4Å; L733-N737 WeakPolarHBondContact O-CB 3.43Å; L733-N737 PolarHBondContact O-N 2.86Å; L733-N737 VanDerWaalsContact O-N 3.14Å
734	S	73.5	Confident	64.5	Low	66 Å²	66	120.3 Å²	120.3	46%	0.462	59%	0.592	S	S	.	*	H	α-helix	trans	-72.3	-18.9	176.3	50	0	0	0	0	113.8	Q730 R731 R732	Q730-S734 WeakPolarHBondContact O-CB 3.34Å; Q730-S734 PolarHBondContact O-N 2.91Å; Q730-S734 PolarHBondContact O-OG 2.85Å; R731-S734 WeakPolarHBondContact CA-OG 3.48Å; R731-S734 PolarHBondContact O-OG 2.75Å; R732-S734 PolarHBondContact O-N 3.05Å
735	T	63.7	Low	62.2	Low	74 Å²	74	124.2 Å²	124.2	45%	0.454	61%	0.613	S	S	.	*	H	α-helix	trans	-86	-37.7	173.1	-51.5	0	0	0	0	112.1	R731 R732 L733 R738 R739	R731-T735 WeakPolarHBondContact O-CB 3.46Å; R731-T735 PolarHBondContact O-N 3.46Å; R731-T735 VanDerWaalsContact O-N 3.08Å; R731-T735 PolarHBondContact O-OG1 3.27Å; R732-T735 PolarHBondContact O-N 3.17Å; R732-T735 VanDerWaalsContact O-N 3.08Å; L733-T735 VanDerWaalsContact C-N 3.28Å; L733-T735 PolarHBondContact O-N 3.01Å; T735-R738 PolarHBondContact O-N 3.38Å; T735-R739 PolarHBondContact O-N 3.1Å
736	S	57.1	Low	59.8	Low	61 Å²	61	124.2 Å²	124.2	43%	0.427	63%	0.633	S	S	.	*	H	α-helix	trans	-65.5	-41.4	174.8	58.9	0	0	0	0	111.8	R732 L733 R738 R739 S740	R732-S736 PolarHBondContact O-N 3.1Å; R732-S736 PolarHBondContact O-OG 2.92Å; L733-S736 PolarHBondContact O-OG 3.4Å; S736-R738 PolarHBondContact O-N 3.25Å; S736-R739 PolarHBondContact O-N 3.15Å; S736-S740 PolarHBondContact O-N 3.18Å; S736-S740 VanDerWaalsContact O-N 3.11Å
737	N	52.6	Low	57.5	Low	111 Å²	111	123.8 Å²	123.8	59%	0.594	64%	0.642	S	S	*	*	H	α-helix	trans	-65.4	-17.2	176.8	-75.1	-2.2	0	0	0	114	L733 S740	L733-N737 WeakPolarHBondContact O-CB 3.43Å; L733-N737 PolarHBondContact O-N 2.86Å; L733-N737 VanDerWaalsContact O-N 3.14Å; N737-S740 PolarHBondContact O-OG 3.23Å
738	R	49.5	Very low	55.2	Low	213 Å²	213	132.5 Å²	132.5	80%	0.804	67%	0.666	S	S	*	*	H	α-helix	trans	-86.3	-21.5	169.8	-72.3	-173.7	-173.5	-169.3	2.9	113.5	T735 S736	T735-R738 PolarHBondContact O-N 3.38Å; S736-R738 PolarHBondContact O-N 3.25Å
739	R	45.9	Very low	53	Low	199 Å²	199	132 Å²	132	75%	0.751	68%	0.677	S	S	*	*	H	α-helix	trans	-88.4	-26.3	178.9	-71.7	-174.3	174.3	-172.2	-2.3	113	T735 S736 F741 G742	T735-R739 PolarHBondContact O-N 3.1Å; S736-R739 PolarHBondContact O-N 3.15Å; R739-F741 VanDerWaalsContact C-N 3.27Å; R739-F741 PolarHBondContact O-N 3.2Å; R739-G742 PolarHBondContact O-N 2.97Å
740	S	43.7	Very low	50.9	Low	87 Å²	87	134.3 Å²	134.3	61%	0.608	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-16.3	175	57.5	0	0	0	0	114.7	S736 N737	S736-S740 PolarHBondContact O-N 3.18Å; S736-S740 VanDerWaalsContact O-N 3.11Å; N737-S740 PolarHBondContact O-OG 3.23Å
741	F	41.9	Very low	48.7	Very low	187 Å²	187	131.5 Å²	131.5	82%	0.82	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	4	177.4	-97.1	-84.2	0	0	0	114.6	R739	R739-F741 VanDerWaalsContact C-N 3.27Å; R739-F741 PolarHBondContact O-N 3.2Å
742	G	37.6	Very low	46.7	Very low	62 Å²	62	128.1 Å²	128.1	64%	0.639	71%	0.71	S	S	*	*	S	Bend	trans	-99.6	3.1	-169.4	0	0	0	0	0	117.1	R739	R739-G742 PolarHBondContact O-N 2.97Å
743	L	38.2	Very low	44.9	Very low	162 Å²	162	130 Å²	130	85%	0.848	72%	0.717	S	S	*	*	S	Bend	trans	-130.7	44.5	-167	-86.1	152.5	0	0	0	113.7
744	T	38.1	Very low	43	Very low	126 Å²	126	133.2 Å²	133.2	77%	0.773	73%	0.729	S	S	*	*	S	Bend	trans	-139.4	144.3	160.9	50.5	0	0	0	0	111.3
745	N	38	Very low	41.5	Very low	155 Å²	155	138.1 Å²	138.1	83%	0.829	75%	0.75	S	S	*	*			trans	59.6	82.1	174	-68.4	-6	0	0	0	118.3	S747	N745-S747 PolarHBondContact O-N 3.46Å
746	A	33.6	Very low	40.3	Very low	105 Å²	105	139.9 Å²	139.9	87%	0.868	77%	0.765	S	S	*	*			trans	-66.3	112.1	142.2	0	0	0	0	0	110
747	S	37.9	Very low	39.5	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	79%	0.785	S	S	*	*			trans	177.7	138.9	139.6	46.2	0	0	0	0	114.1	N745	N745-S747 PolarHBondContact O-N 3.46Å
748	R	36.4	Very low	38.8	Very low	224 Å²	224	141.9 Å²	141.9	85%	0.845	79%	0.794	S	S	*	*			trans	79.7	121.7	154.8	-69.6	168.6	178.8	-176.1	-0.7	121.1
749	T	37.9	Very low	38.3	Very low	116 Å²	116	138.6 Å²	138.6	71%	0.712	80%	0.797	S	S	*	*			trans	66.1	102.2	139.9	56.4	0	0	0	0	118.9
750	T	34.4	Very low	37.8	Very low	142 Å²	142	134.1 Å²	134.1	87%	0.871	80%	0.796	S	S	*	*				67.7	116.1	74.9	64.1	0	0	0	0	116
751	G	35.2	Very low	37.6	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	81%	0.809	S	S	*	*			trans	141.5	73.3	172.8	0	0	0	0	0	112.4
752	S	36.4	Very low	37.3	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	81%	0.81	S	S	*	*				56.4	104.2	94.1	-171.4	0	0	0	0	115.6
753	R	37.9	Very low	37.4	Very low	243 Å²	243	137.7 Å²	137.7	92%	0.917	82%	0.815	S	S	*	*				-166.3	147.7	122.3	-114.9	173.8	162.2	147.3	-4.4	113.1
754	E	34.2	Very low	37.2	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	81%	0.812	S	S	*	*			trans	-91.5	160.6	-170.7	-57.8	151.5	132.2	0	0	112.2
755	N	40.6	Very low	37.1	Very low	170 Å²	170	141.4 Å²	141.4	91%	0.909	81%	0.81	S	S	*	*			trans	-156.9	127.4	136.3	-114.3	-5.9	0	0	0	112.8
756	S	39.7	Very low	36.9	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	80%	0.803	S	S	*	*			trans	-63.1	148.5	-173.8	49.8	0	0	0	0	118
757	A	40.5	Very low	37	Very low	102 Å²	102	139 Å²	139	84%	0.843	80%	0.799	S	S	*	*			trans	-157	129	133.9	0	0	0	0	0	112.3
758	S	36.7	Very low	36.9	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	80%	0.798	S	S	*	*			trans	-51.9	151.4	-178.7	52.7	0	0	0	0	118.8
759	V	39.1	Very low	36.8	Very low	144 Å²	144	134 Å²	134	87%	0.873	79%	0.793	S	S	*	*				-166.7	149.8	105.5	148.4	0	0	0	0	110
760	S	36.8	Very low	36.6	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	80%	0.795	S	S	*	*			trans	-104.6	146.7	-158.9	52.1	0	0	0	0	116.3
761	S	39	Very low	36.5	Very low	124 Å²	124	137.2 Å²	137.2	87%	0.867	79%	0.787	S	S	*	*			trans	-150.7	136.2	130.3	57.6	0	0	0	0	111.4
762	E	35.4	Very low	36.4	Very low	183 Å²	183	140.9 Å²	140.9	86%	0.855	79%	0.789	S	S	*	*			trans	-86	159.2	-177.2	-57	165.5	129.3	0	0	109.4
763	S	38.7	Very low	36.3	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	79%	0.792	S	S	*	*				-177.6	147.4	54.1	38.1	0	0	0	0	113.6
764	R	35.2	Very low	36	Very low	207 Å²	207	142 Å²	142	78%	0.781	79%	0.789	S	S	*	*			trans	64.2	110.3	147.8	-68.2	-163.5	164.3	128.2	4.1	119.3
765	E	35	Very low	35.6	Very low	159 Å²	159	138.8 Å²	138.8	74%	0.743	79%	0.786	S	S	*	*				76.1	133.3	88	-72.2	160.9	-154.8	0	0	112
766	S	33.9	Very low	35.3	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	77%	0.773	S	S	*	*			cis	-170.5	156.5	-4	46.6	0	0	0	0	109.2
767	S	35.5	Very low	34.8	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	77%	0.774	S	S	*	*			trans	42	137.9	150.8	56	0	0	0	0	121.5
768	A	35.6	Very low	34.2	Very low	80 Å²	80	138 Å²	138	66%	0.661	76%	0.764	S	S	*	*			cis	-171.2	162.2	0.8	0	0	0	0	0	111.1
769	N	34.2	Very low	34	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	77%	0.765	S	S	*	*			trans	70.9	140.9	140.9	-75.9	1	0	0	0	123.6
770	Y	34.2	Very low	33.7	Very low	193 Å²	193	142.3 Å²	142.3	76%	0.757	76%	0.759	S	S	*	*			trans	74.7	100.3	154.4	-77.7	-67.3	0	0	0	121.1
771	D	33.3	Very low	33.5	Very low	131 Å²	131	144.4 Å²	144.4	70%	0.701	77%	0.768	S	S	*	*				50	113.4	128.4	-63.8	-15.1	0	0	0	122.1
772	N	33	Very low	33.2	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	77%	0.765	S	S	*	*			trans	18.4	102.7	132.9	-75.9	-15.6	0	0	0	118.5
773	H	33.6	Very low	33.1	Very low	184 Å²	184	143.2 Å²	143.2	85%	0.852	76%	0.761	S	S	*	*				-170	121	118.5	-101.6	-72.9	0	0	0	108.9
774	F	31	Very low	32.8	Very low	195 Å²	195	146.4 Å²	146.4	86%	0.855	76%	0.761	S	S	*	*			trans	-142.5	98.8	171.2	-111.2	-78.6	0	0	0	113	V776	F774-V776 HydrophobicContact CD1-CB 4.12Å; F774-V776 HydrophobicContact CE1-CB 4.21Å; F774-V776 HydrophobicContact CE1-CG2 4.31Å
775	S	26.3	Very low	32.7	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	76%	0.758	S	S	*	*			trans	-80.7	137.1	139.8	55.8	0	0	0	0	109
776	V	34.3	Very low	32.6	Very low	106 Å²	106	141.8 Å²	141.8	64%	0.642	76%	0.757	S	S	*	*			trans	179.4	115.8	155.7	138.4	0	0	0	0	106.6	F774	F774-V776 HydrophobicContact CD1-CB 4.12Å; F774-V776 HydrophobicContact CE1-CB 4.21Å; F774-V776 HydrophobicContact CE1-CG2 4.31Å
777	Q	30.4	Very low	32.5	Very low	166 Å²	166	142 Å²	142	78%	0.776	76%	0.759	S	S	*	*				65.3	108.3	82.3	-85.9	-171.2	-6.3	0	0	116.7
778	S	27.7	Very low	32.3	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	75%	0.754	S	S	*	*			trans	67.8	129.9	138.6	76.4	0	0	0	0	121.4
779	K	32.4	Very low	32	Very low	185 Å²	185	147.8 Å²	147.8	80%	0.804	76%	0.762	S	S	*	*				174.4	112.2	121.1	-91.6	153.8	-171.4	174.8	0	109
780	H	31.3	Very low	31.8	Very low	162 Å²	162	148.9 Å²	148.9	75%	0.75	76%	0.762	S	S	*	*				67	105	92.4	-85	-61.7	0	0	0	116
781	T	33.9	Very low	31.6	Very low	150 Å²	150	146.4 Å²	146.4	92%	0.92	77%	0.767	S	S	*	*			trans	-141	145.7	140.9	46.3	0	0	0	0	109.9
782	H	32.3	Very low	31.3	Very low	172 Å²	172	149 Å²	149	80%	0.796	78%	0.775	S	S	*	*			trans	-100.1	148.6	-172.2	-79.7	-63	0	0	0	113.7
783	S	32.6	Very low	31.1	Very low	110 Å²	110	145.8 Å²	145.8	77%	0.769	77%	0.77	S	S	*	*				-177.9	112.9	125.4	-163	0	0	0	0	109.3
784	K	33.2	Very low	30.9	Very low	172 Å²	172	147.7 Å²	147.7	75%	0.748	77%	0.769	S	S	*	*				46.5	115.3	81.4	-75.7	-169.1	178.9	-177.7	0	112.7
785	N	33.7	Very low	30.9	Very low	133 Å²	133	146.7 Å²	146.7	71%	0.711	77%	0.765	S	S	*	*			cis	-167.3	159.5	45.1	-91.9	-22.6	0	0	0	113.9
786	N	33.2	Very low	30.8	Very low	135 Å²	135	149.7 Å²	149.7	72%	0.722	77%	0.767	S	S	*	*			trans	53.5	113.1	143.5	-69.5	5.6	0	0	0	120.6
787	S	31.5	Very low	30.6	Very low	100 Å²	100	151.3 Å²	151.3	70%	0.699	78%	0.777	S	S	*	*				67.9	132.8	76.3	82	0	0	0	0	114.1
788	S	30	Very low	30.4	Very low	100 Å²	100	146.9 Å²	146.9	70%	0.699	78%	0.776	S	S	*	*			cis	-176.8	170.5	4.1	50.1	0	0	0	0	111.1
789	R	30.5	Very low	30.5	Very low	216 Å²	216	151 Å²	151	82%	0.815	79%	0.79	S	S	*	*			trans	77.5	120.3	161.3	-75.9	179.4	165.9	159.2	-2.6	120.3
790	Q	28.7	Very low	30.2	Very low	162 Å²	162	146.8 Å²	146.8	76%	0.757	78%	0.784	S	S	*	*				38.5	123.5	120	-59.9	172.3	-41	0	0	116.9
791	T	31.5	Very low	30	Very low	140 Å²	140	147.9 Å²	147.9	86%	0.859	79%	0.786	S	S	*	*				-161.2	168.2	68.4	16.8	0	0	0	0	114.4
792	E	26.6	Very low	29.9	Very low	185 Å²	185	148 Å²	148	86%	0.864	78%	0.781	S	S	*	*			trans	-62.1	160.6	-176.1	-48.8	170.6	130.4	0	0	117.7
793	A	28.5	Very low	29.7	Very low	86 Å²	86	146.4 Å²	146.4	71%	0.711	78%	0.777	S	S	*	*			trans	92.4	122.8	131.6	0	0	0	0	0	122.6
794	R	28.9	Very low	29.7	Very low	224 Å²	224	147.7 Å²	147.7	85%	0.845	78%	0.775	S	S	*	*			trans	91.7	112.2	139.7	-75.2	171.3	177	-172.2	1.4	121.4
795	K	30.8	Very low	29.4	Very low	174 Å²	174	145.8 Å²	145.8	76%	0.757	77%	0.773	S	S	*	*				78.5	119.1	129.3	-68.2	-174.7	170.3	-163.7	0	119.7
796	E	25.4	Very low	29.4	Very low	174 Å²	174	148.1 Å²	148.1	81%	0.813	78%	0.78	S	S	*	*				6.6	122.4	123.7	-55.1	167.5	154.9	0	0	114.2
797	T	29.5	Very low	29.3	Very low	139 Å²	139	152.6 Å²	152.6	85%	0.853	79%	0.788	S	S	*	*				-157.9	155.2	64.9	42.1	0	0	0	0	112
798	G	27.1	Very low	29.5	Very low	73 Å²	73	155.5 Å²	155.5	75%	0.753	79%	0.794	S	S	*	*			trans	-66.8	169.4	-165.5	0	0	0	0	0	118.7
799	L	29.4	Very low	29.6	Very low	179 Å²	179	159.6 Å²	159.6	94%	0.937	80%	0.799	S	S	*	*			trans	-152.3	151.2	148.1	-105.2	156.7	0	0	0	107.8
800	S	25.3	Very low	30	Very low	97 Å²	97	158.1 Å²	158.1	68%	0.678	80%	0.795	S	S	*	*			trans	-102.6	158.6	-174.1	55	0	0	0	0	112
801	K	27.4	Very low	30.6	Very low	185 Å²	185	156.6 Å²	156.6	80%	0.804	79%	0.792	S	S	*	*			trans	74.1	105.4	174	-55.1	178.5	177.6	-178.4	0	115.9
802	D	31.6	Very low	31.2	Very low	151 Å²	151	154.5 Å²	154.5	81%	0.807	78%	0.776	S	S	*	*				-164.5	114.2	119.6	-80	-31.5	0	0	0	104.1
803	I	29	Very low	32.4	Very low	139 Å²	139	151.2 Å²	151.2	71%	0.713	77%	0.77	S	S	*	*				51.3	87	77.7	-54.4	170.6	0	0	0	110.6
804	D	31.5	Very low	33	Very low	137 Å²	137	153.6 Å²	153.6	73%	0.733	77%	0.77	S	S	*	*				-176	162.8	100.9	-115.8	-44.2	0	0	0	115.2
805	N	27.6	Very low	33.9	Very low	132 Å²	132	145.7 Å²	145.7	71%	0.706	76%	0.759	S	S	*	*			trans	-57.6	120.7	-175.3	-63.1	-85.3	0	0	0	116.6
806	E	33.8	Very low	34.6	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	76%	0.764	S	S	*	*			trans	-133.9	126.8	146.8	-81.7	-161.8	145.1	0	0	111.8	I808	E806-I808 PolarHBondContact O-N 3.24Å; E806-I808 VanDerWaalsContact O-N 3.08Å
807	Y	31.2	Very low	35.5	Very low	229 Å²	229	141.1 Å²	141.1	90%	0.898	77%	0.765	S	S	*	*			trans	-75.7	89.9	-179.7	-92.4	-106	0	0	0	111.3	K809	Y807-K809 PolarHBondContact O-N 3.15Å
808	I	34.4	Very low	36	Very low	161 Å²	161	141 Å²	141	83%	0.826	76%	0.764	S	S	*	*			trans	-79.4	107.4	167.2	-59.6	-179.2	0	0	0	109	E806 Y810	E806-I808 PolarHBondContact O-N 3.24Å; E806-I808 VanDerWaalsContact O-N 3.08Å; I808-Y810 PolarHBondContact O-N 3.13Å; I808-Y810 VanDerWaalsContact O-N 3.13Å
809	K	33.6	Very low	36.3	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	77%	0.77	S	S	*	*			trans	-78.2	93.8	-177.3	-164.6	178.3	-173.6	-178.7	0	110.5	Y807 N811	Y807-K809 PolarHBondContact O-N 3.15Å; K809-N811 PolarHBondContact O-N 3.19Å
810	Y	37.3	Very low	36.5	Very low	185 Å²	185	147 Å²	147	73%	0.725	76%	0.759	S	S	*	*			trans	-67.3	115.3	172.4	-173.7	-95.4	0	0	0	109.9	I808 D812	I808-Y810 PolarHBondContact O-N 3.13Å; I808-Y810 VanDerWaalsContact O-N 3.13Å; Y810-D812 HydrophobicContact CE1-CB 4.24Å
811	N	43	Very low	37	Very low	130 Å²	130	147.5 Å²	147.5	70%	0.695	76%	0.76	S	S	*	*			trans	-96.2	121.9	164.4	-77.8	-12.1	0	0	0	107.3	K809	K809-N811 PolarHBondContact O-N 3.19Å
812	D	43.3	Very low	37.3	Very low	97 Å²	97	150.8 Å²	150.8	52%	0.519	77%	0.768	S	S	.	*			trans	-63.4	125.8	174.1	-163.8	-21.1	0	0	0	109.8	Y810 L814	Y810-D812 HydrophobicContact CE1-CB 4.24Å; D812-L814 PolarHBondContact O-N 3.34Å; D812-L814 WeakPolarHBondContact OD1-CB 3.26Å; D812-L814 PolarHBondContact OD1-N 2.93Å
813	P	50.9	Low	37.3	Very low	115 Å²	115	149.5 Å²	149.5	75%	0.747	77%	0.766	S	S	*	*	S	Bend	trans	-70.2	-14.6	173.2	29.6	-35.8	0	0	0	112.9
814	L	41	Very low	37.2	Very low	136 Å²	136	148 Å²	148	71%	0.712	77%	0.774	S	S	*	*	S	Bend	trans	-86	120.3	172.3	-61.8	166.5	0	0	0	109.2	D812	D812-L814 PolarHBondContact O-N 3.34Å; D812-L814 WeakPolarHBondContact OD1-CB 3.26Å; D812-L814 PolarHBondContact OD1-N 2.93Å
815	G	49.4	Very low	37.1	Very low	59 Å²	59	145.7 Å²	145.7	61%	0.608	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-61.6	166.7	172.8	0	0	0	0	0	112.2	S817	G815-S817 PolarHBondContact O-N 3.41Å; G815-S817 VanDerWaalsContact O-N 3.14Å
816	P	45.3	Very low	37.1	Very low	133 Å²	133	151 Å²	151	86%	0.864	78%	0.784	S	S	*	*	S	Bend	trans	-54.9	123.5	-179.7	24.1	-34.1	0	0	0	110.6
817	S	42.7	Very low	36.8	Very low	119 Å²	119	148.6 Å²	148.6	83%	0.832	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-61.9	136.4	-172.4	46.1	0	0	0	0	112.2	G815	G815-S817 PolarHBondContact O-N 3.41Å; G815-S817 VanDerWaalsContact O-N 3.14Å
818	V	40	Very low	36.8	Very low	137 Å²	137	144.4 Å²	144.4	83%	0.83	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-71.6	133.9	178	179.6	0	0	0	0	109.2	R820	V818-R820 PolarHBondContact O-N 3.18Å
819	E	34.5	Very low	36.3	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	76%	0.757	S	S	*	*			trans	-60.1	107.5	176.4	-70.5	-174.4	133.9	0	0	110.7
820	R	34.3	Very low	36.1	Very low	188 Å²	188	137.9 Å²	137.9	71%	0.709	75%	0.746	S	S	*	*			trans	-60.5	130	176.3	-160.8	175.8	-167	174.9	7.5	109.3	D6 V818 R822	D6-R820 IonicContact OD2-CZ 3.71Å; D6-R820 IonicContact OD2-NH2 2.69Å; D6-R820 PolarHBondContact OD2-NH2 3.11Å; V818-R820 PolarHBondContact O-N 3.18Å; R820-R822 PolarHBondContact O-N 3.34Å
821	P	34.5	Very low	35.7	Very low	108 Å²	108	136 Å²	136	70%	0.701	74%	0.744	S	S	*	*			trans	-62.3	134.5	177.6	25.7	-33.6	0	0	0	109.9	T823	P821-T823 VanDerWaalsContact C-N 3.34Å; P821-T823 PolarHBondContact O-N 3.17Å
822	R	33.3	Very low	35.1	Very low	254 Å²	254	135.1 Å²	135.1	96%	0.958	74%	0.74	S	S	*	*			trans	-70.5	84.5	-179.9	-73.4	-179.4	167.8	-165.6	-7.2	111.4	R820	R820-R822 PolarHBondContact O-N 3.34Å
823	T	32.3	Very low	34.7	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	75%	0.748	S	S	*	*			trans	-66.5	138.1	155.2	27.3	0	0	0	0	109.3	P821 A825	P821-T823 VanDerWaalsContact C-N 3.34Å; P821-T823 PolarHBondContact O-N 3.17Å; T823-A825 PolarHBondContact O-N 2.92Å
824	A	27.6	Very low	34.2	Very low	107 Å²	107	135.6 Å²	135.6	88%	0.884	73%	0.731	S	S	*	*			trans	-79.1	77	-166.6	0	0	0	0	0	112.7
825	A	29.6	Very low	33.9	Very low	89 Å²	89	131.6 Å²	131.6	74%	0.736	72%	0.718	S	S	*	*			trans	-63	137.3	158.9	0	0	0	0	0	109.2	T823 T827	T823-A825 PolarHBondContact O-N 2.92Å; A825-T827 PolarHBondContact O-N 3.33Å
826	R	27.4	Very low	32.9	Very low	243 Å²	243	134.8 Å²	134.8	92%	0.917	72%	0.721	S	S	*	*			trans	-56.6	109	177.9	-74.8	175.9	171.5	170.2	-3.1	109.5	R828	R826-R828 PolarHBondContact O-N 3.41Å; R826-R828 VanDerWaalsContact O-N 3.09Å
827	T	27.3	Very low	32.3	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	71%	0.711	S	S	*	*			trans	-57.2	116	161.4	40.2	0	0	0	0	107.7	A825 S829	A825-T827 PolarHBondContact O-N 3.33Å; T827-S829 PolarHBondContact O-N 3.42Å
828	R	30.3	Very low	31.8	Very low	142 Å²	142	138.3 Å²	138.3	54%	0.536	71%	0.713	S	S	.	*			trans	-53.6	114.9	160.3	-73.8	-173.7	-175.3	-170.2	1.2	106.1	D599 E602 R826 I830	D599-R828 IonicContact OD1-CZ 2.65Å; D599-R828 IonicContact OD1-NH2 2.78Å; D599-R828 PolarHBondContact OD1-NH2 3.01Å; E602-R828 IonicContact OE1-CZ 3.01Å; E602-R828 IonicContact OE1-NH1 3.86Å; E602-R828 PolarHBondContact OE1-NH1 2.93Å; E602-R828 IonicContact OE2-CZ 2.7Å; E602-R828 IonicContact OE2-NH1 2.85Å; E602-R828 PolarHBondContact OE2-NH1 3Å; E602-R828 IonicContact OE2-NH2 2.67Å; E602-R828 PolarHBondContact OE2-NH2 2.87Å; R826-R828 PolarHBondContact O-N 3.41Å; R826-R828 VanDerWaalsContact O-N 3.09Å; R828-I830 PolarHBondContact O-N 2.96Å
829	S	24.5	Very low	31.4	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	71%	0.709	S	S	*	*			trans	-68.4	94.8	167.3	50.5	0	0	0	0	106.6	T827 Q831	T827-S829 PolarHBondContact O-N 3.42Å; S829-Q831 PolarHBondContact O-N 3.13Å
830	I	30.1	Very low	31.2	Very low	114 Å²	114	133.2 Å²	133.2	59%	0.585	69%	0.691	S	S	*	*			trans	-59.2	92.5	141.3	-59	173.9	0	0	0	103.4	R828	R828-I830 PolarHBondContact O-N 2.96Å
831	Q	27.5	Very low	31.2	Very low	146 Å²	146	132.7 Å²	132.7	68%	0.682	70%	0.697	S	S	*	*			trans	-60.3	156.1	160.1	-74.5	-176.9	-79.2	0	0	107.2	S829 D833	S829-Q831 PolarHBondContact O-N 3.13Å; Q831-D833 PolarHBondContact O-N 2.95Å
832	D	31.8	Very low	31.4	Very low	112 Å²	112	134.3 Å²	134.3	60%	0.599	70%	0.7	S	S	*	*	S	Bend	trans	-70.8	41.2	-164.3	-97.1	-50.1	0	0	0	114.8	F834 A835 D836	D832-F834 PolarHBondContact O-N 3.26Å; D832-A835 HydrophobicContact CB-CB 3.99Å; D832-A835 WeakPolarHBondContact O-CA 3.43Å; D832-A835 PolarHBondContact O-N 2.7Å; D832-D836 PolarHBondContact O-N 3.46Å
833	D	34.5	Very low	31.6	Very low	129 Å²	129	128.7 Å²	128.7	69%	0.69	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	0.7	173.4	-67	-7	0	0	0	113.4	Q831	Q831-D833 PolarHBondContact O-N 2.95Å
834	F	40	Very low	31.9	Very low	92 Å²	92	130.6 Å²	130.6	40%	0.404	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	-5.3	167.9	-79.5	-86.9	0	0	0	113.8	I636 D832	I636-F834 HydrophobicContact CD1-CZ 4.24Å; I636-F834 HydrophobicContact CG2-CZ 4.44Å; D832-F834 PolarHBondContact O-N 3.26Å
835	A	34.4	Very low	32.3	Very low	53 Å²	53	131.2 Å²	131.2	44%	0.438	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.6	-34.4	176.7	0	0	0	0	0	112.9	D832 E837	D832-A835 HydrophobicContact CB-CB 3.99Å; D832-A835 WeakPolarHBondContact O-CA 3.43Å; D832-A835 PolarHBondContact O-N 2.7Å; A835-E837 PolarHBondContact O-N 2.93Å
836	D	29.4	Very low	32.8	Very low	126 Å²	126	138.6 Å²	138.6	67%	0.674	72%	0.715	S	S	*	*			trans	-96.2	70	-166.8	-66.6	-11.5	0	0	0	114.2	D832	D832-D836 PolarHBondContact O-N 3.46Å
837	E	32.5	Very low	33.1	Very low	139 Å²	139	133.4 Å²	133.4	65%	0.65	71%	0.705	S	S	*	*			trans	-115.3	65.6	150.3	-79.5	-177.7	157.4	0	0	108.5	A835 V839	A835-E837 PolarHBondContact O-N 2.93Å; E837-V839 PolarHBondContact O-N 3.4Å
838	E	31.7	Very low	33.4	Very low	187 Å²	187	133.5 Å²	133.5	87%	0.874	70%	0.699	S	S	*	*			trans	-73.6	108.3	157.5	-74.5	-164.1	157.5	0	0	107.9	D840	E838-D840 PolarHBondContact O-N 3.32Å
839	V	32	Very low	33.6	Very low	123 Å²	123	133 Å²	133	75%	0.745	71%	0.708	S	S	*	*			trans	-66.3	119.5	171.6	175.7	0	0	0	0	107.8	E837 E841	E837-V839 PolarHBondContact O-N 3.4Å; V839-E841 PolarHBondContact O-N 3.04Å
840	D	29.4	Very low	34.1	Very low	94 Å²	94	135.3 Å²	135.3	50%	0.503	71%	0.711	S	S	.	*			trans	-67.9	95.8	173.6	-176	10	0	0	0	109.9	E838 N842	E838-D840 PolarHBondContact O-N 3.32Å; D840-N842 PolarHBondContact O-N 3.45Å; D840-N842 WeakPolarHBondContact OD1-CB 3.38Å; D840-N842 PolarHBondContact OD1-N 3.04Å; D840-N842 PolarHBondContact OD1-ND2 2.84Å
841	E	35.5	Very low	34.4	Very low	178 Å²	178	136.6 Å²	136.6	83%	0.832	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	3.6	-179.4	-68.1	-171.1	143.9	0	0	113.8	V839	V839-E841 PolarHBondContact O-N 3.04Å
842	N	39.1	Very low	34.8	Very low	142 Å²	142	136 Å²	136	76%	0.759	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	13.9	-175.4	-57.8	-76.4	0	0	0	115.1	D840	D840-N842 PolarHBondContact O-N 3.45Å; D840-N842 WeakPolarHBondContact OD1-CB 3.38Å; D840-N842 PolarHBondContact OD1-N 3.04Å; D840-N842 PolarHBondContact OD1-ND2 2.84Å
843	L	37.4	Very low	35.1	Very low	136 Å²	136	137.7 Å²	137.7	71%	0.712	73%	0.73	S	S	*	*	S	Bend	trans	-115.1	13.2	-167.2	-103.5	161.4	0	0	0	116.9
844	L	37.2	Very low	35.1	Very low	165 Å²	165	138.4 Å²	138.4	86%	0.864	73%	0.734	S	S	*	*	S	Bend	trans	-132.8	137	170.2	-72.2	170.7	0	0	0	111.2
845	P	36.6	Very low	34.7	Very low	119 Å²	119	142.3 Å²	142.3	77%	0.773	76%	0.761	S	S	*	*			trans	-86.5	133.1	-179.7	33.2	-32.7	0	0	0	112.8
846	D	41.1	Very low	34.7	Very low	245 Å²	245	150.4 Å²	150.4	100%	1.31	79%	0.79	S	S	*	*			trans	37.4	0	169	-69.4	-5.8	0	0	0	119.4

Retrieved 846 of 846 residues in 577.3 ms (Link to these results)

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