A0A087XKS2_POEFO Loading...

GEM interacting protein

AlphaFold DB , UniProt , Accession A0A087XKS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,027 aa.

						>A0A087XKS2_POEFO|A0A087XKS2
MEEGVLNKDSSQTPELRKVPHKSETKRYSEIFRDFDNLDLSFISSEDLLIDSDCQFISESISGEGAEITEQNDEHVGAEAGEGDGCLRAQEADLALFRCEDGVETALQYAKMWCRYAKDLLAWMEKRISLEQEFAKNVMKAAEGAKVSVTQQEMMPLQYIYTMTLEQDIKNSLTSRRTSEILQNRCYQALADKRTEIDKWRREFKDQWARAQRKMSDAVTALKKAKHQYFQRCDELEKAKASSAKAVDDTVGVKTLDKRRKSKDDAQSKVLEAELLYRQCVSDAKLTQDELVKSKERIITHIRKLICQGDNLLKEVTVNMFYYQRQQTESVPLGYQNLELTCRNVEPGEPYLLYILSRRRPEQTLQTFSFQDYTPQGKSNRRKPSNILSPLQDSVPTIEDSPYKRSTDGRRTGHSDSESIGGSLESLSSPAHRRLPKTGSTLTVSSDDLEVSDMVSESDYADGQSVKTRMFSRAALTHRLRKMKSKMAKCKQCDNYIVVSGVECEECGLAFHRKCMEVCQLECEQKKGTVFGVDLSVILQDTPDEVPFVVRCCTNEIESRALSVQGVYRVSGSKPRIQKLCQTFETQKDQVDLSEHSPHDITSILKHFFKELPEPLLTFDLYNEFIGLGKIIQHLSEKETSPEPNEILDIIHKLQKLLKKLPSHYYSTLQYLISHLQRVSENYDNKMSPSNLGIVFGPTLLRPLVSTDMSMIALLETSYQSMLVEFLIAHHDRIFGIEQSTNTPPPPAPTAPLPETPPRASCPLDGVNADLELDTSSKERPQSLESRVIKRDSSEGYISDKSSSNEAVDQLGPEASESAVLAMKATSSNPQGKAAGISSSDSGTQPHYRFTRQPVKHHRFQNLGTRFSNPDCATKQPATPKRANYRSANNSRSSSPDPGSQRFLQNLEGHCDIIQQPHRVTTTAEGTVNVPLSPREVAQYMLGVDSTATSPGAALSSSTTERSTQETTRWSRADHNVNLNSAGQNRIHHPCPRTSSAEHNLTSPAQKILSSLKLRRSHSEKEEQLFV
					

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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	34.1	Very low	31.4	Very low	218 Å²	218	139.5 Å²	139.5	100%	1.074	77%	0.769	S	S	*	*				0	60.1	0	-50.6	178.7	-158.9	0	0	106.9
2	E	30.2	Very low	31.1	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.752	78%	0.779	S	S	*	*				69.3	100.8	68.1	-63.6	146	132.7	0	0	108.9
3	E	29.3	Very low	30.9	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	78%	0.779	S	S	*	*				99.3	129.8	93.4	-80.7	-161.7	148.1	0	0	109.1
4	G	31.4	Very low	30.6	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	78%	0.784	S	S	*	*			cis	175.2	-159.4	-3.1	0	0	0	0	0	109.9
5	V	33.8	Very low	30.4	Very low	140 Å²	140	143.3 Å²	143.3	85%	0.848	78%	0.784	S	S	*	*			trans	68.1	120	157.8	-178.5	0	0	0	0	116
6	L	32.3	Very low	30.6	Very low	137 Å²	137	142.1 Å²	142.1	72%	0.717	78%	0.775	S	S	*	*			cis	-157.7	148.8	-4.7	-151.1	71.9	0	0	0	111.7
7	N	30.8	Very low	30.2	Very low	126 Å²	126	148.5 Å²	148.5	67%	0.674	79%	0.785	S	S	*	*			trans	2.9	152.2	149.3	-49.4	-15.2	0	0	0	119.7
8	K	29.6	Very low	30.3	Very low	171 Å²	171	150.4 Å²	150.4	74%	0.743	79%	0.786	S	S	*	*			cis	-157.5	131	33.2	-159.3	162	-174.9	-178.1	0	115.7
9	D	26.7	Very low	30	Very low	111 Å²	111	149 Å²	149	59%	0.594	78%	0.784	S	S	*	*			trans	35.4	112.1	150.8	-39.4	-20	0	0	0	118.6
10	S	29.7	Very low	29.9	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	78%	0.779	S	S	*	*				59.5	119	61.9	79.3	0	0	0	0	114.1
11	S	37.7	Very low	29.8	Very low	112 Å²	112	149 Å²	149	78%	0.783	78%	0.784	S	S	*	*			cis	84.3	147.2	29.5	94.9	0	0	0	0	116.3
12	Q	28	Very low	29.4	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	77%	0.768	S	S	*	*			trans	83.6	149.8	-177.8	-60.2	-164.4	-7.6	0	0	119.6
13	T	28.3	Very low	29.5	Very low	127 Å²	127	144.5 Å²	144.5	78%	0.779	77%	0.771	S	S	*	*			trans	-82.3	167.1	-167.5	42.3	0	0	0	0	114.2
14	P	27.3	Very low	29.6	Very low	129 Å²	129	143.7 Å²	143.7	84%	0.838	77%	0.767	S	S	*	*				-126.9	164.2	113.9	37.2	-33.9	0	0	0	113.6
15	E	27.4	Very low	30.1	Very low	168 Å²	168	147.2 Å²	147.2	79%	0.785	78%	0.776	S	S	*	*			trans	-84.8	147.7	-179.2	-76.4	-168.8	98	0	0	114.9
16	L	33.2	Very low	30.4	Very low	124 Å²	124	146 Å²	146	65%	0.649	76%	0.759	S	S	*	*			trans	43.4	105.9	144	-72.7	161.9	0	0	0	119.7	K18	L16-K18 HydrophobicContact CD2-CG 4.08Å
17	R	23.6	Very low	31.2	Very low	250 Å²	250	148.5 Å²	148.5	94%	0.943	76%	0.759	S	S	*	*				-136.4	115.9	122.1	-117.6	178.6	-177.4	-176.7	0.8	111
18	K	31.5	Very low	31.6	Very low	183 Å²	183	151.4 Å²	151.4	80%	0.796	76%	0.762	S	S	*	*			trans	-73.8	124.7	175.9	-69.4	-179.8	178.2	178	0	109.8	L16	L16-K18 HydrophobicContact CD2-CG 4.08Å
19	V	24.9	Very low	32.1	Very low	124 Å²	124	146.6 Å²	146.6	75%	0.752	75%	0.75	S	S	*	*			trans	-106.2	125.1	158	179	0	0	0	0	106.9	H21	V19-H21 PolarHBondContact O-N 3.43Å
20	P	28.3	Very low	32.9	Very low	107 Å²	107	145.6 Å²	145.6	70%	0.695	74%	0.741	S	S	*	*			trans	-83.3	110.9	179.9	31.5	-31.3	0	0	0	110.4	K22	P20-K22 VanDerWaalsContact C-N 3.31Å; P20-K22 PolarHBondContact O-N 3.02Å
21	H	27	Very low	33.9	Very low	190 Å²	190	144.1 Å²	144.1	88%	0.88	73%	0.725	S	S	*	*			trans	-68.4	95.8	157.1	-86.8	-76.2	0	0	0	108.5	V19 S23	V19-H21 PolarHBondContact O-N 3.43Å; H21-S23 PolarHBondContact O-N 2.86Å
22	K	27.1	Very low	34.2	Very low	171 Å²	171	145 Å²	145	74%	0.743	72%	0.715	S	S	*	*			trans	-65.6	122.4	158.9	-70.4	-178.2	177.2	-179.3	0	107.2	P20 E24	P20-K22 VanDerWaalsContact C-N 3.31Å; P20-K22 PolarHBondContact O-N 3.02Å; K22-E24 PolarHBondContact O-N 3.13Å
23	S	32	Very low	34.9	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	69%	0.693	S	S	*	*			trans	-68	105.9	154.5	51.9	0	0	0	0	106.9	H21 T25	H21-S23 PolarHBondContact O-N 2.86Å; S23-T25 PolarHBondContact O-N 3.47Å
24	E	30.5	Very low	35.5	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	68%	0.679	S	S	*	*			trans	-68.5	120.9	177.6	-66.2	-173.2	132.5	0	0	109.3	K22 K26	K22-E24 PolarHBondContact O-N 3.13Å; E24-K26 PolarHBondContact O-N 3.41Å; E24-K26 VanDerWaalsContact O-N 3.13Å
25	T	41.6	Very low	36.1	Very low	138 Å²	138	138.7 Å²	138.7	85%	0.847	66%	0.662	S	S	*	*			trans	-69.3	106.3	171.5	2.7	0	0	0	0	107.8	S23 R27	S23-T25 PolarHBondContact O-N 3.47Å; T25-R27 PolarHBondContact O-N 3.09Å
26	K	40.3	Very low	36.6	Very low	114 Å²	114	135.6 Å²	135.6	50%	0.496	65%	0.651	S	S	.	*			trans	-43	132.9	170.6	-87.6	-167.7	166.1	-172.4	0	109.7	E24 E30 I31 D34	E24-K26 PolarHBondContact O-N 3.41Å; E24-K26 VanDerWaalsContact O-N 3.13Å; K26-E30 WeakPolarHBondContact CA-OE2 3.06Å; K26-E30 HydrophobicContact CB-CB 4.47Å; K26-E30 HydrophobicContact CD-CB 4.3Å; K26-E30 HydrophobicContact CG-CB 4.43Å; K26-I31 HydrophobicContact CB-CD1 4.36Å; K26-I31 HydrophobicContact CB-CG1 4.12Å; K26-I31 HydrophobicContact CD-CG1 4.36Å; K26-D34 IonicContact NZ-OD1 3.75Å; K26-D34 IonicContact NZ-OD2 3.38Å; K26-D34 PolarHBondContact NZ-OD2 3.19Å
27	R	49.1	Very low	36.8	Very low	191 Å²	191	134.8 Å²	134.8	72%	0.721	65%	0.647	S	S	*	*			trans	-66.8	149.4	170.9	-79.8	-174.3	168.5	-164.5	-1.5	108.8	T25 S29 E30 I31	T25-R27 PolarHBondContact O-N 3.09Å; R27-S29 WeakPolarHBondContact CB-OG 3.38Å; R27-S29 PolarHBondContact O-N 2.95Å; R27-S29 VanDerWaalsContact O-N 3.07Å; R27-E30 PolarHBondContact N-OE2 3.23Å; R27-E30 WeakPolarHBondContact O-CB 3.35Å; R27-E30 PolarHBondContact O-N 3.08Å; R27-I31 PolarHBondContact O-N 2.96Å
28	Y	39	Very low	37.4	Very low	186 Å²	186	126.8 Å²	126.8	73%	0.729	62%	0.623	S	S	*	*	H	α-helix	trans	-51.8	-34.4	175.4	-79.1	-82.3	0	0	0	112.8	E30 I31 F32	Y28-E30 VanDerWaalsContact C-N 3.3Å; Y28-E30 PolarHBondContact O-N 3.35Å; Y28-I31 PolarHBondContact O-N 2.73Å; Y28-I31 VanDerWaalsContact O-N 3.14Å; Y28-F32 WeakPolarHBondContact O-CD2 3.27Å; Y28-F32 PolarHBondContact O-N 2.98Å
29	S	41.2	Very low	37.7	Very low	71 Å²	71	124.4 Å²	124.4	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-58.2	-35.1	174	51.8	0	0	0	0	114.4	R27 R33	R27-S29 WeakPolarHBondContact CB-OG 3.38Å; R27-S29 PolarHBondContact O-N 2.95Å; R27-S29 VanDerWaalsContact O-N 3.07Å; S29-R33 PolarHBondContact O-N 3.46Å
30	E	42.2	Very low	38.1	Very low	89 Å²	89	125.8 Å²	125.8	42%	0.416	62%	0.621	S	S	.	*	H	α-helix	trans	-76.4	-30.5	177.9	-62.6	164.3	153.3	0	0	111	K26 R27 Y28 D34	K26-E30 WeakPolarHBondContact CA-OE2 3.06Å; K26-E30 HydrophobicContact CB-CB 4.47Å; K26-E30 HydrophobicContact CD-CB 4.3Å; K26-E30 HydrophobicContact CG-CB 4.43Å; R27-E30 PolarHBondContact N-OE2 3.23Å; R27-E30 WeakPolarHBondContact O-CB 3.35Å; R27-E30 PolarHBondContact O-N 3.08Å; Y28-E30 VanDerWaalsContact C-N 3.3Å; Y28-E30 PolarHBondContact O-N 3.35Å; E30-D34 VanDerWaalsContact O-CG 3.31Å; E30-D34 PolarHBondContact O-N 3.21Å
31	I	52.3	Low	38.3	Very low	68 Å²	68	124.3 Å²	124.3	35%	0.349	61%	0.613	S	S	.	*	H	α-helix	trans	-73	-33.8	177.4	-58.3	174.2	0	0	0	111	K26 R27 Y28 D34	K26-I31 HydrophobicContact CB-CD1 4.36Å; K26-I31 HydrophobicContact CB-CG1 4.12Å; K26-I31 HydrophobicContact CD-CG1 4.36Å; R27-I31 PolarHBondContact O-N 2.96Å; Y28-I31 PolarHBondContact O-N 2.73Å; Y28-I31 VanDerWaalsContact O-N 3.14Å; I31-D34 PolarHBondContact O-N 2.71Å
32	F	42.4	Very low	38.5	Very low	131 Å²	131	123.6 Å²	123.6	58%	0.575	61%	0.608	S	S	*	*	H	α-helix	trans	-72.6	-39.5	174.8	-70.9	-63.2	0	0	0	112.6	Y28 D34 F35 D36	Y28-F32 WeakPolarHBondContact O-CD2 3.27Å; Y28-F32 PolarHBondContact O-N 2.98Å; F32-D34 PolarHBondContact O-N 3.31Å; F32-F35 WeakPolarHBondContact O-CA 3.48Å; F32-F35 WeakPolarHBondContact O-CB 3.22Å; F32-F35 PolarHBondContact O-N 3.35Å; F32-D36 PolarHBondContact O-N 3.28Å; F32-D36 VanDerWaalsContact O-N 3.08Å
33	R	42.9	Very low	38.8	Very low	116 Å²	116	123.3 Å²	123.3	44%	0.438	61%	0.613	S	S	.	*	H	α-helix	trans	-59.2	-31.6	171.5	-72.7	-173.5	68	-159.1	6.3	113.5	S29 F35 N37 E639	S29-R33 PolarHBondContact O-N 3.46Å; R33-F35 PolarHBondContact O-N 2.66Å; R33-N37 PolarHBondContact O-N 3.41Å; R33-N37 PolarHBondContact O-ND2 3.23Å; R33-E639 WeakPolarHBondContact CD-OE1 3.42Å; R33-E639 IonicContact CZ-OE1 2.76Å; R33-E639 IonicContact CZ-OE2 2.69Å; R33-E639 IonicContact NE-OE1 3.99Å; R33-E639 IonicContact NE-OE2 2.82Å; R33-E639 IonicContact NH1-OE1 3.83Å; R33-E639 PolarHBondContact NH1-OE1 3.25Å; R33-E639 IonicContact NH1-OE2 2.72Å; R33-E639 PolarHBondContact NH1-OE2 3.23Å; R33-E639 IonicContact NH2-OE1 2.77Å; R33-E639 IonicContact NH2-OE2 3.2Å; R33-E639 PolarHBondContact NH2-OE2 3.44Å
34	D	41.8	Very low	38.8	Very low	91 Å²	91	123 Å²	123	49%	0.487	61%	0.611	S	S	.	*	H	α-helix	trans	-69.6	-15.5	173.6	-67.8	-26.5	0	0	0	112.9	K26 E30 I31 F32	K26-D34 IonicContact NZ-OD1 3.75Å; K26-D34 IonicContact NZ-OD2 3.38Å; K26-D34 PolarHBondContact NZ-OD2 3.19Å; E30-D34 VanDerWaalsContact O-CG 3.31Å; E30-D34 PolarHBondContact O-N 3.21Å; I31-D34 PolarHBondContact O-N 2.71Å; F32-D34 PolarHBondContact O-N 3.31Å
35	F	39	Very low	38.7	Very low	108 Å²	108	120.3 Å²	120.3	47%	0.474	61%	0.612	S	S	.	*	H	α-helix	trans	-93.2	-42.4	173.1	-90.7	-87.5	0	0	0	112.9	F32 R33 N37 L38	F32-F35 WeakPolarHBondContact O-CA 3.48Å; F32-F35 WeakPolarHBondContact O-CB 3.22Å; F32-F35 PolarHBondContact O-N 3.35Å; R33-F35 PolarHBondContact O-N 2.66Å; F35-N37 PolarHBondContact O-N 3Å; F35-L38 VanDerWaalsContact O-CB 3.24Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 3.19Å
36	D	39.7	Very low	38.1	Very low	104 Å²	104	123.2 Å²	123.2	56%	0.556	62%	0.616	S	S	*	*	H	α-helix	trans	-62.3	-30	-178.9	-58	-42.7	0	0	0	112.5	F32 L38	F32-D36 PolarHBondContact O-N 3.28Å; F32-D36 VanDerWaalsContact O-N 3.08Å; D36-L38 PolarHBondContact O-N 2.85Å
37	N	37.2	Very low	37.6	Very low	107 Å²	107	124.9 Å²	124.9	57%	0.572	63%	0.63	S	S	*	*	H	α-helix	trans	-71.4	-10.7	173.5	-76.3	-68.1	0	0	0	114	R33 F35	R33-N37 PolarHBondContact O-N 3.41Å; R33-N37 PolarHBondContact O-ND2 3.23Å; F35-N37 PolarHBondContact O-N 3Å
38	L	36.4	Very low	36.7	Very low	81 Å²	81	122.2 Å²	122.2	42%	0.424	63%	0.629	S	S	.	*	H	α-helix	trans	-88.4	-40	179.5	-143.3	75.7	0	0	0	111.9	F35 D36 L40 S41	F35-L38 VanDerWaalsContact O-CB 3.24Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 3.19Å; D36-L38 PolarHBondContact O-N 2.85Å; L38-L40 PolarHBondContact O-N 3.2Å; L38-S41 PolarHBondContact O-N 3.23Å; L38-S41 VanDerWaalsContact O-N 3.14Å; L38-S41 PolarHBondContact O-OG 3.11Å
39	D	36.5	Very low	36.2	Very low	134 Å²	134	121.4 Å²	121.4	72%	0.717	64%	0.636	S	S	*	*	H	α-helix	trans	-66.1	-19.6	179.4	-87.7	-4.2	0	0	0	113.4	S41	D39-S41 VanDerWaalsContact C-N 3.27Å; D39-S41 PolarHBondContact O-N 3.35Å
40	L	34.3	Very low	35.6	Very low	153 Å²	153	124.9 Å²	124.9	80%	0.801	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-2.8	174.8	-72	174.1	0	0	0	114.6	L38	L38-L40 PolarHBondContact O-N 3.2Å
41	S	31.8	Very low	35	Very low	76 Å²	76	127.6 Å²	127.6	53%	0.531	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.4	-3.4	-179.2	64.3	0	0	0	0	115.6	L38 D39	L38-S41 PolarHBondContact O-N 3.23Å; L38-S41 VanDerWaalsContact O-N 3.14Å; L38-S41 PolarHBondContact O-OG 3.11Å; D39-S41 VanDerWaalsContact C-N 3.27Å; D39-S41 PolarHBondContact O-N 3.35Å
42	F	32	Very low	33.8	Very low	175 Å²	175	130 Å²	130	77%	0.768	69%	0.689	S	S	*	*			trans	-116.7	39.8	-175.7	-81.8	-75	0	0	0	114.5
43	I	33.4	Very low	33	Very low	164 Å²	164	130.7 Å²	130.7	84%	0.841	70%	0.698	S	S	*	*	S	Bend	trans	-128.9	71.1	164.2	-48.6	-178.7	0	0	0	110.2
44	S	31.9	Very low	32.3	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	71%	0.706	S	S	*	*			trans	-162.4	157.9	162.3	-166.7	0	0	0	0	109.8
45	S	27.8	Very low	31.5	Very low	120 Å²	120	133.2 Å²	133.2	84%	0.839	72%	0.721	S	S	*	*			trans	71.8	77.1	179.9	-49.6	0	0	0	0	116.1
46	E	29.4	Very low	30.8	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	74%	0.738	S	S	*	*			trans	-124.8	100.5	156.1	-179.1	170.9	-135.5	0	0	108.4
47	D	29	Very low	30.1	Very low	148 Å²	148	140.3 Å²	140.3	79%	0.791	75%	0.753	S	S	*	*			trans	-164.3	151.6	161.3	-143	-22.5	0	0	0	112.3
48	L	30.2	Very low	29.6	Very low	135 Å²	135	140.2 Å²	140.2	71%	0.707	76%	0.761	S	S	*	*			trans	56.1	119.4	174.1	-53.9	174.5	0	0	0	116.5
49	L	28.1	Very low	29	Very low	169 Å²	169	145.9 Å²	145.9	89%	0.885	79%	0.785	S	S	*	*				-146.3	169.4	59	-95.5	170.5	0	0	0	114.8
50	I	30.1	Very low	28.5	Very low	145 Å²	145	144.1 Å²	144.1	74%	0.744	78%	0.783	S	S	*	*			trans	-97.4	143.3	-168.3	-68.3	169.3	0	0	0	112.7
51	D	28.6	Very low	28.1	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	79%	0.786	S	S	*	*			trans	2.3	131.6	154	-165.8	24.9	0	0	0	119.7
52	S	27.4	Very low	27.8	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	80%	0.799	S	S	*	*			trans	-160.9	115.5	159.1	-166	0	0	0	0	110.8
53	D	25.6	Very low	27.5	Very low	144 Å²	144	142 Å²	142	77%	0.77	80%	0.8	S	S	*	*			trans	-96	175.8	-177.6	-157.2	-7.3	0	0	0	112.1
54	C	28.4	Very low	27.3	Very low	89 Å²	89	144 Å²	144	60%	0.601	81%	0.806	S	S	*	*			trans	85.7	115.2	165.8	-72.4	0	0	0	0	121.9
55	Q	24.3	Very low	27	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	80%	0.804	S	S	*	*				87.9	113.1	125.6	-66.2	173.8	25.2	0	0	122.4
56	F	24.7	Very low	27	Very low	193 Å²	193	141.2 Å²	141.2	85%	0.846	80%	0.804	S	S	*	*			trans	7.2	136.4	136	-73.7	-94.3	0	0	0	120
57	I	25.4	Very low	26.8	Very low	169 Å²	169	140.1 Å²	140.1	87%	0.867	80%	0.799	S	S	*	*				-165.8	152.4	104.6	-99.8	159.7	0	0	0	110.5
58	S	25.8	Very low	26.9	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	80%	0.798	S	S	*	*			trans	-89.9	148.4	173.1	-51.3	0	0	0	0	111.2
59	E	24.3	Very low	26.7	Very low	200 Å²	200	139.7 Å²	139.7	94%	0.935	80%	0.8	S	S	*	*			trans	-157.9	166.8	130.2	-121.8	168.7	-166.6	0	0	113.2
60	S	25.9	Very low	26.9	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	80%	0.799	S	S	*	*			trans	-132.5	156.8	-172.4	58.8	0	0	0	0	110.6
61	I	26.3	Very low	26.8	Very low	166 Å²	166	142.4 Å²	142.4	85%	0.851	81%	0.805	S	S	*	*			trans	-177.3	161.9	134.6	-96.2	154.9	0	0	0	110.7
62	S	26	Very low	26.9	Very low	116 Å²	116	143 Å²	143	81%	0.811	81%	0.808	S	S	*	*			trans	-88.5	160.6	-167.6	52.6	0	0	0	0	116.1
63	G	25.8	Very low	26.8	Very low	76 Å²	76	145.3 Å²	145.3	78%	0.784	81%	0.811	S	S	*	*			trans	-161.5	141.3	160	0	0	0	0	0	113.1
64	E	29.1	Very low	27.1	Very low	206 Å²	206	146.4 Å²	146.4	96%	0.963	81%	0.812	S	S	*	*			trans	-84.6	165.3	169.2	-60	154.7	125.2	0	0	109.3
65	G	26	Very low	27.2	Very low	71 Å²	71	150.3 Å²	150.3	73%	0.732	82%	0.821	S	S	*	*			cis	164.8	172	-1.9	0	0	0	0	0	110.8
66	A	26.9	Very low	27.5	Very low	102 Å²	102	148.4 Å²	148.4	84%	0.843	82%	0.821	S	S	*	*			trans	75.7	140.4	166.1	0	0	0	0	0	122.3
67	E	25.9	Very low	27.6	Very low	175 Å²	175	143 Å²	143	82%	0.818	82%	0.819	S	S	*	*			trans	62.3	104.1	147.5	-67	-178.5	177.6	0	0	125
68	I	31.4	Very low	28.1	Very low	151 Å²	151	139.6 Å²	139.6	77%	0.774	82%	0.817	S	S	*	*				41.5	121.9	118.7	-53	163.6	0	0	0	119.6
69	T	24.6	Very low	28.3	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	83%	0.827	S	S	*	*			trans	-162.9	141	130	-78.5	0	0	0	0	110.3
70	E	33.4	Very low	29.2	Very low	185 Å²	185	140.1 Å²	140.1	86%	0.864	83%	0.827	S	S	*	*			trans	-89.4	136.7	166.6	-68.3	-177.5	147.9	0	0	110.2
71	Q	27.4	Very low	29.8	Very low	187 Å²	187	139 Å²	139	87%	0.874	83%	0.831	S	S	*	*			trans	-155.6	138.5	154.4	-118.1	162.3	31.4	0	0	110.8
72	N	29.9	Very low	30.5	Very low	157 Å²	157	140.2 Å²	140.2	84%	0.84	83%	0.833	S	S	*	*			trans	-81.7	151.3	168.5	-61.8	-24.5	0	0	0	109.1
73	D	26.7	Very low	31.1	Very low	168 Å²	168	136.8 Å²	136.8	90%	0.898	82%	0.816	S	S	*	*			trans	-153.3	155.9	130	-129.5	-24.1	0	0	0	111.4
74	E	31.3	Very low	32.1	Very low	167 Å²	167	138.5 Å²	138.5	78%	0.78	81%	0.807	S	S	*	*			trans	-97.4	134.7	176.5	-65.3	-179.7	88.5	0	0	110.5
75	H	30.6	Very low	33.3	Very low	172 Å²	172	131.4 Å²	131.4	80%	0.796	79%	0.789	S	S	*	*				-176.2	124.8	117.9	-107.7	-75.3	0	0	0	115
76	V	30.6	Very low	34.7	Very low	130 Å²	130	131.3 Å²	131.3	79%	0.788	78%	0.777	S	S	*	*			trans	20.1	111.2	136.8	-174.2	0	0	0	0	118.3
77	G	26.6	Very low	36.3	Very low	79 Å²	79	131.5 Å²	131.5	81%	0.814	76%	0.763	S	S	*	*			trans	-148.2	114.4	152.1	0	0	0	0	0	108.3
78	A	35.3	Very low	38.5	Very low	99 Å²	99	129.8 Å²	129.8	82%	0.818	75%	0.749	S	S	*	*			trans	-110	115.5	-170	0	0	0	0	0	111.9
79	E	31.6	Very low	40.7	Very low	202 Å²	202	123.7 Å²	123.7	94%	0.944	72%	0.721	S	S	*	*			trans	-123.6	134.4	157.2	-66.6	-163.4	154.6	0	0	108.5
80	A	42	Very low	43.4	Very low	113 Å²	113	121.6 Å²	121.6	93%	0.934	70%	0.703	S	S	*	*			trans	-102.7	124.1	-174.5	0	0	0	0	0	110.2
81	G	38.7	Very low	45.9	Very low	74 Å²	74	118.9 Å²	118.9	76%	0.763	69%	0.69	S	S	*	*	S	Bend	trans	-161.3	-37.9	-179.3	0	0	0	0	0	115.9
82	E	41.3	Very low	48.6	Very low	191 Å²	191	112.1 Å²	112.1	89%	0.893	67%	0.667	S	S	*	*	S	Bend	trans	-129.7	25	-171.9	-60.4	-168.5	124.2	0	0	114.6
83	G	38.7	Very low	51.4	Low	45 Å²	45	105.5 Å²	105.5	46%	0.464	63%	0.631	S	S	.	*			trans	-71.9	-38.6	-163	0	0	0	0	0	117.8	C86 L87	G83-C86 WeakPolarHBondContact O-CB 3.46Å; G83-C86 PolarHBondContact O-N 3.23Å; G83-L87 PolarHBondContact O-N 3.03Å
84	D	47.1	Very low	54.4	Low	111 Å²	111	101.8 Å²	101.8	59%	0.594	61%	0.611	S	S	*	*	H	α-helix	trans	-65	-52.3	-159.2	-175.2	66.2	0	0	0	114.4	C86 L87 R88	D84-C86 PolarHBondContact O-N 3.12Å; D84-C86 VanDerWaalsContact O-N 3.11Å; D84-L87 PolarHBondContact O-N 2.84Å; D84-R88 PolarHBondContact O-N 3.38Å
85	G	54.1	Low	57.1	Low	57 Å²	57	96.7 Å²	96.7	59%	0.588	60%	0.597	S	S	*	*	H	α-helix	trans	-64.1	-19.1	-179.4	0	0	0	0	0	114.1
86	C	55.6	Low	59.8	Low	69 Å²	69	90.8 Å²	90.8	47%	0.466	57%	0.571	S	S	.	*	H	α-helix	trans	-74.8	-53.8	176.3	-156.5	0	0	0	0	110.4	G83 D84 R88 A89 Q90	G83-C86 WeakPolarHBondContact O-CB 3.46Å; G83-C86 PolarHBondContact O-N 3.23Å; D84-C86 PolarHBondContact O-N 3.12Å; D84-C86 VanDerWaalsContact O-N 3.11Å; C86-R88 PolarHBondContact O-N 3.49Å; C86-A89 WeakPolarHBondContact O-CA 3.1Å; C86-A89 WeakPolarHBondContact O-CB 3.33Å; C86-A89 PolarHBondContact O-N 3.27Å; C86-Q90 VanDerWaalsContact O-CD 3.23Å; C86-Q90 PolarHBondContact O-N 3.31Å; C86-Q90 VanDerWaalsContact O-N 3.08Å; C86-Q90 PolarHBondContact O-OE1 2.99Å; C86-Q90 PolarHBondContact SG-NE2 3.16Å
87	L	58.7	Low	62.6	Low	106 Å²	106	88.1 Å²	88.1	56%	0.555	55%	0.549	S	S	*	.	H	α-helix	trans	-55.9	-50.7	-178.1	-66.7	171.6	0	0	0	111.7	G83 D84 A89 Q90 E91	G83-L87 PolarHBondContact O-N 3.03Å; D84-L87 PolarHBondContact O-N 2.84Å; L87-A89 PolarHBondContact O-N 3.17Å; L87-A89 VanDerWaalsContact O-N 3.1Å; L87-Q90 PolarHBondContact O-N 3.07Å; L87-E91 WeakPolarHBondContact O-CG 3.41Å; L87-E91 PolarHBondContact O-N 3.27Å
88	R	72.7	Confident	65.6	Low	139 Å²	139	93.9 Å²	93.9	53%	0.525	55%	0.546	S	S	.	.	H	α-helix	trans	-58.9	-26.7	179.6	-155.3	172.2	-173.2	173.6	2.6	112.9	D84 C86 A92	D84-R88 PolarHBondContact O-N 3.38Å; C86-R88 PolarHBondContact O-N 3.49Å; R88-A92 PolarHBondContact O-N 2.91Å
89	A	78.8	Confident	68.2	Low	23 Å²	23	92 Å²	92	19%	0.19	53%	0.526	C	S	.	.	H	α-helix	trans	-84	-31	175.6	0	0	0	0	0	113.3	C86 L87 D93 R303	C86-A89 WeakPolarHBondContact O-CA 3.1Å; C86-A89 WeakPolarHBondContact O-CB 3.33Å; C86-A89 PolarHBondContact O-N 3.27Å; L87-A89 PolarHBondContact O-N 3.17Å; L87-A89 VanDerWaalsContact O-N 3.1Å; A89-D93 PolarHBondContact O-N 2.74Å; A89-R303 PolarHBondContact O-NE 2.98Å
90	Q	80.9	Confident	70.8	Confident	80 Å²	80	90.7 Å²	90.7	37%	0.374	52%	0.52	S	S	.	.	H	α-helix	trans	-70.2	-37.2	167.6	-76.1	104.8	32.8	0	0	111.9	C86 L87 A92 D93 L94	C86-Q90 VanDerWaalsContact O-CD 3.23Å; C86-Q90 PolarHBondContact O-N 3.31Å; C86-Q90 VanDerWaalsContact O-N 3.08Å; C86-Q90 PolarHBondContact O-OE1 2.99Å; C86-Q90 PolarHBondContact SG-NE2 3.16Å; L87-Q90 PolarHBondContact O-N 3.07Å; Q90-A92 VanDerWaalsContact C-N 3.32Å; Q90-A92 PolarHBondContact O-N 2.97Å; Q90-D93 PolarHBondContact O-N 3.39Å; Q90-L94 WeakPolarHBondContact O-CB 3.41Å; Q90-L94 VanDerWaalsContact O-CG 3.29Å; Q90-L94 WeakPolarHBondContact O-CG 3.39Å; Q90-L94 PolarHBondContact O-N 2.81Å
91	E	85.5	Confident	73.2	Confident	127 Å²	127	90.2 Å²	90.2	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-60.1	-41.2	174.2	-71.4	-179.5	156.8	0	0	112.1	L87 L94 A95	L87-E91 WeakPolarHBondContact O-CG 3.41Å; L87-E91 PolarHBondContact O-N 3.27Å; E91-L94 PolarHBondContact O-N 2.86Å; E91-A95 WeakPolarHBondContact O-CB 3.47Å; E91-A95 PolarHBondContact O-N 3.23Å
92	A	84.2	Confident	75.8	Confident	46 Å²	46	86.7 Å²	86.7	38%	0.38	47%	0.466	S	S	.	.	H	α-helix	trans	-64	-43.3	174.1	0	0	0	0	0	112.7	R88 Q90 L94 A95 L96	R88-A92 PolarHBondContact O-N 2.91Å; Q90-A92 VanDerWaalsContact C-N 3.32Å; Q90-A92 PolarHBondContact O-N 2.97Å; A92-L94 VanDerWaalsContact C-N 3.34Å; A92-A95 PolarHBondContact O-N 2.73Å; A92-L96 PolarHBondContact O-N 3.47Å
93	D	89.2	Confident	78.4	Confident	18 Å²	18	77.6 Å²	77.6	10%	0.096	42%	0.424	C	S	.	.	H	α-helix	trans	-61	-42.9	173.4	-77.8	-3.5	0	0	0	111	A89 Q90 L96 F97 I299 T300 R303	A89-D93 PolarHBondContact O-N 2.74Å; Q90-D93 PolarHBondContact O-N 3.39Å; D93-L96 PolarHBondContact O-N 2.85Å; D93-F97 VanDerWaalsContact O-CB 3.25Å; D93-F97 WeakPolarHBondContact O-CB 3.42Å; D93-F97 PolarHBondContact O-N 3.36Å; D93-I299 HydrophobicContact CB-CG2 4.29Å; D93-T300 PolarHBondContact OD2-OG1 3.1Å; D93-R303 VanDerWaalsContact OD1-CD 3.31Å; D93-R303 WeakPolarHBondContact OD1-CD 3.13Å; D93-R303 IonicContact OD1-CZ 2.74Å; D93-R303 IonicContact OD1-NE 3.46Å; D93-R303 PolarHBondContact OD1-NE 2.69Å; D93-R303 IonicContact OD1-NH2 2.61Å; D93-R303 IonicContact OD2-CZ 3.19Å; D93-R303 VanDerWaalsContact OD2-CZ 3.29Å; D93-R303 IonicContact OD2-NE 2.87Å; D93-R303 PolarHBondContact OD2-NE 3.37Å; D93-R303 IonicContact OD2-NH2 3.63Å; D93-R303 PolarHBondContact OD2-NH2 2.72Å
94	L	88.6	Confident	81.2	Confident	89 Å²	89	78.5 Å²	78.5	47%	0.466	42%	0.416	S	S	.	.	H	α-helix	trans	-66.8	-35.2	177.8	-73.1	169.6	0	0	0	112.7	Q90 E91 A92 F97 R98	Q90-L94 WeakPolarHBondContact O-CB 3.41Å; Q90-L94 VanDerWaalsContact O-CG 3.29Å; Q90-L94 WeakPolarHBondContact O-CG 3.39Å; Q90-L94 PolarHBondContact O-N 2.81Å; E91-L94 PolarHBondContact O-N 2.86Å; A92-L94 VanDerWaalsContact C-N 3.34Å; L94-F97 PolarHBondContact O-N 2.8Å; L94-R98 VanDerWaalsContact O-CG 3.25Å; L94-R98 WeakPolarHBondContact O-CG 3.11Å; L94-R98 PolarHBondContact O-N 3.33Å
95	A	88.4	Confident	83.6	Confident	61 Å²	61	76.6 Å²	76.6	50%	0.504	41%	0.408	S	S	.	.	H	α-helix	trans	-66.5	-46.2	174	0	0	0	0	0	111.4	E91 A92 F97 R98 C99	E91-A95 WeakPolarHBondContact O-CB 3.47Å; E91-A95 PolarHBondContact O-N 3.23Å; A92-A95 PolarHBondContact O-N 2.73Å; A95-F97 VanDerWaalsContact C-N 3.33Å; A95-F97 PolarHBondContact O-N 3.36Å; A95-R98 PolarHBondContact O-N 2.79Å; A95-C99 PolarHBondContact O-N 2.64Å; A95-C99 VanDerWaalsContact O-N 3.11Å
96	L	88.3	Confident	85.6	Confident	48 Å²	48	74.2 Å²	74.2	25%	0.251	38%	0.383	S	S	.	.	H	α-helix	trans	-65.3	-35.3	173.8	-71	171.6	0	0	0	112.1	A92 D93 R98 C99 G102 T105 I299	A92-L96 PolarHBondContact O-N 3.47Å; D93-L96 PolarHBondContact O-N 2.85Å; L96-R98 VanDerWaalsContact C-N 3.34Å; L96-R98 PolarHBondContact O-N 3.48Å; L96-C99 PolarHBondContact O-N 3.37Å; L96-G102 WeakPolarHBondContact O-CA 3.43Å; L96-T105 HydrophobicContact CD2-CG2 3.88Å; L96-I299 HydrophobicContact CB-CD1 4.01Å; L96-I299 HydrophobicContact CB-CG2 4.02Å; L96-I299 HydrophobicContact CD1-CG2 3.94Å
97	F	89.1	Confident	87.6	Confident	73 Å²	73	71.5 Å²	71.5	32%	0.32	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-39.5	174.9	-180	-89.5	0	0	0	112.3	D93 L94 A95 V292 K295 E296	D93-F97 VanDerWaalsContact O-CB 3.25Å; D93-F97 WeakPolarHBondContact O-CB 3.42Å; D93-F97 PolarHBondContact O-N 3.36Å; L94-F97 PolarHBondContact O-N 2.8Å; A95-F97 VanDerWaalsContact C-N 3.33Å; A95-F97 PolarHBondContact O-N 3.36Å; F97-V292 HydrophobicContact CE2-CG1 3.74Å; F97-V292 HydrophobicContact CZ-CG1 3.63Å; F97-K295 HydrophobicContact CD2-CG 4.42Å; F97-K295 WeakPolarHBondContact O-CE 3.44Å; F97-K295 PolarHBondContact O-NZ 2.97Å; F97-E296 HydrophobicContact CD2-CB 4.34Å; F97-E296 HydrophobicContact CE2-CB 4.32Å
98	R	88.8	Confident	89.5	Confident	200 Å²	200	70.9 Å²	70.9	76%	0.755	36%	0.358	S	S	*	.	H	α-helix	trans	-73.7	-29.4	177.2	-70.1	170.2	-170.2	-167.3	5.2	113.8	L94 A95 L96	L94-R98 VanDerWaalsContact O-CG 3.25Å; L94-R98 WeakPolarHBondContact O-CG 3.11Å; L94-R98 PolarHBondContact O-N 3.33Å; A95-R98 PolarHBondContact O-N 2.79Å; L96-R98 VanDerWaalsContact C-N 3.34Å; L96-R98 PolarHBondContact O-N 3.48Å
99	C	90.1	Very high	90.7	Very high	59 Å²	59	70 Å²	70	40%	0.399	36%	0.355	S	S	.	.	S	Bend	trans	-72.1	135.3	174.9	-175.2	0	0	0	0	111.2	A95 L96 G102 K295	A95-C99 PolarHBondContact O-N 2.64Å; A95-C99 VanDerWaalsContact O-N 3.11Å; L96-C99 PolarHBondContact O-N 3.37Å; C99-G102 PolarHBondContact O-N 3.24Å; C99-K295 PolarHBondContact O-NZ 3.14Å
100	E	86.7	Confident	91.7	Very high	175 Å²	175	69 Å²	69	82%	0.818	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-54.9	-179.5	-62.5	-167.4	146.4	0	0	111.2	G102	E100-G102 PolarHBondContact O-N 3.11Å
101	D	92	Very high	92.5	Very high	104 Å²	104	70.4 Å²	70.4	56%	0.556	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	26.8	177.3	-62.9	-45	0	0	0	114.4	V103 E104 T105	D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 2.96Å; D101-E104 HydrophobicContact CB-CB 4.32Å; D101-E104 PolarHBondContact O-N 2.97Å; D101-T105 WeakPolarHBondContact O-CB 3.3Å; D101-T105 PolarHBondContact O-N 3.22Å; D101-T105 PolarHBondContact O-OG1 3.01Å
102	G	93.7	Very high	93.1	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-35.7	-174.8	0	0	0	0	0	114.7	L96 C99 E100 A106	L96-G102 WeakPolarHBondContact O-CA 3.43Å; C99-G102 PolarHBondContact O-N 3.24Å; E100-G102 PolarHBondContact O-N 3.11Å; G102-A106 PolarHBondContact O-N 3.4Å; G102-A106 VanDerWaalsContact O-N 3.14Å
103	V	96.4	Very high	93.8	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-75.4	-44.7	179.9	-176.4	0	0	0	0	110.4	D101 T105 A106 L107 W208 K295 I298 I299	D101-V103 VanDerWaalsContact C-N 3.33Å; D101-V103 PolarHBondContact O-N 2.96Å; V103-T105 VanDerWaalsContact C-N 3.27Å; V103-T105 PolarHBondContact O-N 3.16Å; V103-A106 PolarHBondContact O-N 3.09Å; V103-L107 HydrophobicContact CG1-CD1 3.83Å; V103-L107 HydrophobicContact CG1-CG 4.3Å; V103-L107 WeakPolarHBondContact O-CB 3.22Å; V103-L107 VanDerWaalsContact O-CG 3.28Å; V103-L107 WeakPolarHBondContact O-CG 3.36Å; V103-L107 PolarHBondContact O-N 3.02Å; V103-W208 HydrophobicContact CB-CD2 3.98Å; V103-W208 HydrophobicContact CB-CG 4.18Å; V103-W208 HydrophobicContact CB-CZ2 4.13Å; V103-W208 HydrophobicContact CG1-CB 4.11Å; V103-W208 HydrophobicContact CG1-CD2 3.82Å; V103-W208 HydrophobicContact CG1-CE3 4.48Å; V103-W208 HydrophobicContact CG1-CG 3.62Å; V103-W208 HydrophobicContact CG2-CD2 3.91Å; V103-W208 HydrophobicContact CG2-CE3 4.1Å; V103-W208 HydrophobicContact CG2-CH2 3.96Å; V103-W208 HydrophobicContact CG2-CZ2 3.74Å; V103-W208 HydrophobicContact CG2-CZ3 4.12Å; V103-K295 HydrophobicContact CG2-CB 4.13Å; V103-K295 HydrophobicContact CG2-CD 4.36Å; V103-K295 HydrophobicContact CG2-CG 3.65Å; V103-I298 HydrophobicContact CG1-CB 4.37Å; V103-I298 HydrophobicContact CG1-CG2 3.65Å; V103-I299 HydrophobicContact CG2-CD1 4.29Å; V103-I299 HydrophobicContact CG2-CG1 4.29Å
104	E	96.8	Very high	94.3	Very high	64 Å²	64	67.2 Å²	67.2	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-55.4	-43.6	173.2	-75.4	72.4	-171.2	0	0	111	D101 L107 Q108 W208 Q212	D101-E104 HydrophobicContact CB-CB 4.32Å; D101-E104 PolarHBondContact O-N 2.97Å; E104-L107 PolarHBondContact O-N 3.31Å; E104-Q108 VanDerWaalsContact O-CB 3.22Å; E104-Q108 WeakPolarHBondContact O-CB 3.15Å; E104-Q108 PolarHBondContact O-N 2.83Å; E104-W208 PolarHBondContact OE1-NE1 2.88Å; E104-W208 PolarHBondContact OE2-NE1 2.95Å; E104-W208 VanDerWaalsContact OE2-NE1 3.09Å; E104-Q212 PolarHBondContact OE1-NE2 2.84Å
105	T	96.4	Very high	94.7	Very high	70 Å²	70	71.4 Å²	71.4	43%	0.429	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-49.9	176.1	-59.2	0	0	0	0	111.5	L96 D101 V103 Q108 Y109	L96-T105 HydrophobicContact CD2-CG2 3.88Å; D101-T105 WeakPolarHBondContact O-CB 3.3Å; D101-T105 PolarHBondContact O-N 3.22Å; D101-T105 PolarHBondContact O-OG1 3.01Å; V103-T105 VanDerWaalsContact C-N 3.27Å; V103-T105 PolarHBondContact O-N 3.16Å; T105-Q108 PolarHBondContact O-N 3.01Å; T105-Y109 PolarHBondContact O-N 2.93Å
106	A	97.1	Very high	95.2	Very high	8 Å²	8	74.9 Å²	74.9	7%	0.066	34%	0.342	C	S	.	.	H	α-helix	trans	-63	-43.7	177.6	0	0	0	0	0	112.3	G102 V103 Q108 Y109 A110 I302	G102-A106 PolarHBondContact O-N 3.4Å; G102-A106 VanDerWaalsContact O-N 3.14Å; V103-A106 PolarHBondContact O-N 3.09Å; A106-Q108 VanDerWaalsContact C-N 3.31Å; A106-Q108 PolarHBondContact O-N 3.41Å; A106-Y109 PolarHBondContact O-N 3.32Å; A106-A110 PolarHBondContact O-N 3.39Å; A106-I302 HydrophobicContact CB-CB 4.37Å; A106-I302 HydrophobicContact CB-CD1 3.87Å; A106-I302 HydrophobicContact CB-CG2 4.07Å
107	L	98.1	Very high	95.7	Very high	12 Å²	12	72.6 Å²	72.6	6%	0.063	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-33.4	176.6	-73.9	171	0	0	0	112.8	V103 E104 K111 R201 F204 K205 I302	V103-L107 HydrophobicContact CG1-CD1 3.83Å; V103-L107 HydrophobicContact CG1-CG 4.3Å; V103-L107 WeakPolarHBondContact O-CB 3.22Å; V103-L107 VanDerWaalsContact O-CG 3.28Å; V103-L107 WeakPolarHBondContact O-CG 3.36Å; V103-L107 PolarHBondContact O-N 3.02Å; E104-L107 PolarHBondContact O-N 3.31Å; L107-K111 WeakPolarHBondContact O-CB 3.46Å; L107-K111 PolarHBondContact O-N 3.13Å; L107-K111 VanDerWaalsContact O-N 3.13Å; L107-R201 HydrophobicContact CD2-CG 4Å; L107-R201 WeakPolarHBondContact CD2-O 3.45Å; L107-R201 WeakPolarHBondContact O-CD 3.46Å; L107-F204 HydrophobicContact CD2-CB 4.04Å; L107-K205 HydrophobicContact CD1-CB 3.99Å; L107-K205 HydrophobicContact CD1-CG 4.17Å; L107-K205 HydrophobicContact CD2-CB 4.35Å; L107-I302 HydrophobicContact CD2-CD1 3.61Å; L107-I302 HydrophobicContact CG-CD1 3.81Å
108	Q	98.1	Very high	96.2	Very high	92 Å²	92	74.9 Å²	74.9	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-72.9	-40.3	174.1	178	72.4	-11.2	0	0	111	E104 T105 A106 K111 M112	E104-Q108 VanDerWaalsContact O-CB 3.22Å; E104-Q108 WeakPolarHBondContact O-CB 3.15Å; E104-Q108 PolarHBondContact O-N 2.83Å; T105-Q108 PolarHBondContact O-N 3.01Å; A106-Q108 VanDerWaalsContact C-N 3.31Å; A106-Q108 PolarHBondContact O-N 3.41Å; Q108-K111 WeakPolarHBondContact O-CB 3.44Å; Q108-K111 PolarHBondContact O-N 3.34Å; Q108-K111 VanDerWaalsContact O-N 3.14Å; Q108-M112 HydrophobicContact CG-CE 4.48Å; Q108-M112 WeakPolarHBondContact O-CG 3.35Å; Q108-M112 PolarHBondContact O-N 2.91Å
109	Y	98.1	Very high	96.6	Very high	120 Å²	120	69.1 Å²	69.1	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-58.7	-49.2	172.8	-172.3	-86.3	0	0	0	111.3	T105 A106 K111 M112 W113 I306	T105-Y109 PolarHBondContact O-N 2.93Å; A106-Y109 PolarHBondContact O-N 3.32Å; Y109-K111 PolarHBondContact O-N 3.12Å; Y109-M112 HydrophobicContact CD2-CE 4.25Å; Y109-M112 WeakPolarHBondContact O-CA 3.31Å; Y109-M112 WeakPolarHBondContact O-CB 3.2Å; Y109-M112 PolarHBondContact O-N 3.46Å; Y109-W113 PolarHBondContact O-N 3.28Å; Y109-I306 HydrophobicContact CD1-CD1 3.94Å; Y109-I306 HydrophobicContact CD1-CG1 4.09Å; Y109-I306 HydrophobicContact CD1-CG2 4.43Å; Y109-I306 HydrophobicContact CE1-CD1 4.02Å; Y109-I306 HydrophobicContact CE1-CG1 4.22Å; Y109-I306 HydrophobicContact CE1-CG2 3.78Å
110	A	98.4	Very high	97	Very high	3 Å²	3	68.5 Å²	68.5	3%	0.025	32%	0.316	C	S	.	.	H	α-helix	trans	-60	-31.7	175.6	0	0	0	0	0	113.2	A106 C114 R201 I302 I306	A106-A110 PolarHBondContact O-N 3.39Å; A110-C114 WeakPolarHBondContact O-CB 3.27Å; A110-C114 PolarHBondContact O-N 3.11Å; A110-C114 PolarHBondContact O-SG 3.49Å; A110-R201 VanDerWaalsContact C-CD 3.5Å; A110-R201 HydrophobicContact CB-CB 4.36Å; A110-R201 HydrophobicContact CB-CG 3.86Å; A110-I302 HydrophobicContact CB-CG2 4.16Å; A110-I306 HydrophobicContact CB-CD1 4.21Å
111	K	98.6	Very high	97.6	Very high	110 Å²	110	60.3 Å²	60.3	48%	0.478	28%	0.278	S	S	.	.	H	α-helix	trans	-69.9	-37.5	174.1	-174.4	-167.5	172.9	-167.9	0	111.7	L107 Q108 Y109 R115 R201	L107-K111 WeakPolarHBondContact O-CB 3.46Å; L107-K111 PolarHBondContact O-N 3.13Å; L107-K111 VanDerWaalsContact O-N 3.13Å; Q108-K111 WeakPolarHBondContact O-CB 3.44Å; Q108-K111 PolarHBondContact O-N 3.34Å; Q108-K111 VanDerWaalsContact O-N 3.14Å; Y109-K111 PolarHBondContact O-N 3.12Å; K111-R115 PolarHBondContact O-N 2.98Å; K111-R115 VanDerWaalsContact O-N 3.16Å; K111-R201 VanDerWaalsContact N-CD 3.29Å
112	M	98.5	Very high	97.9	Very high	102 Å²	102	57.9 Å²	57.9	50%	0.502	27%	0.272	S	S	.	.	H	α-helix	trans	-68.3	-44	174.6	-66.5	-172.9	-62.5	0	0	111	Q108 Y109 R115 Y116	Q108-M112 HydrophobicContact CG-CE 4.48Å; Q108-M112 WeakPolarHBondContact O-CG 3.35Å; Q108-M112 PolarHBondContact O-N 2.91Å; Y109-M112 HydrophobicContact CD2-CE 4.25Å; Y109-M112 WeakPolarHBondContact O-CA 3.31Å; Y109-M112 WeakPolarHBondContact O-CB 3.2Å; Y109-M112 PolarHBondContact O-N 3.46Å; M112-R115 WeakPolarHBondContact O-CB 3.47Å; M112-R115 PolarHBondContact O-N 3.44Å; M112-R115 VanDerWaalsContact O-N 3.11Å; M112-Y116 PolarHBondContact O-N 3.07Å
113	W	98.7	Very high	98.1	Very high	10 Å²	10	64.3 Å²	64.3	4%	0.038	30%	0.297	C	S	.	.	H	α-helix	trans	-57.2	-50.9	174.3	-165.8	100.7	0	0	0	111.8	Y109 R115 Y116 A117 L190 R194 I197 I306 G309 D310	Y109-W113 PolarHBondContact O-N 3.28Å; W113-R115 PolarHBondContact O-N 3.21Å; W113-Y116 PolarHBondContact O-N 3.5Å; W113-Y116 VanDerWaalsContact O-N 3.16Å; W113-A117 HydrophobicContact CE3-CB 4.09Å; W113-A117 HydrophobicContact CH2-CB 3.95Å; W113-A117 HydrophobicContact CZ3-CB 3.68Å; W113-A117 PolarHBondContact O-N 3.18Å; W113-L190 HydrophobicContact CH2-CD1 4.07Å; W113-R194 HydrophobicContact CZ3-CB 4.31Å; W113-R194 HydrophobicContact CZ3-CG 4.33Å; W113-I197 HydrophobicContact CE3-CD1 3.95Å; W113-I197 HydrophobicContact CH2-CD1 3.99Å; W113-I197 HydrophobicContact CZ3-CD1 3.67Å; W113-I306 HydrophobicContact CB-CD1 3.87Å; W113-I306 HydrophobicContact CD2-CD1 4.45Å; W113-I306 HydrophobicContact CG-CD1 3.82Å; W113-G309 VanDerWaalsContact CZ2-C 3.44Å; W113-G309 WeakPolarHBondContact CZ2-O 3.35Å; W113-D310 PolarHBondContact NE1-OD1 2.9Å
114	C	98.7	Very high	98.1	Very high	11 Å²	11	64.9 Å²	64.9	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-24.1	177	-71.3	0	0	0	0	113.8	A110 K118 R194 D198	A110-C114 WeakPolarHBondContact O-CB 3.27Å; A110-C114 PolarHBondContact O-N 3.11Å; A110-C114 PolarHBondContact O-SG 3.49Å; C114-K118 WeakPolarHBondContact O-CB 3.29Å; C114-K118 PolarHBondContact O-N 2.73Å; C114-R194 HydrophobicContact CB-CG 4.34Å; C114-R194 WeakPolarHBondContact O-CD 3.42Å; C114-D198 HydrophobicContact CB-CB 4.37Å
115	R	98.5	Very high	98.2	Very high	177 Å²	177	66.9 Å²	66.9	67%	0.668	31%	0.308	S	S	*	.	H	α-helix	trans	-75.3	-51.2	170.2	177.7	-179.5	174.5	178.5	-0.5	110.9	K111 M112 W113 A117 K118 D119	K111-R115 PolarHBondContact O-N 2.98Å; K111-R115 VanDerWaalsContact O-N 3.16Å; M112-R115 WeakPolarHBondContact O-CB 3.47Å; M112-R115 PolarHBondContact O-N 3.44Å; M112-R115 VanDerWaalsContact O-N 3.11Å; W113-R115 PolarHBondContact O-N 3.21Å; R115-A117 PolarHBondContact O-N 3.23Å; R115-K118 WeakPolarHBondContact O-CA 3.32Å; R115-K118 VanDerWaalsContact O-CB 3.32Å; R115-K118 WeakPolarHBondContact O-CB 3.38Å; R115-K118 PolarHBondContact O-N 2.7Å; R115-D119 WeakPolarHBondContact CG-OD2 3.4Å; R115-D119 IonicContact NE-OD2 3.23Å; R115-D119 PolarHBondContact O-N 3.22Å
116	Y	98.7	Very high	98.3	Very high	135 Å²	135	68.3 Å²	68.3	53%	0.529	31%	0.309	S	S	.	.	H	α-helix	trans	-54.8	-51.1	179.5	174.2	-118.6	0	0	0	111.8	M112 W113 K118 D119 L120 L313	M112-Y116 PolarHBondContact O-N 3.07Å; W113-Y116 PolarHBondContact O-N 3.5Å; W113-Y116 VanDerWaalsContact O-N 3.16Å; Y116-K118 VanDerWaalsContact C-N 3.28Å; Y116-K118 PolarHBondContact O-N 2.93Å; Y116-D119 PolarHBondContact O-N 2.81Å; Y116-D119 VanDerWaalsContact O-N 3.13Å; Y116-L120 HydrophobicContact CD1-CD1 4.24Å; Y116-L120 HydrophobicContact CD2-CG 4.45Å; Y116-L120 HydrophobicContact CE1-CD1 3.74Å; Y116-L120 HydrophobicContact CE2-CD1 4.17Å; Y116-L120 HydrophobicContact CE2-CD2 4.24Å; Y116-L120 HydrophobicContact CE2-CG 4.11Å; Y116-L120 WeakPolarHBondContact O-CG 3.35Å; Y116-L120 PolarHBondContact O-N 3.34Å; Y116-L313 HydrophobicContact CE1-CD2 3.99Å
117	A	98.4	Very high	98.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-30.6	175.7	0	0	0	0	0	113.2	W113 R115 L121 L190 R194	W113-A117 HydrophobicContact CE3-CB 4.09Å; W113-A117 HydrophobicContact CH2-CB 3.95Å; W113-A117 HydrophobicContact CZ3-CB 3.68Å; W113-A117 PolarHBondContact O-N 3.18Å; R115-A117 PolarHBondContact O-N 3.23Å; A117-L121 WeakPolarHBondContact O-CB 3.5Å; A117-L121 VanDerWaalsContact O-CD1 3.25Å; A117-L121 WeakPolarHBondContact O-CD1 3.32Å; A117-L121 WeakPolarHBondContact O-CG 3.28Å; A117-L121 PolarHBondContact O-N 3.36Å; A117-L190 HydrophobicContact CB-CD1 4.34Å; A117-R194 HydrophobicContact CB-CB 4.4Å; A117-R194 HydrophobicContact CB-CG 3.92Å
118	K	98.5	Very high	98.1	Very high	121 Å²	121	70.6 Å²	70.6	53%	0.526	32%	0.315	S	S	.	.	H	α-helix	trans	-67.6	-44.3	172.9	-174.8	-160.8	171	-163.4	0	111.3	C114 R115 Y116 L121 A122	C114-K118 WeakPolarHBondContact O-CB 3.29Å; C114-K118 PolarHBondContact O-N 2.73Å; R115-K118 WeakPolarHBondContact O-CA 3.32Å; R115-K118 VanDerWaalsContact O-CB 3.32Å; R115-K118 WeakPolarHBondContact O-CB 3.38Å; R115-K118 PolarHBondContact O-N 2.7Å; Y116-K118 VanDerWaalsContact C-N 3.28Å; Y116-K118 PolarHBondContact O-N 2.93Å; K118-L121 PolarHBondContact O-N 3.25Å; K118-A122 PolarHBondContact O-N 2.84Å
119	D	98.4	Very high	98.1	Very high	79 Å²	79	68.5 Å²	68.5	42%	0.422	31%	0.311	S	S	.	.	H	α-helix	trans	-70.1	-35.3	-177	-63.2	-19.9	0	0	0	110.3	R115 Y116 W123	R115-D119 WeakPolarHBondContact CG-OD2 3.4Å; R115-D119 IonicContact NE-OD2 3.23Å; R115-D119 PolarHBondContact O-N 3.22Å; Y116-D119 PolarHBondContact O-N 2.81Å; Y116-D119 VanDerWaalsContact O-N 3.13Å; D119-W123 PolarHBondContact O-N 3.23Å
120	L	98.2	Very high	98.1	Very high	46 Å²	46	67.1 Å²	67.1	24%	0.241	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-48.9	166.7	-71.2	-179	0	0	0	112.8	Y116 A122 W123 M124 L313	Y116-L120 HydrophobicContact CD1-CD1 4.24Å; Y116-L120 HydrophobicContact CD2-CG 4.45Å; Y116-L120 HydrophobicContact CE1-CD1 3.74Å; Y116-L120 HydrophobicContact CE2-CD1 4.17Å; Y116-L120 HydrophobicContact CE2-CD2 4.24Å; Y116-L120 HydrophobicContact CE2-CG 4.11Å; Y116-L120 WeakPolarHBondContact O-CG 3.35Å; Y116-L120 PolarHBondContact O-N 3.34Å; L120-A122 VanDerWaalsContact C-N 3.29Å; L120-A122 PolarHBondContact O-N 3.49Å; L120-W123 WeakPolarHBondContact O-CB 3Å; L120-W123 PolarHBondContact O-N 3.32Å; L120-W123 VanDerWaalsContact O-N 3.07Å; L120-M124 WeakPolarHBondContact O-CG 3.44Å; L120-M124 PolarHBondContact O-N 3.35Å; L120-L313 HydrophobicContact CD1-CD1 3.91Å; L120-L313 HydrophobicContact CD1-CD2 4.47Å
121	L	98.6	Very high	97.9	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-37.9	-180	-76.8	162.6	0	0	0	112.2	A117 K118 W123 M124 E125 Y187 L190 A191	A117-L121 WeakPolarHBondContact O-CB 3.5Å; A117-L121 VanDerWaalsContact O-CD1 3.25Å; A117-L121 WeakPolarHBondContact O-CD1 3.32Å; A117-L121 WeakPolarHBondContact O-CG 3.28Å; A117-L121 PolarHBondContact O-N 3.36Å; K118-L121 PolarHBondContact O-N 3.25Å; L121-W123 VanDerWaalsContact C-N 3.31Å; L121-W123 PolarHBondContact O-N 3.42Å; L121-M124 HydrophobicContact CD2-SD 4.28Å; L121-M124 PolarHBondContact O-N 2.94Å; L121-E125 WeakPolarHBondContact O-CB 3.45Å; L121-E125 PolarHBondContact O-N 3.11Å; L121-Y187 HydrophobicContact CB-CD2 4.29Å; L121-Y187 HydrophobicContact CB-CE2 3.88Å; L121-Y187 HydrophobicContact CD2-CD2 3.4Å; L121-Y187 HydrophobicContact CD2-CE2 3.67Å; L121-Y187 HydrophobicContact CD2-CG 3.94Å; L121-Y187 VanDerWaalsContact CD2-O 3.27Å; L121-Y187 WeakPolarHBondContact CD2-O 3.35Å; L121-Y187 HydrophobicContact CG-CD2 4.46Å; L121-Y187 HydrophobicContact CG-CE2 4.37Å; L121-Y187 WeakPolarHBondContact O-CE2 3.26Å; L121-L190 HydrophobicContact CD1-CG 4.22Å; L121-L190 HydrophobicContact CD2-CB 4.08Å; L121-L190 HydrophobicContact CD2-CD2 4.03Å; L121-L190 HydrophobicContact CD2-CG 4.08Å; L121-L190 HydrophobicContact CG-CD2 4.04Å; L121-L190 HydrophobicContact CG-CG 4.15Å; L121-A191 HydrophobicContact CD1-CB 3.95Å; L121-A191 HydrophobicContact CD2-CB 4.17Å
122	A	98.4	Very high	97.8	Very high	53 Å²	53	66.7 Å²	66.7	44%	0.438	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-34.7	174.9	0	0	0	0	0	112.6	K118 L120 K126	K118-A122 PolarHBondContact O-N 2.84Å; L120-A122 VanDerWaalsContact C-N 3.29Å; L120-A122 PolarHBondContact O-N 3.49Å; A122-K126 WeakPolarHBondContact O-CB 3.19Å; A122-K126 PolarHBondContact O-N 3.01Å
123	W	98.1	Very high	97.8	Very high	135 Å²	135	66.8 Å²	66.8	51%	0.511	31%	0.31	S	S	.	.	H	α-helix	trans	-69	-44.9	170.4	168	85.4	0	0	0	111.9	D119 L120 L121 K126 R127 M320	D119-W123 PolarHBondContact O-N 3.23Å; L120-W123 WeakPolarHBondContact O-CB 3Å; L120-W123 PolarHBondContact O-N 3.32Å; L120-W123 VanDerWaalsContact O-N 3.07Å; L121-W123 VanDerWaalsContact C-N 3.31Å; L121-W123 PolarHBondContact O-N 3.42Å; W123-K126 PolarHBondContact O-N 3.41Å; W123-R127 WeakPolarHBondContact O-CB 3.04Å; W123-R127 PolarHBondContact O-N 2.85Å; W123-M320 HydrophobicContact CH2-CE 3.94Å; W123-M320 HydrophobicContact CH2-SD 4.05Å; W123-M320 HydrophobicContact CZ3-CE 3.99Å; W123-M320 HydrophobicContact CZ3-SD 3.91Å
124	M	97.7	Very high	97.7	Very high	12 Å²	12	72.9 Å²	72.9	6%	0.059	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-50.5	178	-68	176.3	77.6	0	0	111.7	L120 L121 K126 R127 I128 C186 Y187 L190 M320	L120-M124 WeakPolarHBondContact O-CG 3.44Å; L120-M124 PolarHBondContact O-N 3.35Å; L121-M124 HydrophobicContact CD2-SD 4.28Å; L121-M124 PolarHBondContact O-N 2.94Å; M124-K126 VanDerWaalsContact C-N 3.29Å; M124-K126 PolarHBondContact O-N 3.12Å; M124-R127 PolarHBondContact O-N 2.85Å; M124-I128 WeakPolarHBondContact O-CB 2.94Å; M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.37Å; M124-I128 PolarHBondContact O-N 3.13Å; M124-C186 HydrophobicContact CE-CB 3.72Å; M124-Y187 HydrophobicContact CB-CD2 4.19Å; M124-L190 HydrophobicContact SD-CD2 4.22Å; M124-M320 HydrophobicContact CE-SD 4.28Å
125	E	97.7	Very high	97.6	Very high	105 Å²	105	72.4 Å²	72.4	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-55.5	-45.5	175.7	-178.9	-180	-143.9	0	0	110.8	L121 I128 S129 Y187	L121-E125 WeakPolarHBondContact O-CB 3.45Å; L121-E125 PolarHBondContact O-N 3.11Å; E125-I128 PolarHBondContact O-N 2.88Å; E125-S129 VanDerWaalsContact O-CB 3.27Å; E125-S129 WeakPolarHBondContact O-CB 3.34Å; E125-S129 PolarHBondContact O-N 2.86Å; E125-Y187 HydrophobicContact CB-CD2 4.35Å; E125-Y187 HydrophobicContact CB-CE2 3.84Å
126	K	98.1	Very high	97.6	Very high	101 Å²	101	70.9 Å²	70.9	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-70.2	-35	-179.8	-172.1	61.7	-154.6	143.3	0	113	A122 W123 M124 S129 L130	A122-K126 WeakPolarHBondContact O-CB 3.19Å; A122-K126 PolarHBondContact O-N 3.01Å; W123-K126 PolarHBondContact O-N 3.41Å; M124-K126 VanDerWaalsContact C-N 3.29Å; M124-K126 PolarHBondContact O-N 3.12Å; K126-S129 PolarHBondContact NZ-OG 3.48Å; K126-L130 HydrophobicContact CG-CD1 4.31Å; K126-L130 VanDerWaalsContact O-CG 3.31Å; K126-L130 WeakPolarHBondContact O-CG 3.46Å; K126-L130 PolarHBondContact O-N 3.49Å; K126-L130 VanDerWaalsContact O-N 3.09Å
127	R	96.1	Very high	97.6	Very high	62 Å²	62	68.6 Å²	68.6	23%	0.234	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-50.9	173.9	-169.9	-164.6	160.7	-65.7	-13.2	110.5	W123 M124 S129 L130 E131	W123-R127 WeakPolarHBondContact O-CB 3.04Å; W123-R127 PolarHBondContact O-N 2.85Å; M124-R127 PolarHBondContact O-N 2.85Å; R127-S129 VanDerWaalsContact C-N 3.34Å; R127-S129 PolarHBondContact O-N 3.34Å; R127-L130 PolarHBondContact O-N 3.1Å; R127-E131 IonicContact CZ-OE2 2.81Å; R127-E131 VanDerWaalsContact CZ-OE2 3.22Å; R127-E131 IonicContact NH1-OE2 2.69Å; R127-E131 PolarHBondContact NH1-OE2 3.24Å; R127-E131 IonicContact NH2-OE1 3.52Å; R127-E131 IonicContact NH2-OE2 2.62Å; R127-E131 PolarHBondContact NH2-OE2 2.77Å; R127-E131 PolarHBondContact O-N 3.06Å
128	I	96.5	Very high	97.5	Very high	6 Å²	6	70.2 Å²	70.2	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-44.4	177.9	-67.2	166	0	0	0	110.6	M124 E125 L130 E131 Q132 L182 Q183	M124-I128 WeakPolarHBondContact O-CB 2.94Å; M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.37Å; M124-I128 PolarHBondContact O-N 3.13Å; E125-I128 PolarHBondContact O-N 2.88Å; I128-L130 VanDerWaalsContact C-N 3.35Å; I128-L130 PolarHBondContact O-N 3.37Å; I128-E131 PolarHBondContact O-N 3.23Å; I128-Q132 HydrophobicContact CG2-CG 4.4Å; I128-Q132 WeakPolarHBondContact O-CB 3.46Å; I128-Q132 WeakPolarHBondContact O-CG 3.26Å; I128-Q132 PolarHBondContact O-N 3.25Å; I128-L182 HydrophobicContact CD1-CB 3.99Å; I128-L182 HydrophobicContact CG1-CB 4.27Å; I128-Q183 HydrophobicContact CD1-CB 4.46Å
129	S	97.4	Very high	97.5	Very high	47 Å²	47	65.5 Å²	65.5	33%	0.329	32%	0.318	S	S	.	.	H	α-helix	trans	-57.1	-42.6	175	158.9	0	0	0	0	113.3	E125 K126 R127 E133	E125-S129 VanDerWaalsContact O-CB 3.27Å; E125-S129 WeakPolarHBondContact O-CB 3.34Å; E125-S129 PolarHBondContact O-N 2.86Å; K126-S129 PolarHBondContact NZ-OG 3.48Å; R127-S129 VanDerWaalsContact C-N 3.34Å; R127-S129 PolarHBondContact O-N 3.34Å; S129-E133 WeakPolarHBondContact O-CB 3.48Å; S129-E133 PolarHBondContact O-N 3.02Å; S129-E133 VanDerWaalsContact O-N 3.15Å
130	L	97.3	Very high	97.4	Very high	92 Å²	92	69 Å²	69	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-72.2	-38.2	179.8	-72.4	168.3	0	0	0	112	K126 R127 I128 E133 F134	K126-L130 HydrophobicContact CG-CD1 4.31Å; K126-L130 VanDerWaalsContact O-CG 3.31Å; K126-L130 WeakPolarHBondContact O-CG 3.46Å; K126-L130 PolarHBondContact O-N 3.49Å; K126-L130 VanDerWaalsContact O-N 3.09Å; R127-L130 PolarHBondContact O-N 3.1Å; I128-L130 VanDerWaalsContact C-N 3.35Å; I128-L130 PolarHBondContact O-N 3.37Å; L130-E133 PolarHBondContact O-N 3.37Å; L130-F134 WeakPolarHBondContact O-CB 3.41Å; L130-F134 PolarHBondContact O-N 3.26Å
131	E	95.4	Very high	97.4	Very high	28 Å²	28	69.9 Å²	69.9	13%	0.131	34%	0.344	C	S	.	.	H	α-helix	trans	-67.5	-42.9	178.4	-173.6	158.9	-141.8	0	0	111.8	R127 I128 E133 F134 A135 S175 Q327	R127-E131 IonicContact CZ-OE2 2.81Å; R127-E131 VanDerWaalsContact CZ-OE2 3.22Å; R127-E131 IonicContact NH1-OE2 2.69Å; R127-E131 PolarHBondContact NH1-OE2 3.24Å; R127-E131 IonicContact NH2-OE1 3.52Å; R127-E131 IonicContact NH2-OE2 2.62Å; R127-E131 PolarHBondContact NH2-OE2 2.77Å; R127-E131 PolarHBondContact O-N 3.06Å; I128-E131 PolarHBondContact O-N 3.23Å; E131-E133 VanDerWaalsContact C-N 3.35Å; E131-E133 PolarHBondContact O-N 3.42Å; E131-F134 PolarHBondContact O-N 2.88Å; E131-A135 WeakPolarHBondContact O-CB 3.5Å; E131-A135 PolarHBondContact O-N 2.83Å; E131-S175 WeakPolarHBondContact CG-OG 3.48Å; E131-Q327 PolarHBondContact OE1-NE2 2.64Å; E131-Q327 PolarHBondContact OE1-OE1 3.07Å
132	Q	96.4	Very high	97.4	Very high	75 Å²	75	69.9 Å²	69.9	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-39.4	171.9	-71.1	177.5	-0.9	0	0	112.7	I128 K136	I128-Q132 HydrophobicContact CG2-CG 4.4Å; I128-Q132 WeakPolarHBondContact O-CB 3.46Å; I128-Q132 WeakPolarHBondContact O-CG 3.26Å; I128-Q132 PolarHBondContact O-N 3.25Å; Q132-K136 WeakPolarHBondContact O-CB 3.26Å; Q132-K136 PolarHBondContact O-N 2.94Å; Q132-K136 VanDerWaalsContact O-N 3.09Å
133	E	97.6	Very high	97.3	Very high	105 Å²	105	72 Å²	72	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-67.5	-44	176.4	-177.7	169.8	-163.5	0	0	111.7	S129 L130 E131 N137	S129-E133 WeakPolarHBondContact O-CB 3.48Å; S129-E133 PolarHBondContact O-N 3.02Å; S129-E133 VanDerWaalsContact O-N 3.15Å; L130-E133 PolarHBondContact O-N 3.37Å; E131-E133 VanDerWaalsContact C-N 3.35Å; E131-E133 PolarHBondContact O-N 3.42Å; E133-N137 WeakPolarHBondContact O-CB 3.48Å; E133-N137 PolarHBondContact O-N 2.8Å; E133-N137 PolarHBondContact O-ND2 2.81Å; E133-N137 VanDerWaalsContact O-ND2 3.13Å
134	F	97.1	Very high	97.1	Very high	138 Å²	138	67.7 Å²	67.7	61%	0.605	34%	0.342	S	S	*	.	H	α-helix	trans	-59.7	-56.5	175.5	175.2	-101.6	0	0	0	111.7	L130 E131 K136 N137 V138	L130-F134 WeakPolarHBondContact O-CB 3.41Å; L130-F134 PolarHBondContact O-N 3.26Å; E131-F134 PolarHBondContact O-N 2.88Å; F134-K136 VanDerWaalsContact C-N 3.28Å; F134-K136 PolarHBondContact O-N 3.31Å; F134-N137 PolarHBondContact O-N 3.39Å; F134-V138 HydrophobicContact CD1-CG2 4.44Å; F134-V138 HydrophobicContact CD2-CG2 4.18Å; F134-V138 HydrophobicContact CE1-CG2 4.05Å; F134-V138 HydrophobicContact CE2-CG2 3.77Å; F134-V138 HydrophobicContact CZ-CG2 3.7Å; F134-V138 WeakPolarHBondContact O-CG2 3.29Å; F134-V138 PolarHBondContact O-N 3.27Å
135	A	97	Very high	97.1	Very high	1 Å²	1	69 Å²	69	1%	0.008	36%	0.355	C	S	.	.	H	α-helix	trans	-58.4	-39.4	-179.3	0	0	0	0	0	112.2	E131 M139 S172 R176	E131-A135 WeakPolarHBondContact O-CB 3.5Å; E131-A135 PolarHBondContact O-N 2.83Å; A135-M139 WeakPolarHBondContact O-CB 3.34Å; A135-M139 PolarHBondContact O-N 3.41Å; A135-S172 WeakPolarHBondContact O-CB 3.28Å; A135-S172 PolarHBondContact O-OG 3.38Å; A135-R176 HydrophobicContact CB-CG 4.31Å
136	K	97.7	Very high	97	Very high	145 Å²	145	66.7 Å²	66.7	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-64.2	-40.1	175.1	179.2	-178.3	177.3	-176.7	0	112.8	Q132 F134 K140	Q132-K136 WeakPolarHBondContact O-CB 3.26Å; Q132-K136 PolarHBondContact O-N 2.94Å; Q132-K136 VanDerWaalsContact O-N 3.09Å; F134-K136 VanDerWaalsContact C-N 3.28Å; F134-K136 PolarHBondContact O-N 3.31Å; K136-K140 WeakPolarHBondContact O-CB 3.22Å; K136-K140 PolarHBondContact O-N 2.62Å; K136-K140 VanDerWaalsContact O-N 3.13Å
137	N	98.2	Very high	96.6	Very high	87 Å²	87	65.8 Å²	65.8	47%	0.465	35%	0.346	S	S	.	.	H	α-helix	trans	-73.8	-41.7	-178.5	-71.4	-26.1	0	0	0	111.8	E133 F134 K140 A141	E133-N137 WeakPolarHBondContact O-CB 3.48Å; E133-N137 PolarHBondContact O-N 2.8Å; E133-N137 PolarHBondContact O-ND2 2.81Å; E133-N137 VanDerWaalsContact O-ND2 3.13Å; F134-N137 PolarHBondContact O-N 3.39Å; N137-K140 PolarHBondContact O-N 3.11Å; N137-A141 WeakPolarHBondContact O-CB 3.41Å; N137-A141 PolarHBondContact O-N 3.12Å
138	V	97.9	Very high	96.4	Very high	34 Å²	34	66.3 Å²	66.3	21%	0.206	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-51.5	173.8	174	0	0	0	0	110.7	F134 K140 A141 A142 D168	F134-V138 HydrophobicContact CD1-CG2 4.44Å; F134-V138 HydrophobicContact CD2-CG2 4.18Å; F134-V138 HydrophobicContact CE1-CG2 4.05Å; F134-V138 HydrophobicContact CE2-CG2 3.77Å; F134-V138 HydrophobicContact CZ-CG2 3.7Å; F134-V138 WeakPolarHBondContact O-CG2 3.29Å; F134-V138 PolarHBondContact O-N 3.27Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 3.14Å; V138-A141 PolarHBondContact O-N 3.22Å; V138-A141 VanDerWaalsContact O-N 3.11Å; V138-A142 WeakPolarHBondContact O-CB 3.29Å; V138-A142 PolarHBondContact O-N 2.74Å; V138-D168 HydrophobicContact CG1-CB 4.1Å
139	M	97.3	Very high	96.2	Very high	21 Å²	21	67.9 Å²	67.9	10%	0.103	37%	0.369	C	S	.	.	H	α-helix	trans	-53.4	-47.1	177.3	-173.2	-179.6	-57.5	0	0	112.2	A135 A141 A142 E143 I169 L173	A135-M139 WeakPolarHBondContact O-CB 3.34Å; A135-M139 PolarHBondContact O-N 3.41Å; M139-A141 PolarHBondContact O-N 3.4Å; M139-A142 PolarHBondContact O-N 2.77Å; M139-E143 WeakPolarHBondContact O-CB 3.33Å; M139-E143 VanDerWaalsContact O-CG 3.29Å; M139-E143 WeakPolarHBondContact O-CG 3.47Å; M139-E143 PolarHBondContact O-N 2.69Å; M139-I169 HydrophobicContact CG-CG2 4.41Å; M139-L173 HydrophobicContact CE-CB 4.39Å; M139-L173 HydrophobicContact CE-CD2 3.74Å; M139-L173 HydrophobicContact CE-CG 3.72Å; M139-L173 HydrophobicContact SD-CD2 4.25Å
140	K	97.7	Very high	95.9	Very high	153 Å²	153	69 Å²	69	67%	0.665	37%	0.374	S	S	*	.	H	α-helix	trans	-64.6	-39.8	178.3	-172.7	-164	171.8	-157.7	0	112.7	K136 N137 V138 G144	K136-K140 WeakPolarHBondContact O-CB 3.22Å; K136-K140 PolarHBondContact O-N 2.62Å; K136-K140 VanDerWaalsContact O-N 3.13Å; N137-K140 PolarHBondContact O-N 3.11Å; V138-K140 VanDerWaalsContact C-N 3.32Å; V138-K140 PolarHBondContact O-N 3.14Å; K140-G144 PolarHBondContact O-N 3.11Å; K140-G144 VanDerWaalsContact O-N 3.08Å
141	A	97.6	Very high	95.5	Very high	65 Å²	65	70.9 Å²	70.9	54%	0.537	38%	0.381	S	S	.	.	H	α-helix	trans	-66	-45	177	0	0	0	0	0	110.9	N137 V138 M139 G144 A145	N137-A141 WeakPolarHBondContact O-CB 3.41Å; N137-A141 PolarHBondContact O-N 3.12Å; V138-A141 PolarHBondContact O-N 3.22Å; V138-A141 VanDerWaalsContact O-N 3.11Å; M139-A141 PolarHBondContact O-N 3.4Å; A141-G144 PolarHBondContact O-N 3.43Å; A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 2.73Å
142	A	97.6	Very high	95	Very high	3 Å²	3	74.9 Å²	74.9	3%	0.025	40%	0.399	C	S	.	.	H	α-helix	trans	-65	-43.7	179.3	0	0	0	0	0	112.6	V138 M139 G144 A145 K146 L165 D168 I169	V138-A142 WeakPolarHBondContact O-CB 3.29Å; V138-A142 PolarHBondContact O-N 2.74Å; M139-A142 PolarHBondContact O-N 2.77Å; A142-G144 PolarHBondContact O-N 2.57Å; A142-A145 PolarHBondContact O-N 3.5Å; A142-K146 WeakPolarHBondContact O-CB 3.17Å; A142-K146 PolarHBondContact O-N 3.47Å; A142-L165 HydrophobicContact CB-CB 4.46Å; A142-L165 HydrophobicContact CB-CD2 4.07Å; A142-D168 HydrophobicContact CB-CB 4.06Å; A142-I169 HydrophobicContact CB-CD1 4.23Å; A142-I169 HydrophobicContact CB-CG1 3.76Å
143	E	96.4	Very high	94.3	Very high	98 Å²	98	78.7 Å²	78.7	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-58.1	-45.8	172	-76.1	174.1	174.1	0	0	111.9	M139 K146 V147 I169	M139-E143 WeakPolarHBondContact O-CB 3.33Å; M139-E143 VanDerWaalsContact O-CG 3.29Å; M139-E143 WeakPolarHBondContact O-CG 3.47Å; M139-E143 PolarHBondContact O-N 2.69Å; E143-K146 PolarHBondContact O-N 2.85Å; E143-V147 PolarHBondContact O-N 3.23Å; E143-I169 HydrophobicContact CG-CD1 3.78Å; E143-I169 HydrophobicContact CG-CG1 4.2Å
144	G	95.5	Very high	93.6	Very high	43 Å²	43	76.9 Å²	76.9	44%	0.443	41%	0.409	S	S	.	.	H	α-helix	trans	-62.9	-47.6	179	0	0	0	0	0	112.9	K140 A141 A142	K140-G144 PolarHBondContact O-N 3.11Å; K140-G144 VanDerWaalsContact O-N 3.08Å; A141-G144 PolarHBondContact O-N 3.43Å; A142-G144 PolarHBondContact O-N 2.57Å
145	A	95.9	Very high	93.3	Very high	41 Å²	41	74.5 Å²	74.5	34%	0.339	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-37.8	177.6	0	0	0	0	0	112.3	A141 A142 V147 S148 V149 L165	A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 2.73Å; A142-A145 PolarHBondContact O-N 3.5Å; A145-V147 VanDerWaalsContact C-N 3.31Å; A145-V147 PolarHBondContact O-N 3.04Å; A145-S148 WeakPolarHBondContact O-CB 3.3Å; A145-S148 PolarHBondContact O-N 2.89Å; A145-V149 WeakPolarHBondContact O-CG2 3.07Å; A145-V149 PolarHBondContact O-N 2.9Å; A145-L165 HydrophobicContact CB-CD1 4.07Å; A145-L165 HydrophobicContact CB-CD2 3.9Å
146	K	95.5	Very high	92.9	Very high	55 Å²	55	78.7 Å²	78.7	24%	0.239	43%	0.428	C	S	.	.	H	α-helix	trans	-61.4	-37.9	-179.7	-174.2	-177.1	-178.6	-172.4	0	112.4	A142 E143 S148 V149 T150 T162 L165 E166 I169	A142-K146 WeakPolarHBondContact O-CB 3.17Å; A142-K146 PolarHBondContact O-N 3.47Å; E143-K146 PolarHBondContact O-N 2.85Å; K146-S148 VanDerWaalsContact C-N 3.3Å; K146-S148 PolarHBondContact O-N 3.13Å; K146-V149 PolarHBondContact O-N 3.28Å; K146-T150 HydrophobicContact CG-CG2 4.18Å; K146-T150 WeakPolarHBondContact O-CB 3.16Å; K146-T150 WeakPolarHBondContact O-CG2 3.37Å; K146-T150 PolarHBondContact O-N 3.48Å; K146-T150 PolarHBondContact O-OG1 3.28Å; K146-T162 HydrophobicContact CG-CG2 4.43Å; K146-L165 HydrophobicContact CB-CB 4.29Å; K146-L165 HydrophobicContact CB-CD1 4.19Å; K146-E166 HydrophobicContact CD-CG 4.23Å; K146-E166 VanDerWaalsContact CE-OE1 3.25Å; K146-E166 WeakPolarHBondContact CE-OE1 3.43Å; K146-E166 VanDerWaalsContact NZ-CG 3.27Å; K146-E166 IonicContact NZ-OE1 3.82Å; K146-E166 PolarHBondContact NZ-OE1 3.08Å; K146-I169 HydrophobicContact CD-CD1 4.5Å
147	V	91.6	Very high	92.6	Very high	83 Å²	83	74.4 Å²	74.4	50%	0.503	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-38	175.3	173.5	0	0	0	0	111.1	E143 A145 Q151	E143-V147 PolarHBondContact O-N 3.23Å; A145-V147 VanDerWaalsContact C-N 3.31Å; A145-V147 PolarHBondContact O-N 3.04Å; V147-Q151 VanDerWaalsContact O-CG 3.26Å; V147-Q151 WeakPolarHBondContact O-CG 3.25Å; V147-Q151 PolarHBondContact O-NE2 2.96Å
148	S	91.3	Very high	92.3	Very high	72 Å²	72	72.6 Å²	72.6	50%	0.503	40%	0.401	S	S	.	.	H	α-helix	trans	-72	-45.4	176.5	-57.5	0	0	0	0	112.5	A145 K146 Q151	A145-S148 WeakPolarHBondContact O-CB 3.3Å; A145-S148 PolarHBondContact O-N 2.89Å; K146-S148 VanDerWaalsContact C-N 3.3Å; K146-S148 PolarHBondContact O-N 3.13Å; S148-Q151 PolarHBondContact O-N 3.05Å
149	V	92.8	Very high	92	Very high	39 Å²	39	78.3 Å²	78.3	24%	0.236	42%	0.42	C	S	.	.	H	α-helix	trans	-65.8	-42.2	-178.2	173.7	0	0	0	0	111.6	A145 K146 Q151 Q152 Q158 L165	A145-V149 WeakPolarHBondContact O-CG2 3.07Å; A145-V149 PolarHBondContact O-N 2.9Å; K146-V149 PolarHBondContact O-N 3.28Å; V149-Q151 PolarHBondContact O-N 2.89Å; V149-Q152 PolarHBondContact O-N 3.31Å; V149-Q158 HydrophobicContact CG1-CG 3.86Å; V149-Q158 WeakPolarHBondContact O-CG 3.43Å; V149-Q158 PolarHBondContact O-NE2 3.25Å; V149-L165 HydrophobicContact CG2-CD1 4.15Å
150	T	89.4	Confident	91.8	Very high	71 Å²	71	78 Å²	78	44%	0.436	42%	0.418	S	S	.	.	H	α-helix	trans	-70.6	-15.5	-178.4	52.1	0	0	0	0	114	K146 T162	K146-T150 HydrophobicContact CG-CG2 4.18Å; K146-T150 WeakPolarHBondContact O-CB 3.16Å; K146-T150 WeakPolarHBondContact O-CG2 3.37Å; K146-T150 PolarHBondContact O-N 3.48Å; K146-T150 PolarHBondContact O-OG1 3.28Å; T150-T162 HydrophobicContact CG2-CG2 3.81Å
151	Q	89.3	Confident	91.7	Very high	132 Å²	132	77.1 Å²	77.1	62%	0.617	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-15	174.3	-72.2	171.9	25.6	0	0	114.3	V147 S148 V149 E153	V147-Q151 VanDerWaalsContact O-CG 3.26Å; V147-Q151 WeakPolarHBondContact O-CG 3.25Å; V147-Q151 PolarHBondContact O-NE2 2.96Å; S148-Q151 PolarHBondContact O-N 3.05Å; V149-Q151 PolarHBondContact O-N 2.89Å; Q151-E153 PolarHBondContact O-N 2.79Å
152	Q	85.6	Confident	91.5	Very high	111 Å²	111	75 Å²	75	52%	0.519	39%	0.392	S	S	.	.	S	Bend	trans	-98.7	77.4	-172.7	-61	-64.6	-30.5	0	0	111.6	V149 M155 Q158	V149-Q152 PolarHBondContact O-N 3.31Å; Q152-M155 HydrophobicContact CB-CG 3.64Å; Q152-M155 WeakPolarHBondContact O-CG 3.49Å; Q152-Q158 PolarHBondContact O-NE2 3.09Å; Q152-Q158 PolarHBondContact O-OE1 2.87Å
153	E	82.4	Confident	91.4	Very high	156 Å²	156	78 Å²	78	73%	0.729	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	146.5	176.9	-64.7	-178.7	174.2	0	0	112.8	Q151 M155	Q151-E153 PolarHBondContact O-N 2.79Å; E153-M155 PolarHBondContact O-N 3.45Å
154	M	81.7	Confident	91.4	Very high	66 Å²	66	75 Å²	75	33%	0.325	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	19.7	175.6	-48.2	-53.1	-61.9	0	0	115.6	P350 L353 Y354	M154-P350 WeakPolarHBondContact O-CB 3.44Å; M154-L353 HydrophobicContact CE-CB 3.32Å; M154-L353 HydrophobicContact CE-CD1 4.2Å; M154-L353 HydrophobicContact CE-CG 4.4Å; M154-Y354 HydrophobicContact CB-CD2 4.14Å; M154-Y354 HydrophobicContact CG-CD2 4.23Å
155	M	90.5	Very high	91.4	Very high	89 Å²	89	74.1 Å²	74.1	44%	0.438	38%	0.38	S	S	.	.			trans	-82.8	148.6	175.9	-71.1	-56.9	102.6	0	0	113.4	Q152 E153 Q158	Q152-M155 HydrophobicContact CB-CG 3.64Å; Q152-M155 WeakPolarHBondContact O-CG 3.49Å; E153-M155 PolarHBondContact O-N 3.45Å; M155-Q158 HydrophobicContact CB-CB 4.26Å; M155-Q158 WeakPolarHBondContact O-CB 3.42Å; M155-Q158 PolarHBondContact O-N 2.91Å
156	P	90.2	Very high	91.4	Very high	89 Å²	89	76.1 Å²	76.1	58%	0.578	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	138.4	174.2	26.9	-34.9	0	0	0	111.6	Q158	P156-Q158 PolarHBondContact O-N 3.11Å
157	L	91	Very high	91.4	Very high	55 Å²	55	74.5 Å²	74.5	29%	0.288	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	11.8	177.8	-51.6	175.4	0	0	0	115.5	Y159 I160 Y161 V345	L157-Y159 VanDerWaalsContact C-N 3.28Å; L157-Y159 PolarHBondContact O-N 3.09Å; L157-I160 HydrophobicContact CD2-CD1 3.67Å; L157-I160 PolarHBondContact O-N 3.44Å; L157-Y161 HydrophobicContact CB-CD2 3.8Å; L157-Y161 HydrophobicContact CB-CE2 3.87Å; L157-Y161 HydrophobicContact CD1-CE2 4.15Å; L157-Y161 WeakPolarHBondContact O-CD2 3.17Å; L157-Y161 PolarHBondContact O-N 3.43Å; L157-V345 HydrophobicContact CD2-CB 3.98Å; L157-V345 HydrophobicContact CD2-CG1 3.94Å; L157-V345 HydrophobicContact CD2-CG2 4.21Å
158	Q	91.9	Very high	91.6	Very high	48 Å²	48	72.4 Å²	72.4	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-51.8	-44.5	-175.9	-169.2	-159.1	8.5	0	0	112.7	V149 Q152 M155 P156 T162	V149-Q158 HydrophobicContact CG1-CG 3.86Å; V149-Q158 WeakPolarHBondContact O-CG 3.43Å; V149-Q158 PolarHBondContact O-NE2 3.25Å; Q152-Q158 PolarHBondContact O-NE2 3.09Å; Q152-Q158 PolarHBondContact O-OE1 2.87Å; M155-Q158 HydrophobicContact CB-CB 4.26Å; M155-Q158 WeakPolarHBondContact O-CB 3.42Å; M155-Q158 PolarHBondContact O-N 2.91Å; P156-Q158 PolarHBondContact O-N 3.11Å; Q158-T162 WeakPolarHBondContact O-CB 3.49Å; Q158-T162 PolarHBondContact O-N 2.98Å; Q158-T162 PolarHBondContact O-OG1 3.32Å
159	Y	90.9	Very high	91.9	Very high	154 Å²	154	70.3 Å²	70.3	60%	0.604	34%	0.344	S	S	*	.	H	α-helix	trans	-63.8	-46.3	177	174	-113.2	0	0	0	112.2	L157 T162 M163	L157-Y159 VanDerWaalsContact C-N 3.28Å; L157-Y159 PolarHBondContact O-N 3.09Å; Y159-T162 WeakPolarHBondContact O-CB 3.48Å; Y159-T162 PolarHBondContact O-N 2.98Å; Y159-M163 HydrophobicContact CD1-CG 4.49Å; Y159-M163 HydrophobicContact CD2-CG 4.2Å; Y159-M163 HydrophobicContact CE1-CG 4.04Å; Y159-M163 HydrophobicContact CE2-CG 3.69Å; Y159-M163 HydrophobicContact CE2-SD 3.85Å; Y159-M163 WeakPolarHBondContact O-CG 3.45Å; Y159-M163 PolarHBondContact O-N 2.92Å
160	I	93.1	Very high	92.1	Very high	15 Å²	15	74.2 Å²	74.2	8%	0.077	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-46.4	-179.6	-69.4	153.3	0	0	0	110.7	L157 T162 M163 T164 T341 C342 V345	L157-I160 HydrophobicContact CD2-CD1 3.67Å; L157-I160 PolarHBondContact O-N 3.44Å; I160-T162 VanDerWaalsContact C-N 3.28Å; I160-T162 PolarHBondContact O-N 3.3Å; I160-M163 PolarHBondContact O-N 3.32Å; I160-M163 VanDerWaalsContact O-N 3.15Å; I160-T164 PolarHBondContact O-N 3.11Å; I160-T164 PolarHBondContact O-OG1 3.24Å; I160-T164 VanDerWaalsContact O-OG1 3.05Å; I160-T341 HydrophobicContact CD1-CG2 4.41Å; I160-T341 HydrophobicContact CG1-CG2 3.95Å; I160-C342 HydrophobicContact CD1-CB 4.2Å; I160-C342 HydrophobicContact CG2-CB 4.3Å; I160-V345 HydrophobicContact CD1-CG2 3.6Å
161	Y	94.8	Very high	92.3	Very high	134 Å²	134	71.8 Å²	71.8	53%	0.525	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-37.4	174.2	-81.2	-70.9	0	0	0	112.1	L157 T164 L165	L157-Y161 HydrophobicContact CB-CD2 3.8Å; L157-Y161 HydrophobicContact CB-CE2 3.87Å; L157-Y161 HydrophobicContact CD1-CE2 4.15Å; L157-Y161 WeakPolarHBondContact O-CD2 3.17Å; L157-Y161 PolarHBondContact O-N 3.43Å; Y161-T164 PolarHBondContact O-N 3.12Å; Y161-L165 WeakPolarHBondContact O-CB 3.5Å; Y161-L165 WeakPolarHBondContact O-CD1 3.5Å; Y161-L165 WeakPolarHBondContact O-CG 3.43Å; Y161-L165 PolarHBondContact O-N 3.07Å
162	T	94.8	Very high	92.7	Very high	20 Å²	20	65.8 Å²	65.8	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-61.6	-44.5	173.4	-57	0	0	0	0	111.6	K146 T150 Q158 Y159 I160 L165 E166	K146-T162 HydrophobicContact CG-CG2 4.43Å; T150-T162 HydrophobicContact CG2-CG2 3.81Å; Q158-T162 WeakPolarHBondContact O-CB 3.49Å; Q158-T162 PolarHBondContact O-N 2.98Å; Q158-T162 PolarHBondContact O-OG1 3.32Å; Y159-T162 WeakPolarHBondContact O-CB 3.48Å; Y159-T162 PolarHBondContact O-N 2.98Å; I160-T162 VanDerWaalsContact C-N 3.28Å; I160-T162 PolarHBondContact O-N 3.3Å; T162-L165 PolarHBondContact O-N 3.29Å; T162-E166 WeakPolarHBondContact O-CG 3.16Å; T162-E166 PolarHBondContact O-N 3.14Å
163	M	94.8	Very high	93.2	Very high	67 Å²	67	63.4 Å²	63.4	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-39.7	176.3	-69.2	-64.6	-62	0	0	112.7	Y159 I160 E166 Q167 L338	Y159-M163 HydrophobicContact CD1-CG 4.49Å; Y159-M163 HydrophobicContact CD2-CG 4.2Å; Y159-M163 HydrophobicContact CE1-CG 4.04Å; Y159-M163 HydrophobicContact CE2-CG 3.69Å; Y159-M163 HydrophobicContact CE2-SD 3.85Å; Y159-M163 WeakPolarHBondContact O-CG 3.45Å; Y159-M163 PolarHBondContact O-N 2.92Å; I160-M163 PolarHBondContact O-N 3.32Å; I160-M163 VanDerWaalsContact O-N 3.15Å; M163-E166 PolarHBondContact O-N 2.61Å; M163-Q167 WeakPolarHBondContact O-CB 3.49Å; M163-Q167 PolarHBondContact O-N 2.89Å; M163-L338 HydrophobicContact CB-CD2 3.63Å
164	T	95.8	Very high	93.8	Very high	36 Å²	36	57.9 Å²	57.9	22%	0.221	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-46.7	174.7	-58.4	0	0	0	0	111.2	I160 Y161 E166 Q167 D168 L338	I160-T164 PolarHBondContact O-N 3.11Å; I160-T164 PolarHBondContact O-OG1 3.24Å; I160-T164 VanDerWaalsContact O-OG1 3.05Å; Y161-T164 PolarHBondContact O-N 3.12Å; T164-E166 VanDerWaalsContact C-N 3.33Å; T164-E166 PolarHBondContact O-N 3.15Å; T164-Q167 PolarHBondContact O-N 3.11Å; T164-Q167 VanDerWaalsContact O-N 3.16Å; T164-D168 PolarHBondContact O-N 2.85Å; T164-L338 HydrophobicContact CG2-CD1 4.38Å
165	L	96.9	Very high	94.5	Very high	23 Å²	23	55.1 Å²	55.1	12%	0.12	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-35	178.5	-64.6	164.3	0	0	0	111.9	A142 A145 K146 V149 Y161 T162 I169	A142-L165 HydrophobicContact CB-CB 4.46Å; A142-L165 HydrophobicContact CB-CD2 4.07Å; A145-L165 HydrophobicContact CB-CD1 4.07Å; A145-L165 HydrophobicContact CB-CD2 3.9Å; K146-L165 HydrophobicContact CB-CB 4.29Å; K146-L165 HydrophobicContact CB-CD1 4.19Å; V149-L165 HydrophobicContact CG2-CD1 4.15Å; Y161-L165 WeakPolarHBondContact O-CB 3.5Å; Y161-L165 WeakPolarHBondContact O-CD1 3.5Å; Y161-L165 WeakPolarHBondContact O-CG 3.43Å; Y161-L165 PolarHBondContact O-N 3.07Å; T162-L165 PolarHBondContact O-N 3.29Å; L165-I169 WeakPolarHBondContact O-CD1 3.48Å; L165-I169 VanDerWaalsContact O-CG1 3.28Å; L165-I169 WeakPolarHBondContact O-CG1 3.39Å; L165-I169 PolarHBondContact O-N 2.88Å; L165-I169 VanDerWaalsContact O-N 3.13Å
166	E	95.6	Very high	94.7	Very high	83 Å²	83	55.8 Å²	55.8	39%	0.388	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-39.7	170.8	-75.2	-174.3	174.3	0	0	113	K146 T162 M163 T164 I169 K170	K146-E166 HydrophobicContact CD-CG 4.23Å; K146-E166 VanDerWaalsContact CE-OE1 3.25Å; K146-E166 WeakPolarHBondContact CE-OE1 3.43Å; K146-E166 VanDerWaalsContact NZ-CG 3.27Å; K146-E166 IonicContact NZ-OE1 3.82Å; K146-E166 PolarHBondContact NZ-OE1 3.08Å; T162-E166 WeakPolarHBondContact O-CG 3.16Å; T162-E166 PolarHBondContact O-N 3.14Å; M163-E166 PolarHBondContact O-N 2.61Å; T164-E166 VanDerWaalsContact C-N 3.33Å; T164-E166 PolarHBondContact O-N 3.15Å; E166-I169 PolarHBondContact O-N 2.87Å; E166-K170 VanDerWaalsContact O-CB 3.3Å; E166-K170 WeakPolarHBondContact O-CB 3.24Å; E166-K170 PolarHBondContact O-N 2.71Å
167	Q	95.4	Very high	95	Very high	21 Å²	21	58.4 Å²	58.4	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-36.3	176.2	-175.1	61.3	41.9	0	0	111.5	M163 T164 K170 N171 L338	M163-Q167 WeakPolarHBondContact O-CB 3.49Å; M163-Q167 PolarHBondContact O-N 2.89Å; T164-Q167 PolarHBondContact O-N 3.11Å; T164-Q167 VanDerWaalsContact O-N 3.16Å; Q167-K170 PolarHBondContact O-N 3.43Å; Q167-N171 PolarHBondContact NE2-OD1 2.82Å; Q167-N171 WeakPolarHBondContact O-CB 3.21Å; Q167-N171 PolarHBondContact O-N 3.42Å; Q167-N171 PolarHBondContact O-ND2 2.93Å; Q167-N171 PolarHBondContact O-OD1 3.08Å; Q167-L338 HydrophobicContact CB-CD1 4.17Å; Q167-L338 HydrophobicContact CG-CD1 4.35Å
168	D	96.5	Very high	95.3	Very high	39 Å²	39	56.2 Å²	56.2	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-41.5	173	-94.6	-16.7	0	0	0	113.4	V138 A142 T164 K170 N171 S172 Y335	V138-D168 HydrophobicContact CG1-CB 4.1Å; A142-D168 HydrophobicContact CB-CB 4.06Å; T164-D168 PolarHBondContact O-N 2.85Å; D168-K170 VanDerWaalsContact C-N 3.34Å; D168-N171 PolarHBondContact O-N 2.91Å; D168-S172 VanDerWaalsContact O-CB 3.25Å; D168-S172 WeakPolarHBondContact O-CB 3.44Å; D168-S172 PolarHBondContact O-N 2.86Å; D168-S172 PolarHBondContact O-OG 2.94Å; D168-Y335 PolarHBondContact OD1-OH 3.17Å
169	I	96.9	Very high	95.5	Very high	29 Å²	29	54 Å²	54	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-45	173.1	-68.4	164.1	0	0	0	110	M139 A142 E143 K146 L165 E166 S172 L173	M139-I169 HydrophobicContact CG-CG2 4.41Å; A142-I169 HydrophobicContact CB-CD1 4.23Å; A142-I169 HydrophobicContact CB-CG1 3.76Å; E143-I169 HydrophobicContact CG-CD1 3.78Å; E143-I169 HydrophobicContact CG-CG1 4.2Å; K146-I169 HydrophobicContact CD-CD1 4.5Å; L165-I169 WeakPolarHBondContact O-CD1 3.48Å; L165-I169 VanDerWaalsContact O-CG1 3.28Å; L165-I169 WeakPolarHBondContact O-CG1 3.39Å; L165-I169 PolarHBondContact O-N 2.88Å; L165-I169 VanDerWaalsContact O-N 3.13Å; E166-I169 PolarHBondContact O-N 2.87Å; I169-S172 PolarHBondContact O-N 2.91Å; I169-L173 HydrophobicContact CG2-CD1 4.01Å; I169-L173 WeakPolarHBondContact O-CB 3.38Å; I169-L173 VanDerWaalsContact O-CG 3.31Å; I169-L173 WeakPolarHBondContact O-CG 3.19Å; I169-L173 PolarHBondContact O-N 2.85Å
170	K	95.7	Very high	95.8	Very high	120 Å²	120	50.2 Å²	50.2	52%	0.522	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-47.4	177.4	175.2	-178.7	162.7	-160	0	112.4	E166 Q167 D168 S172 L173 T174	E166-K170 VanDerWaalsContact O-CB 3.3Å; E166-K170 WeakPolarHBondContact O-CB 3.24Å; E166-K170 PolarHBondContact O-N 2.71Å; Q167-K170 PolarHBondContact O-N 3.43Å; D168-K170 VanDerWaalsContact C-N 3.34Å; K170-S172 VanDerWaalsContact C-N 3.32Å; K170-S172 PolarHBondContact O-N 2.8Å; K170-L173 PolarHBondContact O-N 3.36Å; K170-T174 PolarHBondContact O-N 3.27Å; K170-T174 PolarHBondContact O-OG1 3.42Å
171	N	95.3	Very high	95.9	Very high	21 Å²	21	52.4 Å²	52.4	11%	0.112	24%	0.244	C	C	.	.	H	α-helix	trans	-56.1	-47.8	174.2	-72	-18.9	0	0	0	110.6	Q167 D168 L173 T174 S175	Q167-N171 PolarHBondContact NE2-OD1 2.82Å; Q167-N171 WeakPolarHBondContact O-CB 3.21Å; Q167-N171 PolarHBondContact O-N 3.42Å; Q167-N171 PolarHBondContact O-ND2 2.93Å; Q167-N171 PolarHBondContact O-OD1 3.08Å; D168-N171 PolarHBondContact O-N 2.91Å; N171-L173 PolarHBondContact O-N 3.33Å; N171-T174 PolarHBondContact O-N 2.84Å; N171-S175 WeakPolarHBondContact O-CB 3.47Å; N171-S175 PolarHBondContact O-N 3.48Å
172	S	96.9	Very high	96	Very high	5 Å²	5	46.2 Å²	46.2	4%	0.035	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-36.4	-179.7	-59.8	0	0	0	0	113	A135 D168 I169 K170 R176	A135-S172 WeakPolarHBondContact O-CB 3.28Å; A135-S172 PolarHBondContact O-OG 3.38Å; D168-S172 VanDerWaalsContact O-CB 3.25Å; D168-S172 WeakPolarHBondContact O-CB 3.44Å; D168-S172 PolarHBondContact O-N 2.86Å; D168-S172 PolarHBondContact O-OG 2.94Å; I169-S172 PolarHBondContact O-N 2.91Å; K170-S172 VanDerWaalsContact C-N 3.32Å; K170-S172 PolarHBondContact O-N 2.8Å; S172-R176 PolarHBondContact O-N 2.94Å
173	L	96.3	Very high	96.2	Very high	62 Å²	62	47.6 Å²	47.6	33%	0.325	23%	0.225	S	C	.	.	H	α-helix	trans	-65.9	-41.4	173.4	-76.3	168	0	0	0	111.7	M139 I169 K170 N171 R176 R177	M139-L173 HydrophobicContact CE-CB 4.39Å; M139-L173 HydrophobicContact CE-CD2 3.74Å; M139-L173 HydrophobicContact CE-CG 3.72Å; M139-L173 HydrophobicContact SD-CD2 4.25Å; I169-L173 HydrophobicContact CG2-CD1 4.01Å; I169-L173 WeakPolarHBondContact O-CB 3.38Å; I169-L173 VanDerWaalsContact O-CG 3.31Å; I169-L173 WeakPolarHBondContact O-CG 3.19Å; I169-L173 PolarHBondContact O-N 2.85Å; K170-L173 PolarHBondContact O-N 3.36Å; N171-L173 PolarHBondContact O-N 3.33Å; L173-R176 PolarHBondContact O-N 3.16Å; L173-R177 WeakPolarHBondContact O-CG 3.43Å; L173-R177 PolarHBondContact O-N 2.88Å; L173-R177 VanDerWaalsContact O-N 3.13Å
174	T	95.4	Very high	96.2	Very high	40 Å²	40	50 Å²	50	25%	0.245	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-47.8	174.9	-62.9	0	0	0	0	111.3	K170 N171 R176 R177 T178	K170-T174 PolarHBondContact O-N 3.27Å; K170-T174 PolarHBondContact O-OG1 3.42Å; N171-T174 PolarHBondContact O-N 2.84Å; T174-R176 VanDerWaalsContact C-N 3.28Å; T174-R176 PolarHBondContact O-N 2.9Å; T174-R177 PolarHBondContact O-N 2.82Å; T174-R177 VanDerWaalsContact O-N 3.07Å; T174-T178 PolarHBondContact O-N 3.38Å; T174-T178 PolarHBondContact O-OG1 3.36Å
175	S	95.8	Very high	96.2	Very high	8 Å²	8	55.7 Å²	55.7	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-38.7	176.5	179.4	0	0	0	0	112.9	E131 N171 S179 Q327	E131-S175 WeakPolarHBondContact CG-OG 3.48Å; N171-S175 WeakPolarHBondContact O-CB 3.47Å; N171-S175 PolarHBondContact O-N 3.48Å; S175-S179 WeakPolarHBondContact O-CB 3.24Å; S175-S179 PolarHBondContact O-N 2.89Å; S175-S179 PolarHBondContact O-OG 3.03Å; S175-Q327 PolarHBondContact OG-NE2 3.32Å
176	R	95.7	Very high	96.2	Very high	102 Å²	102	54.6 Å²	54.6	39%	0.385	25%	0.25	S	S	.	.	H	α-helix	trans	-62.4	-48.2	171.3	-94.6	-163.9	58.7	-152.8	-12.4	113.3	A135 S172 L173 T174 T178 S179 E180	A135-R176 HydrophobicContact CB-CG 4.31Å; S172-R176 PolarHBondContact O-N 2.94Å; L173-R176 PolarHBondContact O-N 3.16Å; T174-R176 VanDerWaalsContact C-N 3.28Å; T174-R176 PolarHBondContact O-N 2.9Å; R176-T178 VanDerWaalsContact C-N 3.33Å; R176-T178 PolarHBondContact O-N 3.46Å; R176-S179 WeakPolarHBondContact O-CB 3.44Å; R176-S179 PolarHBondContact O-N 3.1Å; R176-E180 IonicContact CZ-OE1 3.4Å; R176-E180 IonicContact NE-OE1 3.43Å; R176-E180 PolarHBondContact NE-OE1 3.09Å; R176-E180 IonicContact NH2-OE1 3.48Å; R176-E180 PolarHBondContact NH2-OE1 3.01Å; R176-E180 WeakPolarHBondContact O-CG 3.04Å; R176-E180 PolarHBondContact O-N 3.44Å
177	R	95.9	Very high	96.3	Very high	144 Å²	144	52.5 Å²	52.5	54%	0.543	24%	0.239	S	C	.	.	H	α-helix	trans	-60.3	-44	177.7	-68.4	173.5	-169.9	127.7	-3	111.2	L173 T174 S179 E180 I181	L173-R177 WeakPolarHBondContact O-CG 3.43Å; L173-R177 PolarHBondContact O-N 2.88Å; L173-R177 VanDerWaalsContact O-N 3.13Å; T174-R177 PolarHBondContact O-N 2.82Å; T174-R177 VanDerWaalsContact O-N 3.07Å; R177-S179 PolarHBondContact O-N 3.2Å; R177-E180 PolarHBondContact O-N 3.31Å; R177-I181 WeakPolarHBondContact O-CG1 3.36Å; R177-I181 PolarHBondContact O-N 3.11Å
178	T	96.6	Very high	96.5	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-44	174.5	-62.5	0	0	0	0	111.5	T174 R176 E180 I181 L182 Q327	T174-T178 PolarHBondContact O-N 3.38Å; T174-T178 PolarHBondContact O-OG1 3.36Å; R176-T178 VanDerWaalsContact C-N 3.33Å; R176-T178 PolarHBondContact O-N 3.46Å; T178-E180 VanDerWaalsContact C-N 3.3Å; T178-E180 PolarHBondContact O-N 3.41Å; T178-I181 PolarHBondContact O-N 3.11Å; T178-I181 VanDerWaalsContact O-N 3.16Å; T178-L182 HydrophobicContact CG2-CD1 4.07Å; T178-L182 HydrophobicContact CG2-CG 4.17Å; T178-L182 WeakPolarHBondContact O-CB 3.4Å; T178-L182 VanDerWaalsContact O-CG 3.31Å; T178-L182 WeakPolarHBondContact O-CG 3.33Å; T178-L182 PolarHBondContact O-N 3.47Å; T178-Q327 HydrophobicContact CG2-CB 4.38Å; T178-Q327 PolarHBondContact OG1-OE1 3.26Å
179	S	96.9	Very high	96.5	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-40.6	175.3	-61.9	0	0	0	0	112.7	S175 R176 R177 Q183	S175-S179 WeakPolarHBondContact O-CB 3.24Å; S175-S179 PolarHBondContact O-N 2.89Å; S175-S179 PolarHBondContact O-OG 3.03Å; R176-S179 WeakPolarHBondContact O-CB 3.44Å; R176-S179 PolarHBondContact O-N 3.1Å; R177-S179 PolarHBondContact O-N 3.2Å; S179-Q183 WeakPolarHBondContact O-CB 3.25Å; S179-Q183 PolarHBondContact O-N 3.08Å
180	E	96.3	Very high	96.6	Very high	75 Å²	75	53.7 Å²	53.7	35%	0.35	25%	0.248	S	C	.	.	H	α-helix	trans	-68	-37.2	176.4	-69.3	161.2	-160.3	0	0	111.5	R176 R177 T178 N184	R176-E180 IonicContact CZ-OE1 3.4Å; R176-E180 IonicContact NE-OE1 3.43Å; R176-E180 PolarHBondContact NE-OE1 3.09Å; R176-E180 IonicContact NH2-OE1 3.48Å; R176-E180 PolarHBondContact NH2-OE1 3.01Å; R176-E180 WeakPolarHBondContact O-CG 3.04Å; R176-E180 PolarHBondContact O-N 3.44Å; R177-E180 PolarHBondContact O-N 3.31Å; T178-E180 VanDerWaalsContact C-N 3.3Å; T178-E180 PolarHBondContact O-N 3.41Å; E180-N184 WeakPolarHBondContact O-CB 3.4Å; E180-N184 VanDerWaalsContact O-CG 3.29Å; E180-N184 PolarHBondContact O-N 3.42Å; E180-N184 PolarHBondContact O-ND2 3.22Å
181	I	96.1	Very high	96.7	Very high	62 Å²	62	48.5 Å²	48.5	32%	0.318	23%	0.228	S	C	.	.	H	α-helix	trans	-68.2	-44.6	173.3	-68.1	164.9	0	0	0	111.7	R177 T178 Q183 N184 R185 Y323	R177-I181 WeakPolarHBondContact O-CG1 3.36Å; R177-I181 PolarHBondContact O-N 3.11Å; T178-I181 PolarHBondContact O-N 3.11Å; T178-I181 VanDerWaalsContact O-N 3.16Å; I181-Q183 VanDerWaalsContact C-N 3.32Å; I181-Q183 PolarHBondContact O-N 3.08Å; I181-N184 PolarHBondContact O-N 3Å; I181-R185 HydrophobicContact CG2-CG 4.44Å; I181-R185 WeakPolarHBondContact O-CB 3.45Å; I181-R185 PolarHBondContact O-N 3.3Å; I181-Y323 HydrophobicContact CG2-CD1 4.02Å; I181-Y323 HydrophobicContact CG2-CD2 3.82Å; I181-Y323 HydrophobicContact CG2-CE1 3.85Å; I181-Y323 HydrophobicContact CG2-CE2 3.67Å; I181-Y323 HydrophobicContact CG2-CG 4.03Å
182	L	97.2	Very high	96.9	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.016	24%	0.243	C	C	.	.	I	π-helix	trans	-61	-40.9	177.4	-71.6	178.2	0	0	0	111.6	I128 T178 C186 Y187 M320 Y323 Q324	I128-L182 HydrophobicContact CD1-CB 3.99Å; I128-L182 HydrophobicContact CG1-CB 4.27Å; T178-L182 HydrophobicContact CG2-CD1 4.07Å; T178-L182 HydrophobicContact CG2-CG 4.17Å; T178-L182 WeakPolarHBondContact O-CB 3.4Å; T178-L182 VanDerWaalsContact O-CG 3.31Å; T178-L182 WeakPolarHBondContact O-CG 3.33Å; T178-L182 PolarHBondContact O-N 3.47Å; L182-C186 WeakPolarHBondContact O-CA 3.48Å; L182-C186 VanDerWaalsContact O-CB 3.31Å; L182-C186 WeakPolarHBondContact O-CB 3.45Å; L182-C186 PolarHBondContact O-N 3.29Å; L182-C186 VanDerWaalsContact O-N 3.1Å; L182-Y187 PolarHBondContact O-N 3.41Å; L182-M320 HydrophobicContact CD2-CB 4.07Å; L182-M320 HydrophobicContact CD2-CG 3.92Å; L182-Y323 HydrophobicContact CD2-CD2 4.14Å; L182-Q324 HydrophobicContact CD1-CG 4.21Å
183	Q	97.3	Very high	97	Very high	50 Å²	50	52.1 Å²	52.1	23%	0.234	25%	0.246	C	C	.	.	I	π-helix	trans	-60.7	-47.5	175.5	-172.2	64.4	29.8	0	0	111.5	I128 S179 I181 Q188	I128-Q183 HydrophobicContact CD1-CB 4.46Å; S179-Q183 WeakPolarHBondContact O-CB 3.25Å; S179-Q183 PolarHBondContact O-N 3.08Å; I181-Q183 VanDerWaalsContact C-N 3.32Å; I181-Q183 PolarHBondContact O-N 3.08Å; Q183-Q188 PolarHBondContact O-N 3.24Å
184	N	95.4	Very high	97.1	Very high	117 Å²	117	52 Å²	52	63%	0.626	24%	0.241	S	C	*	.	I	π-helix	trans	-82.4	-40	-171.9	-67.3	-23	0	0	0	113.9	E180 I181	E180-N184 WeakPolarHBondContact O-CB 3.4Å; E180-N184 VanDerWaalsContact O-CG 3.29Å; E180-N184 PolarHBondContact O-N 3.42Å; E180-N184 PolarHBondContact O-ND2 3.22Å; I181-N184 PolarHBondContact O-N 3Å
185	R	95.5	Very high	97.2	Very high	155 Å²	155	53.5 Å²	53.5	59%	0.585	25%	0.25	S	S	*	.	I	π-helix	trans	-93	-30.4	-176.4	-69.4	-169.7	171.2	-170.7	-9	114.1	I181 Y323	I181-R185 HydrophobicContact CG2-CG 4.44Å; I181-R185 WeakPolarHBondContact O-CB 3.45Å; I181-R185 PolarHBondContact O-N 3.3Å; R185-Y323 WeakPolarHBondContact CD-OH 3.37Å; R185-Y323 PolarHBondContact NH1-OH 3.34Å
186	C	97.4	Very high	97.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-106	-55.3	-173.5	-51.3	0	0	0	0	111.9	M124 L182 L190 V316	M124-C186 HydrophobicContact CE-CB 3.72Å; L182-C186 WeakPolarHBondContact O-CA 3.48Å; L182-C186 VanDerWaalsContact O-CB 3.31Å; L182-C186 WeakPolarHBondContact O-CB 3.45Å; L182-C186 PolarHBondContact O-N 3.29Å; L182-C186 VanDerWaalsContact O-N 3.1Å; C186-L190 WeakPolarHBondContact O-CB 3.48Å; C186-L190 PolarHBondContact O-N 2.93Å; C186-V316 HydrophobicContact CB-CB 4.11Å
187	Y	98.3	Very high	97.5	Very high	40 Å²	40	51.5 Å²	51.5	16%	0.157	25%	0.245	C	C	.	.	I	π-helix	trans	-67.1	-51.8	-179	172.4	-85.3	0	0	0	112	L121 M124 E125 L182 L190 A191	L121-Y187 HydrophobicContact CB-CD2 4.29Å; L121-Y187 HydrophobicContact CB-CE2 3.88Å; L121-Y187 HydrophobicContact CD2-CD2 3.4Å; L121-Y187 HydrophobicContact CD2-CE2 3.67Å; L121-Y187 HydrophobicContact CD2-CG 3.94Å; L121-Y187 VanDerWaalsContact CD2-O 3.27Å; L121-Y187 WeakPolarHBondContact CD2-O 3.35Å; L121-Y187 HydrophobicContact CG-CD2 4.46Å; L121-Y187 HydrophobicContact CG-CE2 4.37Å; L121-Y187 WeakPolarHBondContact O-CE2 3.26Å; M124-Y187 HydrophobicContact CB-CD2 4.19Å; E125-Y187 HydrophobicContact CB-CD2 4.35Å; E125-Y187 HydrophobicContact CB-CE2 3.84Å; L182-Y187 PolarHBondContact O-N 3.41Å; Y187-L190 PolarHBondContact O-N 2.97Å; Y187-A191 HydrophobicContact CE1-CB 4.37Å; Y187-A191 VanDerWaalsContact O-CB 3.32Å; Y187-A191 WeakPolarHBondContact O-CB 3.38Å; Y187-A191 PolarHBondContact O-N 3.28Å
188	Q	98.3	Very high	97.6	Very high	81 Å²	81	46.4 Å²	46.4	38%	0.379	23%	0.228	S	C	.	.	H	α-helix	trans	-63.6	-46.8	-173.9	-172.9	58.6	43.1	0	0	112.2	Q183 L190 A191 D192	Q183-Q188 PolarHBondContact O-N 3.24Å; Q188-L190 PolarHBondContact O-N 3.09Å; Q188-A191 WeakPolarHBondContact O-CB 3.47Å; Q188-A191 PolarHBondContact O-N 2.95Å; Q188-A191 VanDerWaalsContact O-N 3.14Å; Q188-D192 PolarHBondContact NE2-OD1 3.12Å; Q188-D192 PolarHBondContact NE2-OD2 3.09Å; Q188-D192 PolarHBondContact O-N 2.85Å
189	A	97.9	Very high	97.7	Very high	32 Å²	32	52.6 Å²	52.6	26%	0.264	25%	0.254	S	S	.	.	H	α-helix	trans	-57.1	-47	178.4	0	0	0	0	0	112.7	D192 K193 L312 V316	A189-D192 PolarHBondContact O-N 3.38Å; A189-K193 PolarHBondContact O-N 2.85Å; A189-L312 HydrophobicContact CB-CD1 4.45Å; A189-L312 HydrophobicContact CB-CD2 4.44Å; A189-L312 WeakPolarHBondContact O-CD2 3.48Å; A189-V316 HydrophobicContact CB-CG1 4.22Å
190	L	98.5	Very high	97.7	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-68.3	-35.5	176.8	179	62.8	0	0	0	112.3	W113 A117 L121 M124 C186 Y187 Q188 R194 L313 V316	W113-L190 HydrophobicContact CH2-CD1 4.07Å; A117-L190 HydrophobicContact CB-CD1 4.34Å; L121-L190 HydrophobicContact CD1-CG 4.22Å; L121-L190 HydrophobicContact CD2-CB 4.08Å; L121-L190 HydrophobicContact CD2-CD2 4.03Å; L121-L190 HydrophobicContact CD2-CG 4.08Å; L121-L190 HydrophobicContact CG-CD2 4.04Å; L121-L190 HydrophobicContact CG-CG 4.15Å; M124-L190 HydrophobicContact SD-CD2 4.22Å; C186-L190 WeakPolarHBondContact O-CB 3.48Å; C186-L190 PolarHBondContact O-N 2.93Å; Y187-L190 PolarHBondContact O-N 2.97Å; Q188-L190 PolarHBondContact O-N 3.09Å; L190-R194 VanDerWaalsContact O-CB 3.26Å; L190-R194 WeakPolarHBondContact O-CB 3.43Å; L190-R194 PolarHBondContact O-N 2.75Å; L190-L313 HydrophobicContact CD1-CB 4.46Å; L190-L313 HydrophobicContact CD1-CD1 3.99Å; L190-L313 HydrophobicContact CD2-CD1 3.81Å; L190-V316 HydrophobicContact CB-CG2 4.2Å; L190-V316 HydrophobicContact CD2-CG2 4.22Å
191	A	98.7	Very high	97.8	Very high	11 Å²	11	56 Å²	56	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-46.5	174.9	0	0	0	0	0	111.8	L121 Y187 Q188 R194 T195	L121-A191 HydrophobicContact CD1-CB 3.95Å; L121-A191 HydrophobicContact CD2-CB 4.17Å; Y187-A191 HydrophobicContact CE1-CB 4.37Å; Y187-A191 VanDerWaalsContact O-CB 3.32Å; Y187-A191 WeakPolarHBondContact O-CB 3.38Å; Y187-A191 PolarHBondContact O-N 3.28Å; Q188-A191 WeakPolarHBondContact O-CB 3.47Å; Q188-A191 PolarHBondContact O-N 2.95Å; Q188-A191 VanDerWaalsContact O-N 3.14Å; A191-R194 PolarHBondContact O-N 3.44Å; A191-T195 WeakPolarHBondContact O-CG2 3.49Å; A191-T195 PolarHBondContact O-N 2.63Å; A191-T195 VanDerWaalsContact O-N 3.1Å
192	D	98.4	Very high	97.9	Very high	81 Å²	81	59.4 Å²	59.4	43%	0.433	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-50.1	179.4	-69.6	-35.3	0	0	0	110.9	Q188 A189 R194 T195 E196	Q188-D192 PolarHBondContact NE2-OD1 3.12Å; Q188-D192 PolarHBondContact NE2-OD2 3.09Å; Q188-D192 PolarHBondContact O-N 2.85Å; A189-D192 PolarHBondContact O-N 3.38Å; D192-R194 VanDerWaalsContact C-N 3.28Å; D192-R194 PolarHBondContact O-N 3.14Å; D192-T195 WeakPolarHBondContact O-CA 3.42Å; D192-T195 PolarHBondContact O-N 3.3Å; D192-T195 PolarHBondContact O-OG1 3.35Å; D192-E196 PolarHBondContact O-N 3.38Å
193	K	98.3	Very high	98	Very high	21 Å²	21	62.5 Å²	62.5	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-36.1	177.5	-169.7	53.7	167.3	-178	0	112.7	A189 T195 E196 I197 L312	A189-K193 PolarHBondContact O-N 2.85Å; K193-T195 VanDerWaalsContact C-N 3.33Å; K193-T195 PolarHBondContact O-N 3.16Å; K193-E196 HydrophobicContact CD-CB 4.41Å; K193-E196 WeakPolarHBondContact CD-OE2 3.39Å; K193-E196 IonicContact NZ-OE1 3.02Å; K193-E196 PolarHBondContact NZ-OE1 2.87Å; K193-E196 IonicContact NZ-OE2 3.91Å; K193-E196 PolarHBondContact NZ-OE2 3.15Å; K193-E196 WeakPolarHBondContact O-CB 3.35Å; K193-E196 PolarHBondContact O-N 2.98Å; K193-I197 HydrophobicContact CD-CD1 4.27Å; K193-I197 HydrophobicContact CD-CG1 4.33Å; K193-I197 HydrophobicContact CG-CD1 4.01Å; K193-I197 WeakPolarHBondContact O-CG1 3.38Å; K193-I197 PolarHBondContact O-N 2.98Å; K193-L312 HydrophobicContact CB-CD2 3.46Å; K193-L312 VanDerWaalsContact CB-CD2 3.46Å; K193-L312 HydrophobicContact CG-CD2 3.87Å
194	R	98.6	Very high	98.1	Very high	59 Å²	59	60.4 Å²	60.4	22%	0.223	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-38	172.7	-167.9	-156.9	80.5	-138.3	-3.9	112.5	W113 C114 A117 L190 A191 D192 D198	W113-R194 HydrophobicContact CZ3-CB 4.31Å; W113-R194 HydrophobicContact CZ3-CG 4.33Å; C114-R194 HydrophobicContact CB-CG 4.34Å; C114-R194 WeakPolarHBondContact O-CD 3.42Å; A117-R194 HydrophobicContact CB-CB 4.4Å; A117-R194 HydrophobicContact CB-CG 3.92Å; L190-R194 VanDerWaalsContact O-CB 3.26Å; L190-R194 WeakPolarHBondContact O-CB 3.43Å; L190-R194 PolarHBondContact O-N 2.75Å; A191-R194 PolarHBondContact O-N 3.44Å; D192-R194 VanDerWaalsContact C-N 3.28Å; D192-R194 PolarHBondContact O-N 3.14Å; R194-D198 PolarHBondContact O-N 3.37Å; R194-D198 VanDerWaalsContact O-N 3.16Å
195	T	98.4	Very high	98.2	Very high	71 Å²	71	60.6 Å²	60.6	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-73.5	-34.5	176	65.7	0	0	0	0	112.7	A191 D192 K193 K199	A191-T195 WeakPolarHBondContact O-CG2 3.49Å; A191-T195 PolarHBondContact O-N 2.63Å; A191-T195 VanDerWaalsContact O-N 3.1Å; D192-T195 WeakPolarHBondContact O-CA 3.42Å; D192-T195 PolarHBondContact O-N 3.3Å; D192-T195 PolarHBondContact O-OG1 3.35Å; K193-T195 VanDerWaalsContact C-N 3.33Å; K193-T195 PolarHBondContact O-N 3.16Å; T195-K199 VanDerWaalsContact O-CB 3.28Å; T195-K199 WeakPolarHBondContact O-CB 3.3Å; T195-K199 PolarHBondContact O-N 3.33Å
196	E	98.4	Very high	98.3	Very high	66 Å²	66	57 Å²	57	31%	0.308	27%	0.265	S	S	.	.	H	α-helix	trans	-61.3	-50.4	173.8	-167.1	-146.2	119.6	0	0	111.2	D192 K193 D198 K199 W200 L305	D192-E196 PolarHBondContact O-N 3.38Å; K193-E196 HydrophobicContact CD-CB 4.41Å; K193-E196 WeakPolarHBondContact CD-OE2 3.39Å; K193-E196 IonicContact NZ-OE1 3.02Å; K193-E196 PolarHBondContact NZ-OE1 2.87Å; K193-E196 IonicContact NZ-OE2 3.91Å; K193-E196 PolarHBondContact NZ-OE2 3.15Å; K193-E196 WeakPolarHBondContact O-CB 3.35Å; K193-E196 PolarHBondContact O-N 2.98Å; E196-D198 PolarHBondContact O-N 3.39Å; E196-K199 WeakPolarHBondContact O-CB 3.45Å; E196-K199 PolarHBondContact O-N 3.02Å; E196-W200 PolarHBondContact O-N 2.8Å; E196-L305 VanDerWaalsContact OE1-CD2 3.27Å; E196-L305 WeakPolarHBondContact OE1-CD2 3.42Å
197	I	98.4	Very high	98.3	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-42.7	179.3	-64.3	169.2	0	0	0	110.7	W113 K193 K199 W200 R201 L305	W113-I197 HydrophobicContact CE3-CD1 3.95Å; W113-I197 HydrophobicContact CH2-CD1 3.99Å; W113-I197 HydrophobicContact CZ3-CD1 3.67Å; K193-I197 HydrophobicContact CD-CD1 4.27Å; K193-I197 HydrophobicContact CD-CG1 4.33Å; K193-I197 HydrophobicContact CG-CD1 4.01Å; K193-I197 WeakPolarHBondContact O-CG1 3.38Å; K193-I197 PolarHBondContact O-N 2.98Å; I197-K199 PolarHBondContact O-N 3.42Å; I197-W200 PolarHBondContact O-N 2.97Å; I197-R201 WeakPolarHBondContact O-CB 3.28Å; I197-R201 PolarHBondContact O-N 3.2Å; I197-L305 WeakPolarHBondContact CD1-O 3.44Å; I197-L305 HydrophobicContact CG1-CB 4.38Å
198	D	98.5	Very high	98.2	Very high	36 Å²	36	58.6 Å²	58.6	19%	0.193	27%	0.273	C	S	.	.	H	α-helix	trans	-69	-31.3	177.7	-174.1	66.8	0	0	0	113.3	C114 R194 E196 R201 R202	C114-D198 HydrophobicContact CB-CB 4.37Å; R194-D198 PolarHBondContact O-N 3.37Å; R194-D198 VanDerWaalsContact O-N 3.16Å; E196-D198 PolarHBondContact O-N 3.39Å; D198-R201 IonicContact OD1-CZ 2.77Å; D198-R201 VanDerWaalsContact OD1-CZ 3.23Å; D198-R201 IonicContact OD1-NE 2.73Å; D198-R201 PolarHBondContact OD1-NE 3.24Å; D198-R201 IonicContact OD1-NH2 3.63Å; D198-R201 PolarHBondContact OD1-NH2 3.31Å; D198-R202 WeakPolarHBondContact O-CG 3.4Å; D198-R202 PolarHBondContact O-N 3.24Å; D198-R202 VanDerWaalsContact O-N 3.09Å; D198-R202 PolarHBondContact O-NE 3.14Å; D198-R202 IonicContact OD2-CZ 2.81Å; D198-R202 IonicContact OD2-NE 2.72Å; D198-R202 PolarHBondContact OD2-NE 3.5Å; D198-R202 IonicContact OD2-NH2 3.29Å; D198-R202 PolarHBondContact OD2-NH2 3.27Å
199	K	98.4	Very high	98.2	Very high	141 Å²	141	56.3 Å²	56.3	61%	0.613	27%	0.268	S	S	*	.	H	α-helix	trans	-63.2	-52.7	172.2	178.4	-170.8	175	-171.1	0	110.4	T195 E196 I197 R202 E203	T195-K199 VanDerWaalsContact O-CB 3.28Å; T195-K199 WeakPolarHBondContact O-CB 3.3Å; T195-K199 PolarHBondContact O-N 3.33Å; E196-K199 WeakPolarHBondContact O-CB 3.45Å; E196-K199 PolarHBondContact O-N 3.02Å; I197-K199 PolarHBondContact O-N 3.42Å; K199-R202 PolarHBondContact O-N 2.97Å; K199-E203 PolarHBondContact O-N 3.18Å
200	W	98.5	Very high	98.1	Very high	106 Å²	106	60.1 Å²	60.1	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-42.1	177.9	-81.3	118.7	0	0	0	112.5	E196 I197 R202 E203 F204 L305	E196-W200 PolarHBondContact O-N 2.8Å; I197-W200 PolarHBondContact O-N 2.97Å; W200-R202 VanDerWaalsContact C-N 3.27Å; W200-R202 PolarHBondContact O-N 3.25Å; W200-E203 PolarHBondContact O-N 2.95Å; W200-F204 HydrophobicContact CB-CD2 4.28Å; W200-F204 HydrophobicContact CB-CE2 3.97Å; W200-F204 HydrophobicContact CD2-CE2 4.43Å; W200-F204 HydrophobicContact CD2-CZ 4.37Å; W200-F204 HydrophobicContact CE3-CE1 4.1Å; W200-F204 HydrophobicContact CE3-CE2 4Å; W200-F204 AromaticContact CE3-CZ 3.65Å; W200-F204 HydrophobicContact CE3-CZ 3.65Å; W200-F204 HydrophobicContact CG-CE2 4.46Å; W200-F204 HydrophobicContact CZ3-CE1 4.34Å; W200-F204 HydrophobicContact CZ3-CZ 4.14Å; W200-F204 WeakPolarHBondContact O-CB 3.34Å; W200-F204 WeakPolarHBondContact O-CD2 3.25Å; W200-F204 WeakPolarHBondContact O-CG 3.16Å; W200-F204 PolarHBondContact O-N 2.85Å; W200-L305 HydrophobicContact CB-CD1 3.44Å; W200-L305 VanDerWaalsContact CB-CD1 3.44Å; W200-L305 HydrophobicContact CG-CD1 3.73Å; W200-L305 HydrophobicContact CG-CD2 4.49Å
201	R	98.4	Very high	98	Very high	39 Å²	39	60.8 Å²	60.8	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-57.4	-37.3	174.7	-173.4	-168.1	72	72.5	5	112.6	L107 A110 K111 I197 D198 K205	L107-R201 HydrophobicContact CD2-CG 4Å; L107-R201 WeakPolarHBondContact CD2-O 3.45Å; L107-R201 WeakPolarHBondContact O-CD 3.46Å; A110-R201 VanDerWaalsContact C-CD 3.5Å; A110-R201 HydrophobicContact CB-CB 4.36Å; A110-R201 HydrophobicContact CB-CG 3.86Å; K111-R201 VanDerWaalsContact N-CD 3.29Å; I197-R201 WeakPolarHBondContact O-CB 3.28Å; I197-R201 PolarHBondContact O-N 3.2Å; D198-R201 IonicContact OD1-CZ 2.77Å; D198-R201 VanDerWaalsContact OD1-CZ 3.23Å; D198-R201 IonicContact OD1-NE 2.73Å; D198-R201 PolarHBondContact OD1-NE 3.24Å; D198-R201 IonicContact OD1-NH2 3.63Å; D198-R201 PolarHBondContact OD1-NH2 3.31Å; R201-K205 WeakPolarHBondContact O-CB 3.19Å; R201-K205 PolarHBondContact O-N 2.79Å
202	R	98.2	Very high	97.8	Very high	134 Å²	134	64 Å²	64	51%	0.506	29%	0.294	S	S	.	.	H	α-helix	trans	-70.3	-48.1	174.2	-79.4	-176.9	-88.7	135.8	-6.7	111.8	D198 K199 W200 F204 K205 D206	D198-R202 WeakPolarHBondContact O-CG 3.4Å; D198-R202 PolarHBondContact O-N 3.24Å; D198-R202 VanDerWaalsContact O-N 3.09Å; D198-R202 PolarHBondContact O-NE 3.14Å; D198-R202 IonicContact OD2-CZ 2.81Å; D198-R202 IonicContact OD2-NE 2.72Å; D198-R202 PolarHBondContact OD2-NE 3.5Å; D198-R202 IonicContact OD2-NH2 3.29Å; D198-R202 PolarHBondContact OD2-NH2 3.27Å; K199-R202 PolarHBondContact O-N 2.97Å; W200-R202 VanDerWaalsContact C-N 3.27Å; W200-R202 PolarHBondContact O-N 3.25Å; R202-F204 PolarHBondContact O-N 2.75Å; R202-K205 WeakPolarHBondContact O-CB 3.26Å; R202-K205 PolarHBondContact O-N 3.4Å; R202-D206 PolarHBondContact O-N 3.09Å
203	E	98.3	Very high	97.8	Very high	69 Å²	69	67.3 Å²	67.3	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-44.8	178	178.6	53	-141.2	0	0	112.2	K199 W200 K205 D206 Q207 R210	K199-E203 PolarHBondContact O-N 3.18Å; W200-E203 PolarHBondContact O-N 2.95Å; E203-K205 PolarHBondContact O-N 3.49Å; E203-D206 PolarHBondContact O-N 2.93Å; E203-D206 VanDerWaalsContact O-N 3.16Å; E203-Q207 WeakPolarHBondContact O-CG 3.25Å; E203-Q207 PolarHBondContact O-N 2.91Å; E203-Q207 VanDerWaalsContact OE1-CG 3.3Å; E203-Q207 WeakPolarHBondContact OE1-CG 3.08Å; E203-Q207 PolarHBondContact OE1-NE2 2.76Å; E203-R210 IonicContact OE1-CZ 2.85Å; E203-R210 IonicContact OE1-NH2 2.71Å; E203-R210 PolarHBondContact OE1-NH2 3.17Å
204	F	98.4	Very high	97.7	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-36	176.5	-68.8	-42.4	0	0	0	113.2	L107 W200 R202 D206 Q207 W208 I298 H301 I302 L305	L107-F204 HydrophobicContact CD2-CB 4.04Å; W200-F204 HydrophobicContact CB-CD2 4.28Å; W200-F204 HydrophobicContact CB-CE2 3.97Å; W200-F204 HydrophobicContact CD2-CE2 4.43Å; W200-F204 HydrophobicContact CD2-CZ 4.37Å; W200-F204 HydrophobicContact CE3-CE1 4.1Å; W200-F204 HydrophobicContact CE3-CE2 4Å; W200-F204 AromaticContact CE3-CZ 3.65Å; W200-F204 HydrophobicContact CE3-CZ 3.65Å; W200-F204 HydrophobicContact CG-CE2 4.46Å; W200-F204 HydrophobicContact CZ3-CE1 4.34Å; W200-F204 HydrophobicContact CZ3-CZ 4.14Å; W200-F204 WeakPolarHBondContact O-CB 3.34Å; W200-F204 WeakPolarHBondContact O-CD2 3.25Å; W200-F204 WeakPolarHBondContact O-CG 3.16Å; W200-F204 PolarHBondContact O-N 2.85Å; R202-F204 PolarHBondContact O-N 2.75Å; F204-D206 VanDerWaalsContact C-N 3.31Å; F204-D206 PolarHBondContact O-N 3.2Å; F204-Q207 PolarHBondContact O-N 3.11Å; F204-W208 WeakPolarHBondContact O-CB 3.34Å; F204-W208 PolarHBondContact O-N 3.42Å; F204-I298 HydrophobicContact CB-CG1 4.35Å; F204-I298 HydrophobicContact CB-CG2 3.87Å; F204-I298 HydrophobicContact CD1-CG1 3.96Å; F204-I298 HydrophobicContact CG-CG1 4.36Å; F204-I298 HydrophobicContact CG-CG2 4.19Å; F204-H301 HydrophobicContact CE1-CB 4.3Å; F204-H301 HydrophobicContact CE2-CB 3.82Å; F204-H301 HydrophobicContact CZ-CB 3.51Å; F204-H301 AromaticContact CZ-CG 3.97Å; F204-I302 HydrophobicContact CD2-CG1 3.95Å; F204-I302 HydrophobicContact CE2-CG1 4.45Å; F204-L305 HydrophobicContact CE2-CD1 3.86Å
205	K	98.1	Very high	97.7	Very high	121 Å²	121	70 Å²	70	53%	0.526	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-44	171.9	-169.4	-164.9	176.1	-162	0	110.9	L107 R201 R202 E203 W208 A209	L107-K205 HydrophobicContact CD1-CB 3.99Å; L107-K205 HydrophobicContact CD1-CG 4.17Å; L107-K205 HydrophobicContact CD2-CB 4.35Å; R201-K205 WeakPolarHBondContact O-CB 3.19Å; R201-K205 PolarHBondContact O-N 2.79Å; R202-K205 WeakPolarHBondContact O-CB 3.26Å; R202-K205 PolarHBondContact O-N 3.4Å; E203-K205 PolarHBondContact O-N 3.49Å; K205-W208 PolarHBondContact O-N 3.09Å; K205-A209 WeakPolarHBondContact O-CB 3.26Å; K205-A209 PolarHBondContact O-N 3.25Å
206	D	98	Very high	97.6	Very high	80 Å²	80	69.9 Å²	69.9	43%	0.428	32%	0.317	S	S	.	.	H	α-helix	trans	-73	-31.4	-178.8	-68	-12.4	0	0	0	111.9	R202 E203 F204 R210	R202-D206 PolarHBondContact O-N 3.09Å; E203-D206 PolarHBondContact O-N 2.93Å; E203-D206 VanDerWaalsContact O-N 3.16Å; F204-D206 VanDerWaalsContact C-N 3.31Å; F204-D206 PolarHBondContact O-N 3.2Å; D206-R210 WeakPolarHBondContact O-CB 3.28Å; D206-R210 WeakPolarHBondContact O-CG 3.33Å; D206-R210 PolarHBondContact O-N 3.31Å; D206-R210 PolarHBondContact O-NE 3.43Å
207	Q	96.9	Very high	97.6	Very high	57 Å²	57	71.8 Å²	71.8	27%	0.266	33%	0.329	S	S	.	.	H	α-helix	trans	-62.9	-49.7	168.9	-72.8	176.7	16.8	0	0	111.8	E203 F204 A209 R210 A211 I298	E203-Q207 WeakPolarHBondContact O-CG 3.25Å; E203-Q207 PolarHBondContact O-N 2.91Å; E203-Q207 VanDerWaalsContact OE1-CG 3.3Å; E203-Q207 WeakPolarHBondContact OE1-CG 3.08Å; E203-Q207 PolarHBondContact OE1-NE2 2.76Å; F204-Q207 PolarHBondContact O-N 3.11Å; Q207-A209 PolarHBondContact O-N 2.95Å; Q207-R210 WeakPolarHBondContact O-CA 3.14Å; Q207-R210 WeakPolarHBondContact O-CB 3.28Å; Q207-R210 PolarHBondContact O-N 2.81Å; Q207-A211 PolarHBondContact O-N 3.27Å; Q207-I298 HydrophobicContact CB-CD1 4.26Å
208	W	97.6	Very high	97.5	Very high	16 Å²	16	72.4 Å²	72.4	6%	0.061	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-46.5	178	-173.5	-127.4	0	0	0	111.7	V103 E104 F204 K205 R210 A211 Q212 L291 K295 I298	V103-W208 HydrophobicContact CB-CD2 3.98Å; V103-W208 HydrophobicContact CB-CG 4.18Å; V103-W208 HydrophobicContact CB-CZ2 4.13Å; V103-W208 HydrophobicContact CG1-CB 4.11Å; V103-W208 HydrophobicContact CG1-CD2 3.82Å; V103-W208 HydrophobicContact CG1-CE3 4.48Å; V103-W208 HydrophobicContact CG1-CG 3.62Å; V103-W208 HydrophobicContact CG2-CD2 3.91Å; V103-W208 HydrophobicContact CG2-CE3 4.1Å; V103-W208 HydrophobicContact CG2-CH2 3.96Å; V103-W208 HydrophobicContact CG2-CZ2 3.74Å; V103-W208 HydrophobicContact CG2-CZ3 4.12Å; E104-W208 PolarHBondContact OE1-NE1 2.88Å; E104-W208 PolarHBondContact OE2-NE1 2.95Å; E104-W208 VanDerWaalsContact OE2-NE1 3.09Å; F204-W208 WeakPolarHBondContact O-CB 3.34Å; F204-W208 PolarHBondContact O-N 3.42Å; K205-W208 PolarHBondContact O-N 3.09Å; W208-R210 PolarHBondContact O-N 2.93Å; W208-A211 PolarHBondContact O-N 3.46Å; W208-Q212 HydrophobicContact CD2-CG 4.17Å; W208-Q212 HydrophobicContact CZ2-CG 4.17Å; W208-Q212 WeakPolarHBondContact O-CG 3.17Å; W208-Q212 PolarHBondContact O-N 3.36Å; W208-L291 HydrophobicContact CE3-CD1 4.04Å; W208-L291 HydrophobicContact CH2-CD1 3.71Å; W208-L291 HydrophobicContact CH2-CG 4.02Å; W208-L291 HydrophobicContact CZ3-CD1 3.36Å; W208-L291 HydrophobicContact CZ3-CG 3.95Å; W208-K295 HydrophobicContact CH2-CB 4.01Å; W208-K295 HydrophobicContact CH2-CD 4.38Å; W208-K295 HydrophobicContact CH2-CG 4.45Å; W208-K295 HydrophobicContact CZ3-CB 3.83Å; W208-I298 HydrophobicContact CB-CD1 3.96Å; W208-I298 HydrophobicContact CE3-CD1 4.45Å
209	A	97.1	Very high	97.5	Very high	32 Å²	32	72.7 Å²	72.7	26%	0.264	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-19.8	175.1	0	0	0	0	0	113.7	K205 Q207 R213	K205-A209 WeakPolarHBondContact O-CB 3.26Å; K205-A209 PolarHBondContact O-N 3.25Å; Q207-A209 PolarHBondContact O-N 2.95Å; A209-R213 PolarHBondContact O-NE 3.07Å; A209-R213 PolarHBondContact O-NH2 3.2Å
210	R	96.9	Very high	97.5	Very high	113 Å²	113	68.5 Å²	68.5	43%	0.426	32%	0.324	S	S	.	.	H	α-helix	trans	-78.2	-42.1	168.6	-75.7	178.9	-61.4	-114.1	16.2	111.1	E203 D206 Q207 W208 R213 K214	E203-R210 IonicContact OE1-CZ 2.85Å; E203-R210 IonicContact OE1-NH2 2.71Å; E203-R210 PolarHBondContact OE1-NH2 3.17Å; D206-R210 WeakPolarHBondContact O-CB 3.28Å; D206-R210 WeakPolarHBondContact O-CG 3.33Å; D206-R210 PolarHBondContact O-N 3.31Å; D206-R210 PolarHBondContact O-NE 3.43Å; Q207-R210 WeakPolarHBondContact O-CA 3.14Å; Q207-R210 WeakPolarHBondContact O-CB 3.28Å; Q207-R210 PolarHBondContact O-N 2.81Å; W208-R210 PolarHBondContact O-N 2.93Å; R210-R213 PolarHBondContact O-N 2.87Å; R210-K214 PolarHBondContact O-N 3.43Å
211	A	95.4	Very high	97.4	Very high	15 Å²	15	65.6 Å²	65.6	12%	0.124	32%	0.322	C	S	.	.	H	α-helix	trans	-68.1	-45.8	178.9	0	0	0	0	0	113	Q207 W208 R213 K214 M215 L291	Q207-A211 PolarHBondContact O-N 3.27Å; W208-A211 PolarHBondContact O-N 3.46Å; A211-R213 VanDerWaalsContact C-N 3.26Å; A211-R213 PolarHBondContact O-N 3.21Å; A211-K214 WeakPolarHBondContact O-CB 3.4Å; A211-K214 PolarHBondContact O-N 2.86Å; A211-M215 PolarHBondContact O-N 2.9Å; A211-M215 VanDerWaalsContact O-N 3.14Å; A211-L291 HydrophobicContact CB-CD1 3.62Å
212	Q	95.5	Very high	97.4	Very high	78 Å²	78	65.6 Å²	65.6	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-56.3	-39.7	175.3	-73.7	174	-40	0	0	112	E104 W208 M215 S216 L291	E104-Q212 PolarHBondContact OE1-NE2 2.84Å; W208-Q212 HydrophobicContact CD2-CG 4.17Å; W208-Q212 HydrophobicContact CZ2-CG 4.17Å; W208-Q212 WeakPolarHBondContact O-CG 3.17Å; W208-Q212 PolarHBondContact O-N 3.36Å; Q212-M215 PolarHBondContact O-N 3.45Å; Q212-S216 WeakPolarHBondContact O-CB 3.29Å; Q212-S216 PolarHBondContact O-N 3.14Å; Q212-L291 HydrophobicContact CG-CD1 4.45Å
213	R	97.3	Very high	97.4	Very high	150 Å²	150	65.8 Å²	65.8	57%	0.566	33%	0.33	S	S	*	.	H	α-helix	trans	-65.4	-49.1	176.2	-83.1	-179	-72.1	155.3	-4.2	112.6	A209 R210 A211 M215 S216 D217	A209-R213 PolarHBondContact O-NE 3.07Å; A209-R213 PolarHBondContact O-NH2 3.2Å; R210-R213 PolarHBondContact O-N 2.87Å; A211-R213 VanDerWaalsContact C-N 3.26Å; A211-R213 PolarHBondContact O-N 3.21Å; R213-M215 PolarHBondContact O-N 3.07Å; R213-S216 WeakPolarHBondContact O-CB 3.04Å; R213-S216 PolarHBondContact O-N 3.15Å; R213-S216 VanDerWaalsContact O-N 3.09Å; R213-D217 PolarHBondContact O-N 2.97Å
214	K	96.8	Very high	97.4	Very high	107 Å²	107	68.7 Å²	68.7	47%	0.465	34%	0.341	S	S	.	.	H	α-helix	trans	-48.5	-48.2	173.5	-80.9	-177.2	159.4	-165.8	0	111.5	R210 A211 D217 A218 E290	R210-K214 PolarHBondContact O-N 3.43Å; A211-K214 WeakPolarHBondContact O-CB 3.4Å; A211-K214 PolarHBondContact O-N 2.86Å; K214-D217 PolarHBondContact O-N 3.25Å; K214-A218 WeakPolarHBondContact O-CB 3.38Å; K214-A218 PolarHBondContact O-N 3.27Å; K214-E290 IonicContact NZ-OE1 3.05Å; K214-E290 PolarHBondContact NZ-OE1 3.39Å; K214-E290 IonicContact NZ-OE2 3.91Å; K214-E290 PolarHBondContact NZ-OE2 2.82Å
215	M	97.2	Very high	97.4	Very high	29 Å²	29	68.7 Å²	68.7	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-42.2	-179.2	-172.7	60	-173.3	0	0	112.3	A211 Q212 R213 D217 A218 V219 T287 Q288 L291	A211-M215 PolarHBondContact O-N 2.9Å; A211-M215 VanDerWaalsContact O-N 3.14Å; Q212-M215 PolarHBondContact O-N 3.45Å; R213-M215 PolarHBondContact O-N 3.07Å; M215-D217 VanDerWaalsContact C-N 3.32Å; M215-D217 PolarHBondContact O-N 3.24Å; M215-A218 PolarHBondContact O-N 3.37Å; M215-V219 HydrophobicContact CE-CG2 3.66Å; M215-V219 HydrophobicContact CG-CG2 4.46Å; M215-V219 WeakPolarHBondContact O-CB 3.5Å; M215-V219 VanDerWaalsContact O-CG2 3.29Å; M215-V219 WeakPolarHBondContact O-CG2 3.24Å; M215-V219 PolarHBondContact O-N 3.37Å; M215-V219 HydrophobicContact SD-CG2 4.35Å; M215-T287 PolarHBondContact SD-OG1 3.13Å; M215-Q288 HydrophobicContact CE-CB 3.88Å; M215-Q288 VanDerWaalsContact CE-OE1 3.28Å; M215-Q288 HydrophobicContact SD-CB 4.16Å; M215-L291 HydrophobicContact CB-CD2 4.05Å; M215-L291 HydrophobicContact CG-CD2 3.98Å
216	S	97.3	Very high	97.4	Very high	69 Å²	69	67.6 Å²	67.6	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-42.4	174.3	-178.1	0	0	0	0	112.4	Q212 R213 T220	Q212-S216 WeakPolarHBondContact O-CB 3.29Å; Q212-S216 PolarHBondContact O-N 3.14Å; R213-S216 WeakPolarHBondContact O-CB 3.04Å; R213-S216 PolarHBondContact O-N 3.15Å; R213-S216 VanDerWaalsContact O-N 3.09Å; S216-T220 VanDerWaalsContact O-CB 3.28Å; S216-T220 WeakPolarHBondContact O-CB 3.25Å; S216-T220 PolarHBondContact O-N 3.26Å; S216-T220 PolarHBondContact O-OG1 2.93Å
217	D	97.9	Very high	97.4	Very high	107 Å²	107	70 Å²	70	57%	0.572	35%	0.346	S	S	*	.	H	α-helix	trans	-67.6	-44.3	178.4	-67.4	-32.9	0	0	0	111.3	R213 K214 M215 T220 A221	R213-D217 PolarHBondContact O-N 2.97Å; K214-D217 PolarHBondContact O-N 3.25Å; M215-D217 VanDerWaalsContact C-N 3.32Å; M215-D217 PolarHBondContact O-N 3.24Å; D217-T220 WeakPolarHBondContact O-CB 3.16Å; D217-T220 PolarHBondContact O-N 3.01Å; D217-T220 VanDerWaalsContact O-N 3.17Å; D217-A221 PolarHBondContact O-N 3.26Å
218	A	97.6	Very high	97.4	Very high	16 Å²	16	71.6 Å²	71.6	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-62.5	-44.9	175.8	0	0	0	0	0	112.4	K214 M215 T220 A221 L222 T287	K214-A218 WeakPolarHBondContact O-CB 3.38Å; K214-A218 PolarHBondContact O-N 3.27Å; M215-A218 PolarHBondContact O-N 3.37Å; A218-T220 VanDerWaalsContact C-N 3.26Å; A218-T220 PolarHBondContact O-N 2.87Å; A218-A221 PolarHBondContact O-N 3.46Å; A218-L222 WeakPolarHBondContact O-CB 3.49Å; A218-L222 PolarHBondContact O-N 2.79Å; A218-T287 HydrophobicContact CB-CG2 4.06Å; A218-T287 WeakPolarHBondContact CB-OG1 3.32Å
219	V	97.8	Very high	97.4	Very high	42 Å²	42	73.1 Å²	73.1	26%	0.255	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-35	173.6	169.1	0	0	0	0	111.5	M215 K223	M215-V219 HydrophobicContact CE-CG2 3.66Å; M215-V219 HydrophobicContact CG-CG2 4.46Å; M215-V219 WeakPolarHBondContact O-CB 3.5Å; M215-V219 VanDerWaalsContact O-CG2 3.29Å; M215-V219 WeakPolarHBondContact O-CG2 3.24Å; M215-V219 PolarHBondContact O-N 3.37Å; M215-V219 HydrophobicContact SD-CG2 4.35Å; V219-K223 HydrophobicContact CG1-CD 4.09Å; V219-K223 WeakPolarHBondContact O-CB 3.29Å; V219-K223 VanDerWaalsContact O-CG 3.25Å; V219-K223 WeakPolarHBondContact O-CG 3.5Å; V219-K223 PolarHBondContact O-N 3.14Å
220	T	98	Very high	97.4	Very high	53 Å²	53	76.7 Å²	76.7	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-72.1	-39	177.1	-62.3	0	0	0	0	111.9	S216 D217 A218 K224	S216-T220 VanDerWaalsContact O-CB 3.28Å; S216-T220 WeakPolarHBondContact O-CB 3.25Å; S216-T220 PolarHBondContact O-N 3.26Å; S216-T220 PolarHBondContact O-OG1 2.93Å; D217-T220 WeakPolarHBondContact O-CB 3.16Å; D217-T220 PolarHBondContact O-N 3.01Å; D217-T220 VanDerWaalsContact O-N 3.17Å; A218-T220 VanDerWaalsContact C-N 3.26Å; A218-T220 PolarHBondContact O-N 2.87Å; T220-K224 HydrophobicContact CG2-CD 4.46Å; T220-K224 WeakPolarHBondContact O-CG 3.47Å; T220-K224 PolarHBondContact O-N 3.27Å; T220-K224 VanDerWaalsContact O-N 3.12Å
221	A	97.8	Very high	97.4	Very high	44 Å²	44	75.5 Å²	75.5	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-47.6	171.3	0	0	0	0	0	111.3	D217 A218 K223 K224 A225	D217-A221 PolarHBondContact O-N 3.26Å; A218-A221 PolarHBondContact O-N 3.46Å; A221-K223 PolarHBondContact O-N 3.13Å; A221-K224 WeakPolarHBondContact O-CB 3.43Å; A221-K224 PolarHBondContact O-N 3.07Å; A221-K224 VanDerWaalsContact O-N 3.12Å; A221-A225 PolarHBondContact O-N 3.17Å
222	L	97.9	Very high	97.5	Very high	39 Å²	39	78.3 Å²	78.3	20%	0.204	38%	0.375	C	S	.	.	H	α-helix	trans	-56.4	-45.6	175.3	174.6	60.2	0	0	0	112.5	A218 K224 A225 K226 Y277 C280 V281 A284	A218-L222 WeakPolarHBondContact O-CB 3.49Å; A218-L222 PolarHBondContact O-N 2.79Å; L222-K224 VanDerWaalsContact C-N 3.35Å; L222-K224 PolarHBondContact O-N 2.72Å; L222-A225 PolarHBondContact O-N 2.83Å; L222-K226 VanDerWaalsContact O-CB 3.26Å; L222-K226 WeakPolarHBondContact O-CB 3.44Å; L222-K226 PolarHBondContact O-N 2.85Å; L222-Y277 HydrophobicContact CD1-CD2 3.84Å; L222-Y277 HydrophobicContact CD1-CE2 3.52Å; L222-C280 HydrophobicContact CB-CB 4.27Å; L222-C280 HydrophobicContact CD1-CB 4.18Å; L222-V281 HydrophobicContact CD1-CB 4.36Å; L222-V281 HydrophobicContact CD1-CG2 3.48Å; L222-V281 VanDerWaalsContact CD1-CG2 3.48Å; L222-A284 HydrophobicContact CD2-CB 3.87Å
223	K	97.9	Very high	97.5	Very high	139 Å²	139	76.4 Å²	76.4	60%	0.604	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-41.4	175.5	-76.3	167.7	-179.3	173.6	0	112	V219 A221 H227	V219-K223 HydrophobicContact CG1-CD 4.09Å; V219-K223 WeakPolarHBondContact O-CB 3.29Å; V219-K223 VanDerWaalsContact O-CG 3.25Å; V219-K223 WeakPolarHBondContact O-CG 3.5Å; V219-K223 PolarHBondContact O-N 3.14Å; A221-K223 PolarHBondContact O-N 3.13Å; K223-H227 PolarHBondContact O-N 3.32Å; K223-H227 VanDerWaalsContact O-N 3.09Å
224	K	98.1	Very high	97.5	Very high	130 Å²	130	73 Å²	73	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-66	-49	176.5	-71.5	168.1	-179	174.5	0	111.9	T220 A221 L222 K226 H227 Q228	T220-K224 HydrophobicContact CG2-CD 4.46Å; T220-K224 WeakPolarHBondContact O-CG 3.47Å; T220-K224 PolarHBondContact O-N 3.27Å; T220-K224 VanDerWaalsContact O-N 3.12Å; A221-K224 WeakPolarHBondContact O-CB 3.43Å; A221-K224 PolarHBondContact O-N 3.07Å; A221-K224 VanDerWaalsContact O-N 3.12Å; L222-K224 VanDerWaalsContact C-N 3.35Å; L222-K224 PolarHBondContact O-N 2.72Å; K224-K226 VanDerWaalsContact C-N 3.34Å; K224-K226 PolarHBondContact O-N 2.89Å; K224-H227 PolarHBondContact O-N 2.76Å; K224-Q228 WeakPolarHBondContact O-CG 3.34Å; K224-Q228 PolarHBondContact O-N 3.48Å
225	A	98	Very high	97.4	Very high	5 Å²	5	71.3 Å²	71.3	4%	0.041	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-41.4	178.3	0	0	0	0	0	111.8	A221 L222 H227 Q228 Y229 L276 Y277 C280	A221-A225 PolarHBondContact O-N 3.17Å; L222-A225 PolarHBondContact O-N 2.83Å; A225-H227 PolarHBondContact O-N 2.79Å; A225-Q228 PolarHBondContact O-N 3.02Å; A225-Y229 PolarHBondContact O-N 3.01Å; A225-L276 HydrophobicContact CB-CG 4.28Å; A225-Y277 HydrophobicContact CB-CD2 4.45Å; A225-C280 HydrophobicContact CB-CB 4.19Å
226	K	97.8	Very high	97.2	Very high	98 Å²	98	70.6 Å²	70.6	43%	0.426	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-49	173.5	-171	174	179.4	178.3	0	111.9	L222 K224 Y229 F230 Y277	L222-K226 VanDerWaalsContact O-CB 3.26Å; L222-K226 WeakPolarHBondContact O-CB 3.44Å; L222-K226 PolarHBondContact O-N 2.85Å; K224-K226 VanDerWaalsContact C-N 3.34Å; K224-K226 PolarHBondContact O-N 2.89Å; K226-Y229 PolarHBondContact O-N 3.25Å; K226-F230 HydrophobicContact CD-CE2 4.42Å; K226-F230 HydrophobicContact CG-CD2 4.02Å; K226-F230 HydrophobicContact CG-CE2 3.77Å; K226-F230 WeakPolarHBondContact O-CD2 3.35Å; K226-F230 PolarHBondContact O-N 2.83Å; K226-F230 VanDerWaalsContact O-N 3.15Å; K226-Y277 HydrophobicContact CB-CD2 3.82Å; K226-Y277 HydrophobicContact CB-CE2 3.49Å; K226-Y277 VanDerWaalsContact CB-CE2 3.49Å; K226-Y277 HydrophobicContact CD-CE2 4.13Å; K226-Y277 HydrophobicContact CG-CD2 4.41Å; K226-Y277 HydrophobicContact CG-CE2 3.74Å
227	H	97.9	Very high	97	Very high	131 Å²	131	73.8 Å²	73.8	61%	0.606	36%	0.361	S	S	*	.	H	α-helix	trans	-63.7	-42.9	179.4	-179.5	59.5	0	0	0	112	K223 K224 A225 Y229 F230 Q231	K223-H227 PolarHBondContact O-N 3.32Å; K223-H227 VanDerWaalsContact O-N 3.09Å; K224-H227 PolarHBondContact O-N 2.76Å; A225-H227 PolarHBondContact O-N 2.79Å; H227-Y229 PolarHBondContact O-N 3.39Å; H227-F230 PolarHBondContact O-N 3.22Å; H227-Q231 PolarHBondContact O-N 3.4Å
228	Q	97.4	Very high	96.7	Very high	90 Å²	90	75 Å²	75	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-42.4	175	-72.3	175.7	-2.1	0	0	112.1	K224 A225 Q231 R232	K224-Q228 WeakPolarHBondContact O-CG 3.34Å; K224-Q228 PolarHBondContact O-N 3.48Å; A225-Q228 PolarHBondContact O-N 3.02Å; Q228-Q231 PolarHBondContact O-N 2.74Å; Q228-R232 VanDerWaalsContact O-CG 3.29Å; Q228-R232 WeakPolarHBondContact O-CG 3.35Å; Q228-R232 PolarHBondContact O-N 3.21Å
229	Y	97.9	Very high	96.3	Very high	48 Å²	48	74.9 Å²	74.9	19%	0.188	36%	0.36	C	S	.	.	H	α-helix	trans	-58.3	-50.5	175.3	174.1	-108.6	0	0	0	112	A225 K226 H227 Q231 R232 C233 V270 A273 E274 Y277	A225-Y229 PolarHBondContact O-N 3.01Å; K226-Y229 PolarHBondContact O-N 3.25Å; H227-Y229 PolarHBondContact O-N 3.39Å; Y229-Q231 PolarHBondContact O-N 2.87Å; Y229-R232 PolarHBondContact O-N 2.84Å; Y229-C233 PolarHBondContact O-N 3.31Å; Y229-C233 PolarHBondContact O-SG 3.29Å; Y229-C233 VanDerWaalsContact O-SG 3.38Å; Y229-V270 HydrophobicContact CE2-CG1 3.93Å; Y229-A273 HydrophobicContact CD2-CB 4.34Å; Y229-E274 HydrophobicContact CD2-CB 3.91Å; Y229-E274 HydrophobicContact CD2-CG 4.38Å; Y229-E274 HydrophobicContact CE2-CB 3.57Å; Y229-E274 HydrophobicContact CE2-CG 3.72Å; Y229-E274 PolarHBondContact OH-OE2 2.85Å; Y229-Y277 HydrophobicContact CD1-CD1 4.43Å
230	F	97.6	Very high	95.9	Very high	107 Å²	107	77.8 Å²	77.8	47%	0.469	37%	0.37	S	S	.	.	H	α-helix	trans	-60.9	-42.7	176.4	-76.8	-69	0	0	0	112.5	K226 H227 R232 C233 D234	K226-F230 HydrophobicContact CD-CE2 4.42Å; K226-F230 HydrophobicContact CG-CD2 4.02Å; K226-F230 HydrophobicContact CG-CE2 3.77Å; K226-F230 WeakPolarHBondContact O-CD2 3.35Å; K226-F230 PolarHBondContact O-N 2.83Å; K226-F230 VanDerWaalsContact O-N 3.15Å; H227-F230 PolarHBondContact O-N 3.22Å; F230-R232 VanDerWaalsContact C-N 3.3Å; F230-R232 PolarHBondContact O-N 3.4Å; F230-C233 WeakPolarHBondContact O-CB 3.1Å; F230-C233 PolarHBondContact O-N 3.13Å; F230-C233 VanDerWaalsContact O-N 3.12Å; F230-D234 PolarHBondContact O-N 2.87Å
231	Q	97.4	Very high	95.3	Very high	88 Å²	88	77.6 Å²	77.6	41%	0.411	37%	0.373	S	S	.	.	H	α-helix	trans	-57.1	-42.4	174.9	-173.8	-168.5	-24.9	0	0	112.1	H227 Q228 Y229 D234 E235	H227-Q231 PolarHBondContact O-N 3.4Å; Q228-Q231 PolarHBondContact O-N 2.74Å; Y229-Q231 PolarHBondContact O-N 2.87Å; Q231-D234 PolarHBondContact O-N 2.89Å; Q231-E235 PolarHBondContact NE2-OE1 2.98Å; Q231-E235 WeakPolarHBondContact O-CG 3.48Å; Q231-E235 PolarHBondContact O-N 2.83Å
232	R	96.8	Very high	94.6	Very high	74 Å²	74	78.7 Å²	78.7	28%	0.279	38%	0.378	S	S	.	.	H	α-helix	trans	-68.6	-34.7	177.4	-64.6	-63.7	-178.2	71.4	0.1	112.2	Q228 Y229 F230 E235 L236 K269 V270 A273	Q228-R232 VanDerWaalsContact O-CG 3.29Å; Q228-R232 WeakPolarHBondContact O-CG 3.35Å; Q228-R232 PolarHBondContact O-N 3.21Å; Y229-R232 PolarHBondContact O-N 2.84Å; F230-R232 VanDerWaalsContact C-N 3.3Å; F230-R232 PolarHBondContact O-N 3.4Å; R232-E235 WeakPolarHBondContact CD-OE2 3.13Å; R232-E235 IonicContact NE-OE2 2.71Å; R232-E235 PolarHBondContact O-N 3.23Å; R232-L236 WeakPolarHBondContact O-CB 3.5Å; R232-L236 PolarHBondContact O-N 3.46Å; R232-K269 PolarHBondContact NH1-O 3.33Å; R232-V270 VanDerWaalsContact C-CG2 3.44Å; R232-V270 HydrophobicContact CB-CG2 3.77Å; R232-V270 VanDerWaalsContact O-CG2 3.22Å; R232-V270 WeakPolarHBondContact O-CG2 3.38Å; R232-A273 HydrophobicContact CB-CB 4.42Å; R232-A273 HydrophobicContact CG-CB 4.07Å
233	C	96	Very high	93.6	Very high	38 Å²	38	78.4 Å²	78.4	26%	0.257	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-46.1	172.6	-70.3	0	0	0	0	111.5	Y229 F230 E235 L236 E237	Y229-C233 PolarHBondContact O-N 3.31Å; Y229-C233 PolarHBondContact O-SG 3.29Å; Y229-C233 VanDerWaalsContact O-SG 3.38Å; F230-C233 WeakPolarHBondContact O-CB 3.1Å; F230-C233 PolarHBondContact O-N 3.13Å; F230-C233 VanDerWaalsContact O-N 3.12Å; C233-E235 VanDerWaalsContact C-N 3.34Å; C233-E235 PolarHBondContact O-N 2.83Å; C233-L236 PolarHBondContact O-N 2.77Å; C233-E237 PolarHBondContact O-N 3.4Å
234	D	96.3	Very high	92.7	Very high	78 Å²	78	74.6 Å²	74.6	42%	0.417	37%	0.374	S	S	.	.	H	α-helix	trans	-60.9	-41.2	174.6	-69	9	0	0	0	112.2	F230 Q231 E237 K238	F230-D234 PolarHBondContact O-N 2.87Å; Q231-D234 PolarHBondContact O-N 2.89Å; D234-E237 PolarHBondContact O-N 3.39Å; D234-K238 WeakPolarHBondContact O-CB 3.46Å; D234-K238 VanDerWaalsContact O-CD 3.24Å; D234-K238 WeakPolarHBondContact O-CD 3.31Å; D234-K238 WeakPolarHBondContact O-CG 3.41Å; D234-K238 PolarHBondContact O-N 3.15Å
235	E	94.3	Very high	91.4	Very high	73 Å²	73	76.2 Å²	76.2	34%	0.341	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175.6	-75.3	171.4	-162.2	0	0	111.5	Q231 R232 C233 K238 A239	Q231-E235 PolarHBondContact NE2-OE1 2.98Å; Q231-E235 WeakPolarHBondContact O-CG 3.48Å; Q231-E235 PolarHBondContact O-N 2.83Å; R232-E235 WeakPolarHBondContact CD-OE2 3.13Å; R232-E235 IonicContact NE-OE2 2.71Å; R232-E235 PolarHBondContact O-N 3.23Å; C233-E235 VanDerWaalsContact C-N 3.34Å; C233-E235 PolarHBondContact O-N 2.83Å; E235-K238 PolarHBondContact O-N 3.42Å; E235-A239 WeakPolarHBondContact O-CB 3.28Å; E235-A239 PolarHBondContact O-N 3.2Å
236	L	93.6	Very high	89.6	Confident	13 Å²	13	76 Å²	76	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-66.1	-36.8	174.6	175.5	60.4	0	0	0	112.2	R232 C233 A239 K240 K263 A266 Q267 V270	R232-L236 WeakPolarHBondContact O-CB 3.5Å; R232-L236 PolarHBondContact O-N 3.46Å; C233-L236 PolarHBondContact O-N 2.77Å; L236-A239 PolarHBondContact O-N 3.23Å; L236-K240 HydrophobicContact CD1-CD 4.46Å; L236-K240 HydrophobicContact CD1-CG 4.36Å; L236-K240 HydrophobicContact CG-CD 4.24Å; L236-K240 WeakPolarHBondContact O-CB 3.4Å; L236-K240 VanDerWaalsContact O-CG 3.27Å; L236-K240 WeakPolarHBondContact O-CG 3.5Å; L236-K240 PolarHBondContact O-N 2.94Å; L236-K263 HydrophobicContact CD1-CG 4.35Å; L236-A266 HydrophobicContact CB-CB 4.44Å; L236-A266 HydrophobicContact CD1-CB 4.09Å; L236-Q267 HydrophobicContact CD1-CB 3.97Å; L236-Q267 HydrophobicContact CD2-CB 4.39Å; L236-Q267 HydrophobicContact CD2-CG 4.4Å; L236-V270 HydrophobicContact CB-CG2 3.83Å; L236-V270 HydrophobicContact CD2-CB 4.3Å; L236-V270 HydrophobicContact CD2-CG2 3.82Å; L236-V270 HydrophobicContact CG-CG2 4.45Å
237	E	93.8	Very high	87.7	Confident	136 Å²	136	76.9 Å²	76.9	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-66.4	-43.3	174.3	-174.1	165.8	-142.5	0	0	111.6	C233 D234 A239 K240 A241	C233-E237 PolarHBondContact O-N 3.4Å; D234-E237 PolarHBondContact O-N 3.39Å; E237-A239 VanDerWaalsContact C-N 3.3Å; E237-A239 PolarHBondContact O-N 3.06Å; E237-K240 PolarHBondContact O-N 3.23Å; E237-A241 WeakPolarHBondContact O-CB 3.3Å; E237-A241 PolarHBondContact O-N 2.98Å
238	K	92.1	Very high	85.8	Confident	132 Å²	132	77.5 Å²	77.5	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-61.3	-37.4	173.4	-68	156.7	-165.4	161.7	0	111.7	D234 E235 S242	D234-K238 WeakPolarHBondContact O-CB 3.46Å; D234-K238 VanDerWaalsContact O-CD 3.24Å; D234-K238 WeakPolarHBondContact O-CD 3.31Å; D234-K238 WeakPolarHBondContact O-CG 3.41Å; D234-K238 PolarHBondContact O-N 3.15Å; E235-K238 PolarHBondContact O-N 3.42Å; K238-S242 WeakPolarHBondContact O-CB 3.41Å; K238-S242 PolarHBondContact O-N 3.02Å; K238-S242 PolarHBondContact O-OG 3.08Å
239	A	88.8	Confident	83.9	Confident	14 Å²	14	77.6 Å²	77.6	12%	0.116	40%	0.404	C	S	.	.	H	α-helix	trans	-67.5	-42	173.1	0	0	0	0	0	112.7	E235 L236 E237 S242 S243 A266	E235-A239 WeakPolarHBondContact O-CB 3.28Å; E235-A239 PolarHBondContact O-N 3.2Å; L236-A239 PolarHBondContact O-N 3.23Å; E237-A239 VanDerWaalsContact C-N 3.3Å; E237-A239 PolarHBondContact O-N 3.06Å; A239-S242 WeakPolarHBondContact CA-OG 3.37Å; A239-S242 PolarHBondContact O-OG 3.34Å; A239-S243 WeakPolarHBondContact O-CB 3.45Å; A239-S243 PolarHBondContact O-N 2.86Å; A239-A266 HydrophobicContact CB-CB 4.14Å
240	K	87.9	Confident	81.9	Confident	104 Å²	104	82.2 Å²	82.2	45%	0.452	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-48.4	173.3	-73.7	164	178.7	169.7	0	111.4	L236 E237 S242 S243 A244 K263	L236-K240 HydrophobicContact CD1-CD 4.46Å; L236-K240 HydrophobicContact CD1-CG 4.36Å; L236-K240 HydrophobicContact CG-CD 4.24Å; L236-K240 WeakPolarHBondContact O-CB 3.4Å; L236-K240 VanDerWaalsContact O-CG 3.27Å; L236-K240 WeakPolarHBondContact O-CG 3.5Å; L236-K240 PolarHBondContact O-N 2.94Å; E237-K240 PolarHBondContact O-N 3.23Å; K240-S242 PolarHBondContact O-N 3.03Å; K240-S243 CarbonylContact O-C 3.55Å; K240-S243 PolarHBondContact O-N 3.49Å; K240-A244 WeakPolarHBondContact O-CB 3.48Å; K240-A244 PolarHBondContact O-N 2.85Å; K240-K263 HydrophobicContact CG-CG 4.42Å
241	A	87.2	Confident	79.9	Confident	48 Å²	48	81.5 Å²	81.5	40%	0.397	44%	0.442	S	S	.	.	H	α-helix	trans	-64.1	-40.2	-178.7	0	0	0	0	0	112.9	E237 A244 K245	E237-A241 WeakPolarHBondContact O-CB 3.3Å; E237-A241 PolarHBondContact O-N 2.98Å; A241-A244 PolarHBondContact O-N 3.47Å; A241-K245 WeakPolarHBondContact O-CG 3.31Å; A241-K245 PolarHBondContact O-N 3.08Å; A241-K245 VanDerWaalsContact O-N 3.13Å
242	S	81.3	Confident	78.1	Confident	67 Å²	67	79.5 Å²	79.5	47%	0.469	45%	0.445	S	S	.	.	H	α-helix	trans	-72.2	-28.4	174.8	52.6	0	0	0	0	113.2	K238 A239 K240 A246	K238-S242 WeakPolarHBondContact O-CB 3.41Å; K238-S242 PolarHBondContact O-N 3.02Å; K238-S242 PolarHBondContact O-OG 3.08Å; A239-S242 WeakPolarHBondContact CA-OG 3.37Å; A239-S242 PolarHBondContact O-OG 3.34Å; K240-S242 PolarHBondContact O-N 3.03Å; S242-A246 WeakPolarHBondContact O-CB 3.29Å
243	S	78.5	Confident	76.4	Confident	34 Å²	34	81.2 Å²	81.2	24%	0.238	46%	0.463	C	S	.	.	H	α-helix	trans	-75.6	-21.9	169.1	-173.1	0	0	0	0	113.7	A239 K240	A239-S243 WeakPolarHBondContact O-CB 3.45Å; A239-S243 PolarHBondContact O-N 2.86Å; K240-S243 CarbonylContact O-C 3.55Å; K240-S243 PolarHBondContact O-N 3.49Å
244	A	77.8	Confident	74.9	Confident	59 Å²	59	88.4 Å²	88.4	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-80.4	-49.6	177.6	0	0	0	0	0	111.5	K240 A241 A246 V247	K240-A244 WeakPolarHBondContact O-CB 3.48Å; K240-A244 PolarHBondContact O-N 2.85Å; A241-A244 PolarHBondContact O-N 3.47Å; A244-A246 PolarHBondContact O-N 3.25Å; A244-V247 WeakPolarHBondContact O-CB 3.25Å; A244-V247 WeakPolarHBondContact O-CG2 3.44Å; A244-V247 PolarHBondContact O-N 3.46Å
245	K	71.8	Confident	73.5	Confident	163 Å²	163	87.5 Å²	87.5	71%	0.709	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-19.9	173.8	-67.4	179.5	179.1	-173.2	0	113.6	A241 V247	A241-K245 WeakPolarHBondContact O-CG 3.31Å; A241-K245 PolarHBondContact O-N 3.08Å; A241-K245 VanDerWaalsContact O-N 3.13Å; K245-V247 VanDerWaalsContact C-N 3.3Å; K245-V247 PolarHBondContact O-N 3.42Å
246	A	59.5	Low	72.2	Confident	2 Å²	2	87.8 Å²	87.8	2%	0.017	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-5.2	178.1	0	0	0	0	0	115.1	S242 A244 L256 R259	S242-A246 WeakPolarHBondContact O-CB 3.29Å; A244-A246 PolarHBondContact O-N 3.25Å; A246-L256 HydrophobicContact CB-CD2 4.48Å; A246-R259 VanDerWaalsContact CB-CD 3.48Å; A246-R259 VanDerWaalsContact CB-CZ 3.43Å; A246-R259 VanDerWaalsContact CB-NH1 3.35Å
247	V	57.7	Low	71.3	Confident	116 Å²	116	91.4 Å²	91.4	70%	0.703	51%	0.51	S	S	*	.	S	Bend	trans	-83.1	-28.9	179.6	-179.8	0	0	0	0	111.6	A244 K245	A244-V247 WeakPolarHBondContact O-CB 3.25Å; A244-V247 WeakPolarHBondContact O-CG2 3.44Å; A244-V247 PolarHBondContact O-N 3.46Å; K245-V247 VanDerWaalsContact C-N 3.3Å; K245-V247 PolarHBondContact O-N 3.42Å
248	D	57.3	Low	70.6	Confident	143 Å²	143	92.9 Å²	92.9	77%	0.765	52%	0.515	S	S	*	.	S	Bend	trans	-80.6	-21.3	177.8	-57.3	-47.9	0	0	0	113	T250	D248-T250 PolarHBondContact O-N 2.95Å
249	D	57.6	Low	69.8	Low	92 Å²	92	90 Å²	90	49%	0.492	50%	0.5	S	S	.	.	S	Bend	trans	-80.7	111	176.9	-86.3	-24.7	0	0	0	111.6	V251 R259	D249-V251 PolarHBondContact O-N 3.28Å; D249-R259 IonicContact OD2-NH2 3.98Å
250	T	56.6	Low	69.4	Low	145 Å²	145	97.2 Å²	97.2	89%	0.89	52%	0.524	S	S	*	.			trans	-75.4	55	178	60.5	0	0	0	0	113.7	D248	D248-T250 PolarHBondContact O-N 2.95Å
251	V	55.8	Low	69.2	Low	92 Å²	92	98.6 Å²	98.6	56%	0.558	53%	0.53	S	S	*	.			trans	-129.2	89.7	-173	-172.1	0	0	0	0	113.1	D249 T255	D249-V251 PolarHBondContact O-N 3.28Å; V251-T255 PolarHBondContact O-OG1 3.18Å
252	G	58.6	Low	69.1	Low	46 Å²	46	98.9 Å²	98.9	47%	0.474	53%	0.53	S	S	.	.			trans	72.7	125.5	153.1	0	0	0	0	0	118.1	K254 T255 L256	G252-K254 VanDerWaalsContact C-N 3.34Å; G252-K254 PolarHBondContact O-N 3.18Å; G252-T255 PolarHBondContact O-N 3.07Å; G252-T255 VanDerWaalsContact O-N 3.1Å; G252-T255 PolarHBondContact O-OG1 3.28Å; G252-L256 PolarHBondContact O-N 2.87Å
253	V	62.5	Low	69.4	Low	110 Å²	110	98.9 Å²	98.9	67%	0.667	52%	0.521	S	S	*	.	H	α-helix	trans	-54.6	-46.3	175.7	-177.9	0	0	0	0	112.1	T255 L256 D257	V253-T255 PolarHBondContact O-N 3.02Å; V253-T255 VanDerWaalsContact O-N 3.11Å; V253-L256 WeakPolarHBondContact O-CB 3.31Å; V253-L256 PolarHBondContact O-N 2.97Å; V253-D257 PolarHBondContact O-N 2.77Å; V253-D257 VanDerWaalsContact O-N 3.07Å
254	K	64.3	Low	69.9	Low	189 Å²	189	100.3 Å²	100.3	82%	0.822	53%	0.526	S	S	*	.	H	α-helix	trans	-58.3	-27.8	-179.9	-64.1	-177.4	179.1	179.6	0	113.6	G252 K258	G252-K254 VanDerWaalsContact C-N 3.34Å; G252-K254 PolarHBondContact O-N 3.18Å; K254-K258 PolarHBondContact O-N 3.26Å
255	T	66.6	Low	70.5	Confident	59 Å²	59	101 Å²	101	36%	0.362	52%	0.522	S	S	.	.	H	α-helix	trans	-78.8	-33.4	177.7	-3.5	0	0	0	0	111.6	V251 G252 V253 R259	V251-T255 PolarHBondContact O-OG1 3.18Å; G252-T255 PolarHBondContact O-N 3.07Å; G252-T255 VanDerWaalsContact O-N 3.1Å; G252-T255 PolarHBondContact O-OG1 3.28Å; V253-T255 PolarHBondContact O-N 3.02Å; V253-T255 VanDerWaalsContact O-N 3.11Å; T255-R259 WeakPolarHBondContact O-CD 3.44Å; T255-R259 VanDerWaalsContact O-CG 3.25Å; T255-R259 WeakPolarHBondContact O-CG 3.24Å; T255-R259 PolarHBondContact O-N 3.49Å
256	L	67.5	Low	71.5	Confident	80 Å²	80	94 Å²	94	42%	0.419	49%	0.494	S	S	.	.	H	α-helix	trans	-71.8	-42.3	175.4	-64.1	173.3	0	0	0	112	A246 G252 V253 K258 R259 R260	A246-L256 HydrophobicContact CB-CD2 4.48Å; G252-L256 PolarHBondContact O-N 2.87Å; V253-L256 WeakPolarHBondContact O-CB 3.31Å; V253-L256 PolarHBondContact O-N 2.97Å; L256-K258 VanDerWaalsContact C-N 3.33Å; L256-K258 PolarHBondContact O-N 3.21Å; L256-R259 WeakPolarHBondContact O-CB 3.3Å; L256-R259 PolarHBondContact O-N 2.97Å; L256-R259 VanDerWaalsContact O-N 3.11Å; L256-R260 PolarHBondContact O-N 2.83Å
257	D	74.8	Confident	73.2	Confident	89 Å²	89	98 Å²	98	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-60.9	-41.3	176.7	-70.1	-41.6	0	0	0	112.2	V253 R259 R260 K261	V253-D257 PolarHBondContact O-N 2.77Å; V253-D257 VanDerWaalsContact O-N 3.07Å; D257-R259 VanDerWaalsContact C-N 3.33Å; D257-R259 PolarHBondContact O-N 3.22Å; D257-R260 PolarHBondContact O-N 3.24Å; D257-K261 WeakPolarHBondContact O-CB 3.49Å; D257-K261 PolarHBondContact O-N 2.79Å
258	K	78.6	Confident	74.9	Confident	167 Å²	167	95.4 Å²	95.4	73%	0.726	50%	0.5	S	S	*	.	H	α-helix	trans	-62.9	-38.6	174.7	-172.5	177.9	179.3	-178.3	0	112	K254 L256 S262	K254-K258 PolarHBondContact O-N 3.26Å; L256-K258 VanDerWaalsContact C-N 3.33Å; L256-K258 PolarHBondContact O-N 3.21Å; K258-S262 PolarHBondContact O-N 3.31Å; K258-S262 PolarHBondContact O-OG 3.44Å
259	R	75.2	Confident	76.8	Confident	71 Å²	71	93.1 Å²	93.1	27%	0.268	48%	0.483	S	S	.	.	H	α-helix	trans	-67.5	-47.8	176.5	-73.1	163.2	169.6	165.7	-9.9	111.1	A246 D249 T255 L256 D257 K261 S262 K263	A246-R259 VanDerWaalsContact CB-CD 3.48Å; A246-R259 VanDerWaalsContact CB-CZ 3.43Å; A246-R259 VanDerWaalsContact CB-NH1 3.35Å; D249-R259 IonicContact OD2-NH2 3.98Å; T255-R259 WeakPolarHBondContact O-CD 3.44Å; T255-R259 VanDerWaalsContact O-CG 3.25Å; T255-R259 WeakPolarHBondContact O-CG 3.24Å; T255-R259 PolarHBondContact O-N 3.49Å; L256-R259 WeakPolarHBondContact O-CB 3.3Å; L256-R259 PolarHBondContact O-N 2.97Å; L256-R259 VanDerWaalsContact O-N 3.11Å; D257-R259 VanDerWaalsContact C-N 3.33Å; D257-R259 PolarHBondContact O-N 3.22Å; R259-K261 PolarHBondContact O-N 2.63Å; R259-S262 PolarHBondContact O-N 2.68Å; R259-S262 PolarHBondContact O-OG 3.28Å; R259-K263 PolarHBondContact O-N 3.35Å; R259-K263 VanDerWaalsContact O-N 3.12Å
260	R	80.1	Confident	78.7	Confident	165 Å²	165	89.4 Å²	89.4	62%	0.623	46%	0.463	S	S	*	.	H	α-helix	trans	-53.5	-54.5	172.7	172.7	177.5	-79.4	174.5	-6	110.7	L256 D257 S262 K263 D264	L256-R260 PolarHBondContact O-N 2.83Å; D257-R260 PolarHBondContact O-N 3.24Å; R260-S262 VanDerWaalsContact C-N 3.31Å; R260-S262 PolarHBondContact O-N 3.04Å; R260-K263 WeakPolarHBondContact O-CB 3.35Å; R260-K263 PolarHBondContact O-N 2.99Å; R260-D264 VanDerWaalsContact CG-OD2 3.23Å; R260-D264 WeakPolarHBondContact CG-OD2 3.34Å; R260-D264 VanDerWaalsContact O-CG 3.24Å; R260-D264 PolarHBondContact O-N 2.98Å
261	K	84.8	Confident	80.6	Confident	133 Å²	133	87.4 Å²	87.4	58%	0.578	45%	0.447	S	S	*	.	H	α-helix	trans	-55.6	-44.2	178.1	-178.9	167	-178.8	171.9	0	112.4	D257 R259 K263 D264 D265	D257-K261 WeakPolarHBondContact O-CB 3.49Å; D257-K261 PolarHBondContact O-N 2.79Å; R259-K261 PolarHBondContact O-N 2.63Å; K261-K263 VanDerWaalsContact C-N 3.27Å; K261-K263 PolarHBondContact O-N 2.81Å; K261-D264 PolarHBondContact O-N 3.19Å; K261-D264 VanDerWaalsContact O-N 3.13Å; K261-D265 WeakPolarHBondContact O-CB 3.42Å; K261-D265 PolarHBondContact O-N 3.01Å
262	S	84.8	Confident	82.5	Confident	55 Å²	55	88.7 Å²	88.7	39%	0.385	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-29.6	178.9	69.1	0	0	0	0	114.3	K258 R259 R260 A266	K258-S262 PolarHBondContact O-N 3.31Å; K258-S262 PolarHBondContact O-OG 3.44Å; R259-S262 PolarHBondContact O-N 2.68Å; R259-S262 PolarHBondContact O-OG 3.28Å; R260-S262 VanDerWaalsContact C-N 3.31Å; R260-S262 PolarHBondContact O-N 3.04Å; S262-A266 WeakPolarHBondContact O-CB 3.17Å; S262-A266 PolarHBondContact O-N 3.15Å
263	K	86.8	Confident	84.4	Confident	66 Å²	66	86.8 Å²	86.8	29%	0.287	43%	0.426	S	S	.	.	H	α-helix	trans	-72.7	-42.6	172.1	176.9	-154.4	165.5	-153.4	0	111	L236 K240 R259 R260 K261 A266 Q267	L236-K263 HydrophobicContact CD1-CG 4.35Å; K240-K263 HydrophobicContact CG-CG 4.42Å; R259-K263 PolarHBondContact O-N 3.35Å; R259-K263 VanDerWaalsContact O-N 3.12Å; R260-K263 WeakPolarHBondContact O-CB 3.35Å; R260-K263 PolarHBondContact O-N 2.99Å; K261-K263 VanDerWaalsContact C-N 3.27Å; K261-K263 PolarHBondContact O-N 2.81Å; K263-A266 PolarHBondContact O-N 3.24Å; K263-Q267 WeakPolarHBondContact O-CB 3.48Å; K263-Q267 PolarHBondContact O-N 3.15Å
264	D	89.3	Confident	86	Confident	64 Å²	64	83.4 Å²	83.4	34%	0.342	40%	0.403	S	S	.	.	H	α-helix	trans	-71.6	-36.9	-178.1	-55.7	-26.1	0	0	0	111.2	R260 K261 Q267 S268	R260-D264 VanDerWaalsContact CG-OD2 3.23Å; R260-D264 WeakPolarHBondContact CG-OD2 3.34Å; R260-D264 VanDerWaalsContact O-CG 3.24Å; R260-D264 PolarHBondContact O-N 2.98Å; K261-D264 PolarHBondContact O-N 3.19Å; K261-D264 VanDerWaalsContact O-N 3.13Å; D264-Q267 PolarHBondContact O-N 2.94Å; D264-S268 PolarHBondContact O-N 2.96Å; D264-S268 PolarHBondContact O-OG 3.04Å
265	D	91.3	Very high	87.6	Confident	75 Å²	75	80.1 Å²	80.1	40%	0.401	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-42.1	168.6	-68.1	-20.9	0	0	0	111.1	K261 K269	K261-D265 WeakPolarHBondContact O-CB 3.42Å; K261-D265 PolarHBondContact O-N 3.01Å; D265-K269 WeakPolarHBondContact O-CG 3.33Å; D265-K269 PolarHBondContact O-N 2.93Å
266	A	92.2	Very high	89.1	Confident	15 Å²	15	80.8 Å²	80.8	12%	0.124	40%	0.395	C	S	.	.	H	α-helix	trans	-69.6	-34.9	175.5	0	0	0	0	0	112.7	L236 A239 S262 K263 K269 V270	L236-A266 HydrophobicContact CB-CB 4.44Å; L236-A266 HydrophobicContact CD1-CB 4.09Å; A239-A266 HydrophobicContact CB-CB 4.14Å; S262-A266 WeakPolarHBondContact O-CB 3.17Å; S262-A266 PolarHBondContact O-N 3.15Å; K263-A266 PolarHBondContact O-N 3.24Å; A266-K269 PolarHBondContact O-N 3.03Å; A266-V270 PolarHBondContact O-N 3.38Å; A266-V270 VanDerWaalsContact O-N 3.13Å
267	Q	94	Very high	90.5	Very high	86 Å²	86	79.7 Å²	79.7	40%	0.402	39%	0.386	S	S	.	.	H	α-helix	trans	-68.7	-39.5	177.4	-172.4	169.5	-45.3	0	0	111.2	L236 K263 D264 V270 L271	L236-Q267 HydrophobicContact CD1-CB 3.97Å; L236-Q267 HydrophobicContact CD2-CB 4.39Å; L236-Q267 HydrophobicContact CD2-CG 4.4Å; K263-Q267 WeakPolarHBondContact O-CB 3.48Å; K263-Q267 PolarHBondContact O-N 3.15Å; D264-Q267 PolarHBondContact O-N 2.94Å; Q267-V270 PolarHBondContact O-N 3.24Å; Q267-L271 PolarHBondContact O-N 2.65Å; Q267-L271 VanDerWaalsContact O-N 3.16Å
268	S	95.2	Very high	91.6	Very high	62 Å²	62	82.5 Å²	82.5	43%	0.434	39%	0.39	S	S	.	.	H	α-helix	trans	-60.6	-45.1	173	-54.6	0	0	0	0	111.1	D264 V270 L271 E272	D264-S268 PolarHBondContact O-N 2.96Å; D264-S268 PolarHBondContact O-OG 3.04Å; S268-V270 VanDerWaalsContact C-N 3.26Å; S268-V270 PolarHBondContact O-N 3.04Å; S268-L271 PolarHBondContact O-N 3.4Å; S268-L271 VanDerWaalsContact O-N 3.1Å; S268-E272 WeakPolarHBondContact O-CG 3.36Å; S268-E272 PolarHBondContact O-N 2.86Å
269	K	95.6	Very high	92.6	Very high	95 Å²	95	79.9 Å²	79.9	41%	0.413	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-20.5	175.3	-77.1	174.1	-179.1	175.8	0	115.5	R232 D265 A266	R232-K269 PolarHBondContact NH1-O 3.33Å; D265-K269 WeakPolarHBondContact O-CG 3.33Å; D265-K269 PolarHBondContact O-N 2.93Å; A266-K269 PolarHBondContact O-N 3.03Å
270	V	97.5	Very high	93.6	Very high	13 Å²	13	77.1 Å²	77.1	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-78.2	-45.5	169.6	168.7	0	0	0	0	110.1	Y229 R232 L236 A266 Q267 S268 E272 A273 E274	Y229-V270 HydrophobicContact CE2-CG1 3.93Å; R232-V270 VanDerWaalsContact C-CG2 3.44Å; R232-V270 HydrophobicContact CB-CG2 3.77Å; R232-V270 VanDerWaalsContact O-CG2 3.22Å; R232-V270 WeakPolarHBondContact O-CG2 3.38Å; L236-V270 HydrophobicContact CB-CG2 3.83Å; L236-V270 HydrophobicContact CD2-CB 4.3Å; L236-V270 HydrophobicContact CD2-CG2 3.82Å; L236-V270 HydrophobicContact CG-CG2 4.45Å; A266-V270 PolarHBondContact O-N 3.38Å; A266-V270 VanDerWaalsContact O-N 3.13Å; Q267-V270 PolarHBondContact O-N 3.24Å; S268-V270 VanDerWaalsContact C-N 3.26Å; S268-V270 PolarHBondContact O-N 3.04Å; V270-E272 VanDerWaalsContact C-N 3.35Å; V270-E272 PolarHBondContact O-N 3.3Å; V270-A273 PolarHBondContact O-N 3.44Å; V270-A273 VanDerWaalsContact O-N 3.16Å; V270-E274 WeakPolarHBondContact O-CB 3.46Å; V270-E274 PolarHBondContact O-N 3.05Å
271	L	96.6	Very high	94.5	Very high	103 Å²	103	71.3 Å²	71.3	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-40.4	178.5	-65.9	170.3	0	0	0	112.3	Q267 S268 E274 L275	Q267-L271 PolarHBondContact O-N 2.65Å; Q267-L271 VanDerWaalsContact O-N 3.16Å; S268-L271 PolarHBondContact O-N 3.4Å; S268-L271 VanDerWaalsContact O-N 3.1Å; L271-E274 PolarHBondContact O-N 2.93Å; L271-L275 WeakPolarHBondContact O-CB 3.32Å; L271-L275 PolarHBondContact O-N 3.37Å
272	E	97	Very high	95.1	Very high	119 Å²	119	68 Å²	68	56%	0.556	35%	0.348	S	S	*	.	H	α-helix	trans	-57	-48.2	171.4	-71.6	169.3	178.8	0	0	112.1	S268 V270 L275 L276	S268-E272 WeakPolarHBondContact O-CG 3.36Å; S268-E272 PolarHBondContact O-N 2.86Å; V270-E272 VanDerWaalsContact C-N 3.35Å; V270-E272 PolarHBondContact O-N 3.3Å; E272-L275 PolarHBondContact O-N 3Å; E272-L276 PolarHBondContact O-N 3.19Å
273	A	97.3	Very high	95.7	Very high	6 Å²	6	68.5 Å²	68.5	5%	0.05	35%	0.346	C	S	.	.	H	α-helix	trans	-72.1	-30.6	-179.4	0	0	0	0	0	112.5	Y229 R232 V270 Y277	Y229-A273 HydrophobicContact CD2-CB 4.34Å; R232-A273 HydrophobicContact CB-CB 4.42Å; R232-A273 HydrophobicContact CG-CB 4.07Å; V270-A273 PolarHBondContact O-N 3.44Å; V270-A273 VanDerWaalsContact O-N 3.16Å; A273-Y277 VanDerWaalsContact O-CB 3.25Å; A273-Y277 WeakPolarHBondContact O-CB 3.49Å; A273-Y277 PolarHBondContact O-N 2.89Å
274	E	97.4	Very high	96.2	Very high	39 Å²	39	65.8 Å²	65.8	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-42.7	173.7	-164	173.8	127	0	0	111.2	Y229 V270 L271 Y277 R278	Y229-E274 HydrophobicContact CD2-CB 3.91Å; Y229-E274 HydrophobicContact CD2-CG 4.38Å; Y229-E274 HydrophobicContact CE2-CB 3.57Å; Y229-E274 HydrophobicContact CE2-CG 3.72Å; Y229-E274 PolarHBondContact OH-OE2 2.85Å; V270-E274 WeakPolarHBondContact O-CB 3.46Å; V270-E274 PolarHBondContact O-N 3.05Å; L271-E274 PolarHBondContact O-N 2.93Å; E274-Y277 PolarHBondContact O-N 2.85Å; E274-R278 WeakPolarHBondContact O-CB 3.36Å; E274-R278 WeakPolarHBondContact O-CG 3.49Å; E274-R278 PolarHBondContact O-N 2.75Å; E274-R278 IonicContact OE1-CZ 3.55Å; E274-R278 IonicContact OE1-NH1 2.71Å; E274-R278 PolarHBondContact OE1-NH1 3.15Å; E274-R278 IonicContact OE1-NH2 3.25Å; E274-R278 PolarHBondContact OE1-NH2 3.29Å
275	L	97.5	Very high	96.6	Very high	120 Å²	120	69.2 Å²	69.2	63%	0.628	35%	0.348	S	S	*	.	H	α-helix	trans	-64.1	-47.2	175.7	-175.8	64.1	0	0	0	111	L271 E272 Y277 R278 Q279	L271-L275 WeakPolarHBondContact O-CB 3.32Å; L271-L275 PolarHBondContact O-N 3.37Å; E272-L275 PolarHBondContact O-N 3Å; L275-Y277 PolarHBondContact O-N 3.17Å; L275-R278 PolarHBondContact O-N 3Å; L275-Q279 WeakPolarHBondContact O-CB 3.44Å; L275-Q279 PolarHBondContact O-N 3.44Å
276	L	97.2	Very high	96.9	Very high	73 Å²	73	71 Å²	71	38%	0.382	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175.9	-179.1	62.5	0	0	0	112	A225 E272 Q279 C280	A225-L276 HydrophobicContact CB-CG 4.28Å; E272-L276 PolarHBondContact O-N 3.19Å; L276-Q279 PolarHBondContact O-N 2.9Å; L276-C280 PolarHBondContact O-N 3.06Å; L276-C280 PolarHBondContact O-SG 3.48Å; L276-C280 VanDerWaalsContact O-SG 3.39Å
277	Y	98.2	Very high	97.1	Very high	58 Å²	58	71.6 Å²	71.6	23%	0.227	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-43.1	175.9	175.1	-125.1	0	0	0	112	L222 A225 K226 Y229 A273 E274 L275 Q279 C280 V281	L222-Y277 HydrophobicContact CD1-CD2 3.84Å; L222-Y277 HydrophobicContact CD1-CE2 3.52Å; A225-Y277 HydrophobicContact CB-CD2 4.45Å; K226-Y277 HydrophobicContact CB-CD2 3.82Å; K226-Y277 HydrophobicContact CB-CE2 3.49Å; K226-Y277 VanDerWaalsContact CB-CE2 3.49Å; K226-Y277 HydrophobicContact CD-CE2 4.13Å; K226-Y277 HydrophobicContact CG-CD2 4.41Å; K226-Y277 HydrophobicContact CG-CE2 3.74Å; Y229-Y277 HydrophobicContact CD1-CD1 4.43Å; A273-Y277 VanDerWaalsContact O-CB 3.25Å; A273-Y277 WeakPolarHBondContact O-CB 3.49Å; A273-Y277 PolarHBondContact O-N 2.89Å; E274-Y277 PolarHBondContact O-N 2.85Å; L275-Y277 PolarHBondContact O-N 3.17Å; Y277-Q279 VanDerWaalsContact C-N 3.33Å; Y277-Q279 PolarHBondContact O-N 2.9Å; Y277-C280 PolarHBondContact O-N 3.35Å; Y277-V281 HydrophobicContact CD2-CG2 4.28Å; Y277-V281 HydrophobicContact CE2-CG2 3.91Å; Y277-V281 WeakPolarHBondContact O-CG2 3.47Å; Y277-V281 PolarHBondContact O-N 3.48Å
278	R	97.9	Very high	97.2	Very high	148 Å²	148	71.3 Å²	71.3	56%	0.558	36%	0.358	S	S	*	.	H	α-helix	trans	-60.4	-41.4	172.8	-79.2	-174	177.9	118.6	12.8	112.1	E274 L275 V281 S282	E274-R278 WeakPolarHBondContact O-CB 3.36Å; E274-R278 WeakPolarHBondContact O-CG 3.49Å; E274-R278 PolarHBondContact O-N 2.75Å; E274-R278 IonicContact OE1-CZ 3.55Å; E274-R278 IonicContact OE1-NH1 2.71Å; E274-R278 PolarHBondContact OE1-NH1 3.15Å; E274-R278 IonicContact OE1-NH2 3.25Å; E274-R278 PolarHBondContact OE1-NH2 3.29Å; L275-R278 PolarHBondContact O-N 3Å; R278-V281 PolarHBondContact O-N 3.08Å; R278-S282 PolarHBondContact O-N 3.36Å; R278-S282 VanDerWaalsContact O-N 3.1Å; R278-S282 PolarHBondContact O-OG 2.93Å
279	Q	97.9	Very high	97.2	Very high	111 Å²	111	72.5 Å²	72.5	52%	0.519	36%	0.359	S	S	.	.	H	α-helix	trans	-60.7	-52.9	175.5	-174.8	177.3	-8.3	0	0	110.7	L275 L276 Y277 V281 S282 D283	L275-Q279 WeakPolarHBondContact O-CB 3.44Å; L275-Q279 PolarHBondContact O-N 3.44Å; L276-Q279 PolarHBondContact O-N 2.9Å; Y277-Q279 VanDerWaalsContact C-N 3.33Å; Y277-Q279 PolarHBondContact O-N 2.9Å; Q279-V281 PolarHBondContact O-N 2.7Å; Q279-V281 VanDerWaalsContact O-N 3.17Å; Q279-S282 CarbonylContact O-C 3.59Å; Q279-S282 WeakPolarHBondContact O-CA 3.46Å; Q279-S282 WeakPolarHBondContact O-CB 3.38Å; Q279-S282 PolarHBondContact O-N 3.47Å; Q279-D283 PolarHBondContact O-N 3.46Å
280	C	98.1	Very high	97.2	Very high	13 Å²	13	72.7 Å²	72.7	9%	0.088	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-24.3	178	-63.4	0	0	0	0	113.8	L222 A225 L276 Y277 A284	L222-C280 HydrophobicContact CB-CB 4.27Å; L222-C280 HydrophobicContact CD1-CB 4.18Å; A225-C280 HydrophobicContact CB-CB 4.19Å; L276-C280 PolarHBondContact O-N 3.06Å; L276-C280 PolarHBondContact O-SG 3.48Å; L276-C280 VanDerWaalsContact O-SG 3.39Å; Y277-C280 PolarHBondContact O-N 3.35Å; C280-A284 WeakPolarHBondContact O-CB 3.41Å; C280-A284 PolarHBondContact O-N 3.32Å
281	V	98.1	Very high	97.1	Very high	44 Å²	44	73.3 Å²	73.3	27%	0.267	36%	0.364	S	S	.	.	H	α-helix	trans	-68.9	-41.5	169.8	167.6	0	0	0	0	111.1	L222 Y277 R278 Q279 K285	L222-V281 HydrophobicContact CD1-CB 4.36Å; L222-V281 HydrophobicContact CD1-CG2 3.48Å; L222-V281 VanDerWaalsContact CD1-CG2 3.48Å; Y277-V281 HydrophobicContact CD2-CG2 4.28Å; Y277-V281 HydrophobicContact CE2-CG2 3.91Å; Y277-V281 WeakPolarHBondContact O-CG2 3.47Å; Y277-V281 PolarHBondContact O-N 3.48Å; R278-V281 PolarHBondContact O-N 3.08Å; Q279-V281 PolarHBondContact O-N 2.7Å; Q279-V281 VanDerWaalsContact O-N 3.17Å; V281-K285 WeakPolarHBondContact O-CG 3.42Å; V281-K285 PolarHBondContact O-N 2.99Å
282	S	97.7	Very high	97	Very high	64 Å²	64	70.5 Å²	70.5	45%	0.448	35%	0.352	S	S	.	.	H	α-helix	trans	-67.4	-46.3	174.7	-63.3	0	0	0	0	111.7	R278 Q279 A284 K285 L286	R278-S282 PolarHBondContact O-N 3.36Å; R278-S282 VanDerWaalsContact O-N 3.1Å; R278-S282 PolarHBondContact O-OG 2.93Å; Q279-S282 CarbonylContact O-C 3.59Å; Q279-S282 WeakPolarHBondContact O-CA 3.46Å; Q279-S282 WeakPolarHBondContact O-CB 3.38Å; Q279-S282 PolarHBondContact O-N 3.47Å; S282-A284 VanDerWaalsContact C-N 3.33Å; S282-A284 PolarHBondContact O-N 2.85Å; S282-K285 WeakPolarHBondContact O-CB 3.44Å; S282-K285 PolarHBondContact O-N 3.26Å; S282-K285 VanDerWaalsContact O-N 3.12Å; S282-L286 WeakPolarHBondContact O-CG 3.4Å; S282-L286 PolarHBondContact O-N 3.25Å
283	D	97.1	Very high	96.9	Very high	65 Å²	65	71.5 Å²	71.5	35%	0.348	35%	0.354	S	S	.	.	H	α-helix	trans	-58.2	-45.4	178.2	-56.9	-27	0	0	0	110.9	Q279 K285 L286 T287	Q279-D283 PolarHBondContact O-N 3.46Å; D283-K285 VanDerWaalsContact C-N 3.31Å; D283-K285 PolarHBondContact O-N 3.22Å; D283-L286 PolarHBondContact O-N 3.32Å; D283-T287 PolarHBondContact O-N 2.93Å; D283-T287 PolarHBondContact O-OG1 3.29Å
284	A	97.6	Very high	96.8	Very high	9 Å²	9	72.4 Å²	72.4	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-30	178.2	0	0	0	0	0	113.6	L222 C280 S282 T287 Q288	L222-A284 HydrophobicContact CD2-CB 3.87Å; C280-A284 WeakPolarHBondContact O-CB 3.41Å; C280-A284 PolarHBondContact O-N 3.32Å; S282-A284 VanDerWaalsContact C-N 3.33Å; S282-A284 PolarHBondContact O-N 2.85Å; A284-T287 WeakPolarHBondContact CA-OG1 3.32Å; A284-T287 PolarHBondContact O-OG1 3.37Å; A284-Q288 WeakPolarHBondContact O-CB 3.43Å; A284-Q288 PolarHBondContact O-N 2.92Å; A284-Q288 VanDerWaalsContact O-N 3.12Å
285	K	97.3	Very high	96.7	Very high	135 Å²	135	71.7 Å²	71.7	59%	0.587	36%	0.356	S	S	*	.	H	α-helix	trans	-70.1	-48.1	171.5	-74.3	173.9	177.3	-172.6	0	111.1	V281 S282 D283 T287 Q288 D289	V281-K285 WeakPolarHBondContact O-CG 3.42Å; V281-K285 PolarHBondContact O-N 2.99Å; S282-K285 WeakPolarHBondContact O-CB 3.44Å; S282-K285 PolarHBondContact O-N 3.26Å; S282-K285 VanDerWaalsContact O-N 3.12Å; D283-K285 VanDerWaalsContact C-N 3.31Å; D283-K285 PolarHBondContact O-N 3.22Å; K285-T287 VanDerWaalsContact C-N 3.3Å; K285-T287 PolarHBondContact O-N 2.9Å; K285-Q288 WeakPolarHBondContact O-CA 3.23Å; K285-Q288 WeakPolarHBondContact O-CB 3.02Å; K285-Q288 PolarHBondContact O-N 2.98Å; K285-D289 PolarHBondContact O-N 3.49Å
286	L	96.8	Very high	96.5	Very high	112 Å²	112	71.1 Å²	71.1	59%	0.586	35%	0.35	S	S	*	.	H	α-helix	trans	-58.9	-41.2	177.8	-67.1	171.3	0	0	0	111.7	S282 D283 D289 E290	S282-L286 WeakPolarHBondContact O-CG 3.4Å; S282-L286 PolarHBondContact O-N 3.25Å; D283-L286 PolarHBondContact O-N 3.32Å; L286-D289 PolarHBondContact O-N 3.17Å; L286-E290 PolarHBondContact O-N 2.93Å
287	T	96.6	Very high	96.4	Very high	28 Å²	28	75.3 Å²	75.3	17%	0.172	36%	0.361	C	S	.	.	H	α-helix	trans	-70.4	-28.4	174.6	54.4	0	0	0	0	113.7	M215 A218 D283 A284 K285 L291	M215-T287 PolarHBondContact SD-OG1 3.13Å; A218-T287 HydrophobicContact CB-CG2 4.06Å; A218-T287 WeakPolarHBondContact CB-OG1 3.32Å; D283-T287 PolarHBondContact O-N 2.93Å; D283-T287 PolarHBondContact O-OG1 3.29Å; A284-T287 WeakPolarHBondContact CA-OG1 3.32Å; A284-T287 PolarHBondContact O-OG1 3.37Å; K285-T287 VanDerWaalsContact C-N 3.3Å; K285-T287 PolarHBondContact O-N 2.9Å; T287-L291 VanDerWaalsContact O-CB 3.32Å; T287-L291 WeakPolarHBondContact O-CB 3.32Å; T287-L291 PolarHBondContact O-N 3.36Å
288	Q	96.4	Very high	96.4	Very high	81 Å²	81	72.5 Å²	72.5	38%	0.379	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-43.8	171.4	177.3	62.5	37	0	0	110.5	M215 A284 K285 L291 V292	M215-Q288 HydrophobicContact CE-CB 3.88Å; M215-Q288 VanDerWaalsContact CE-OE1 3.28Å; M215-Q288 HydrophobicContact SD-CB 4.16Å; A284-Q288 WeakPolarHBondContact O-CB 3.43Å; A284-Q288 PolarHBondContact O-N 2.92Å; A284-Q288 VanDerWaalsContact O-N 3.12Å; K285-Q288 WeakPolarHBondContact O-CA 3.23Å; K285-Q288 WeakPolarHBondContact O-CB 3.02Å; K285-Q288 PolarHBondContact O-N 2.98Å; Q288-L291 WeakPolarHBondContact O-CB 3.47Å; Q288-L291 PolarHBondContact O-N 3.47Å; Q288-V292 VanDerWaalsContact O-CG2 3.3Å; Q288-V292 WeakPolarHBondContact O-CG2 3.15Å; Q288-V292 PolarHBondContact O-N 3.48Å
289	D	95.9	Very high	96.3	Very high	87 Å²	87	65.6 Å²	65.6	47%	0.465	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-38.3	178.5	-62.7	-26.3	0	0	0	111.6	K285 L286 V292 K293	K285-D289 PolarHBondContact O-N 3.49Å; L286-D289 PolarHBondContact O-N 3.17Å; D289-V292 PolarHBondContact O-N 2.91Å; D289-K293 WeakPolarHBondContact O-CB 3.28Å; D289-K293 WeakPolarHBondContact O-CG 3.42Å; D289-K293 PolarHBondContact O-N 3.46Å
290	E	95.6	Very high	96.1	Very high	98 Å²	98	61.9 Å²	61.9	46%	0.458	31%	0.309	S	S	.	.	H	α-helix	trans	-58.8	-45.6	168.4	-78.9	-168.3	174.5	0	0	112.1	K214 L286 K293 S294	K214-E290 IonicContact NZ-OE1 3.05Å; K214-E290 PolarHBondContact NZ-OE1 3.39Å; K214-E290 IonicContact NZ-OE2 3.91Å; K214-E290 PolarHBondContact NZ-OE2 2.82Å; L286-E290 PolarHBondContact O-N 2.93Å; E290-K293 PolarHBondContact O-N 3.07Å; E290-S294 WeakPolarHBondContact O-CB 3.3Å; E290-S294 PolarHBondContact O-N 2.91Å
291	L	95.1	Very high	96	Very high	27 Å²	27	65.4 Å²	65.4	14%	0.141	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-41.8	-179.4	-175.2	69.3	0	0	0	111.4	W208 A211 Q212 M215 T287 Q288 S294 K295	W208-L291 HydrophobicContact CE3-CD1 4.04Å; W208-L291 HydrophobicContact CH2-CD1 3.71Å; W208-L291 HydrophobicContact CH2-CG 4.02Å; W208-L291 HydrophobicContact CZ3-CD1 3.36Å; W208-L291 HydrophobicContact CZ3-CG 3.95Å; A211-L291 HydrophobicContact CB-CD1 3.62Å; Q212-L291 HydrophobicContact CG-CD1 4.45Å; M215-L291 HydrophobicContact CB-CD2 4.05Å; M215-L291 HydrophobicContact CG-CD2 3.98Å; T287-L291 VanDerWaalsContact O-CB 3.32Å; T287-L291 WeakPolarHBondContact O-CB 3.32Å; T287-L291 PolarHBondContact O-N 3.36Å; Q288-L291 WeakPolarHBondContact O-CB 3.47Å; Q288-L291 PolarHBondContact O-N 3.47Å; L291-S294 PolarHBondContact O-N 2.97Å; L291-K295 WeakPolarHBondContact O-CB 3.43Å; L291-K295 PolarHBondContact O-N 2.63Å
292	V	94.6	Very high	96	Very high	44 Å²	44	63.7 Å²	63.7	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-48.8	176.4	169.4	0	0	0	0	111.1	F97 Q288 D289 S294 K295 E296	F97-V292 HydrophobicContact CE2-CG1 3.74Å; F97-V292 HydrophobicContact CZ-CG1 3.63Å; Q288-V292 VanDerWaalsContact O-CG2 3.3Å; Q288-V292 WeakPolarHBondContact O-CG2 3.15Å; Q288-V292 PolarHBondContact O-N 3.48Å; D289-V292 PolarHBondContact O-N 2.91Å; V292-S294 VanDerWaalsContact C-N 3.27Å; V292-S294 PolarHBondContact O-N 3.13Å; V292-K295 WeakPolarHBondContact O-CB 3.46Å; V292-K295 PolarHBondContact O-N 3.05Å; V292-K295 VanDerWaalsContact O-N 3.14Å; V292-E296 PolarHBondContact O-N 2.88Å; V292-E296 VanDerWaalsContact O-N 3.1Å
293	K	94.3	Very high	95.9	Very high	139 Å²	139	63.5 Å²	63.5	60%	0.604	30%	0.303	S	S	*	.	H	α-helix	trans	-62.3	-33.8	175.4	-70.9	175.1	179.7	-174.9	0	112.2	D289 E290 R297	D289-K293 WeakPolarHBondContact O-CB 3.28Å; D289-K293 WeakPolarHBondContact O-CG 3.42Å; D289-K293 PolarHBondContact O-N 3.46Å; E290-K293 PolarHBondContact O-N 3.07Å; K293-R297 WeakPolarHBondContact O-CB 3.48Å; K293-R297 PolarHBondContact O-N 3.26Å
294	S	95.2	Very high	95.8	Very high	25 Å²	25	65.9 Å²	65.9	18%	0.175	31%	0.31	C	S	.	.	H	α-helix	trans	-69.7	-38.2	174	-170.2	0	0	0	0	112.5	E290 L291 V292 I298	E290-S294 WeakPolarHBondContact O-CB 3.3Å; E290-S294 PolarHBondContact O-N 2.91Å; L291-S294 PolarHBondContact O-N 2.97Å; V292-S294 VanDerWaalsContact C-N 3.27Å; V292-S294 PolarHBondContact O-N 3.13Å; S294-I298 WeakPolarHBondContact O-CB 3.32Å; S294-I298 WeakPolarHBondContact O-CD1 3.49Å; S294-I298 VanDerWaalsContact O-CG1 3.23Å; S294-I298 WeakPolarHBondContact O-CG1 3.25Å; S294-I298 PolarHBondContact O-N 3.36Å; S294-I298 VanDerWaalsContact O-N 3.09Å
295	K	95.5	Very high	95.8	Very high	25 Å²	25	66.2 Å²	66.2	11%	0.109	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-53.3	178.2	173.9	169.5	-163.1	-172.7	0	111.3	F97 C99 V103 W208 L291 V292 R297 I298 I299	F97-K295 HydrophobicContact CD2-CG 4.42Å; F97-K295 WeakPolarHBondContact O-CE 3.44Å; F97-K295 PolarHBondContact O-NZ 2.97Å; C99-K295 PolarHBondContact O-NZ 3.14Å; V103-K295 HydrophobicContact CG2-CB 4.13Å; V103-K295 HydrophobicContact CG2-CD 4.36Å; V103-K295 HydrophobicContact CG2-CG 3.65Å; W208-K295 HydrophobicContact CH2-CB 4.01Å; W208-K295 HydrophobicContact CH2-CD 4.38Å; W208-K295 HydrophobicContact CH2-CG 4.45Å; W208-K295 HydrophobicContact CZ3-CB 3.83Å; L291-K295 WeakPolarHBondContact O-CB 3.43Å; L291-K295 PolarHBondContact O-N 2.63Å; V292-K295 WeakPolarHBondContact O-CB 3.46Å; V292-K295 PolarHBondContact O-N 3.05Å; V292-K295 VanDerWaalsContact O-N 3.14Å; K295-R297 PolarHBondContact O-N 3.35Å; K295-I298 PolarHBondContact O-N 3.27Å; K295-I299 HydrophobicContact CG-CD1 3.73Å; K295-I299 WeakPolarHBondContact O-CG1 3.42Å; K295-I299 PolarHBondContact O-N 2.72Å
296	E	93.7	Very high	95.9	Very high	108 Å²	108	60.4 Å²	60.4	51%	0.505	29%	0.286	S	S	.	.	H	α-helix	trans	-53.9	-54	177	-177.6	-172.6	179	0	0	111.3	F97 V292 I298 I299 T300	F97-E296 HydrophobicContact CD2-CB 4.34Å; F97-E296 HydrophobicContact CE2-CB 4.32Å; V292-E296 PolarHBondContact O-N 2.88Å; V292-E296 VanDerWaalsContact O-N 3.1Å; E296-I298 VanDerWaalsContact C-N 3.34Å; E296-I298 PolarHBondContact O-N 2.93Å; E296-I299 PolarHBondContact O-N 3.3Å; E296-T300 PolarHBondContact O-N 3.03Å; E296-T300 PolarHBondContact O-OG1 3.47Å
297	R	95.1	Very high	95.8	Very high	160 Å²	160	57.9 Å²	57.9	60%	0.604	28%	0.277	S	S	*	.	H	α-helix	trans	-55	-46.7	179.1	-175	-177.9	-62.8	-175.9	-1.4	112.3	K293 K295 H301	K293-R297 WeakPolarHBondContact O-CB 3.48Å; K293-R297 PolarHBondContact O-N 3.26Å; K295-R297 PolarHBondContact O-N 3.35Å; R297-H301 WeakPolarHBondContact O-CB 3.32Å; R297-H301 PolarHBondContact O-CD2 3.14Å; R297-H301 VanDerWaalsContact O-CD2 3.25Å; R297-H301 PolarHBondContact O-N 3.04Å
298	I	96.9	Very high	95.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.6	-45.1	-177.1	-69.9	169.3	0	0	0	111.1	V103 F204 Q207 W208 S294 K295 E296 H301 I302	V103-I298 HydrophobicContact CG1-CB 4.37Å; V103-I298 HydrophobicContact CG1-CG2 3.65Å; F204-I298 HydrophobicContact CB-CG1 4.35Å; F204-I298 HydrophobicContact CB-CG2 3.87Å; F204-I298 HydrophobicContact CD1-CG1 3.96Å; F204-I298 HydrophobicContact CG-CG1 4.36Å; F204-I298 HydrophobicContact CG-CG2 4.19Å; Q207-I298 HydrophobicContact CB-CD1 4.26Å; W208-I298 HydrophobicContact CB-CD1 3.96Å; W208-I298 HydrophobicContact CE3-CD1 4.45Å; S294-I298 WeakPolarHBondContact O-CB 3.32Å; S294-I298 WeakPolarHBondContact O-CD1 3.49Å; S294-I298 VanDerWaalsContact O-CG1 3.23Å; S294-I298 WeakPolarHBondContact O-CG1 3.25Å; S294-I298 PolarHBondContact O-N 3.36Å; S294-I298 VanDerWaalsContact O-N 3.09Å; K295-I298 PolarHBondContact O-N 3.27Å; E296-I298 VanDerWaalsContact C-N 3.34Å; E296-I298 PolarHBondContact O-N 2.93Å; I298-H301 PolarHBondContact O-N 2.99Å; I298-I302 HydrophobicContact CG2-CD1 3.58Å; I298-I302 HydrophobicContact CG2-CG1 4.33Å; I298-I302 WeakPolarHBondContact O-CB 3.4Å; I298-I302 VanDerWaalsContact O-CG1 3.26Å; I298-I302 WeakPolarHBondContact O-CG1 3.33Å; I298-I302 PolarHBondContact O-N 2.87Å
299	I	96	Very high	96	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.015	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-52.9	178.7	-68.8	165.9	0	0	0	110.1	D93 L96 V103 K295 E296 H301 I302 R303	D93-I299 HydrophobicContact CB-CG2 4.29Å; L96-I299 HydrophobicContact CB-CD1 4.01Å; L96-I299 HydrophobicContact CB-CG2 4.02Å; L96-I299 HydrophobicContact CD1-CG2 3.94Å; V103-I299 HydrophobicContact CG2-CD1 4.29Å; V103-I299 HydrophobicContact CG2-CG1 4.29Å; K295-I299 HydrophobicContact CG-CD1 3.73Å; K295-I299 WeakPolarHBondContact O-CG1 3.42Å; K295-I299 PolarHBondContact O-N 2.72Å; E296-I299 PolarHBondContact O-N 3.3Å; I299-H301 VanDerWaalsContact C-N 3.35Å; I299-H301 PolarHBondContact O-N 3.42Å; I299-I302 PolarHBondContact O-N 2.77Å; I299-R303 PolarHBondContact O-N 2.87Å
300	T	94.4	Very high	96.1	Very high	32 Å²	32	56.1 Å²	56.1	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-38.2	-179.3	-59.8	0	0	0	0	112.7	D93 E296 K304	D93-T300 PolarHBondContact OD2-OG1 3.1Å; E296-T300 PolarHBondContact O-N 3.03Å; E296-T300 PolarHBondContact O-OG1 3.47Å; T300-K304 HydrophobicContact CG2-CD 4.34Å; T300-K304 WeakPolarHBondContact O-CG 3.45Å; T300-K304 PolarHBondContact O-N 3.07Å; T300-K304 VanDerWaalsContact O-N 3.07Å
301	H	96.6	Very high	96.2	Very high	88 Å²	88	57 Å²	57	41%	0.407	27%	0.273	S	S	.	.	H	α-helix	trans	-70	-38.7	175.4	-90	-94.6	0	0	0	113	F204 R297 I298 I299 K304 L305	F204-H301 HydrophobicContact CE1-CB 4.3Å; F204-H301 HydrophobicContact CE2-CB 3.82Å; F204-H301 HydrophobicContact CZ-CB 3.51Å; F204-H301 AromaticContact CZ-CG 3.97Å; R297-H301 WeakPolarHBondContact O-CB 3.32Å; R297-H301 PolarHBondContact O-CD2 3.14Å; R297-H301 VanDerWaalsContact O-CD2 3.25Å; R297-H301 PolarHBondContact O-N 3.04Å; I298-H301 PolarHBondContact O-N 2.99Å; I299-H301 VanDerWaalsContact C-N 3.35Å; I299-H301 PolarHBondContact O-N 3.42Å; H301-K304 PolarHBondContact O-N 3.24Å; H301-L305 WeakPolarHBondContact O-CB 3.44Å; H301-L305 WeakPolarHBondContact O-CG 3.37Å; H301-L305 PolarHBondContact O-N 3.04Å
302	I	97.4	Very high	96.3	Very high	8 Å²	8	57.4 Å²	57.4	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-47.1	174.9	-70.4	166.9	0	0	0	109.8	A106 L107 A110 F204 I298 I299 K304 L305 I306	A106-I302 HydrophobicContact CB-CB 4.37Å; A106-I302 HydrophobicContact CB-CD1 3.87Å; A106-I302 HydrophobicContact CB-CG2 4.07Å; L107-I302 HydrophobicContact CD2-CD1 3.61Å; L107-I302 HydrophobicContact CG-CD1 3.81Å; A110-I302 HydrophobicContact CB-CG2 4.16Å; F204-I302 HydrophobicContact CD2-CG1 3.95Å; F204-I302 HydrophobicContact CE2-CG1 4.45Å; I298-I302 HydrophobicContact CG2-CD1 3.58Å; I298-I302 HydrophobicContact CG2-CG1 4.33Å; I298-I302 WeakPolarHBondContact O-CB 3.4Å; I298-I302 VanDerWaalsContact O-CG1 3.26Å; I298-I302 WeakPolarHBondContact O-CG1 3.33Å; I298-I302 PolarHBondContact O-N 2.87Å; I299-I302 PolarHBondContact O-N 2.77Å; I302-K304 PolarHBondContact O-N 2.6Å; I302-L305 PolarHBondContact O-N 3.42Å; I302-I306 HydrophobicContact CG2-CG1 4.29Å; I302-I306 WeakPolarHBondContact O-CG1 3.47Å; I302-I306 PolarHBondContact O-N 3.5Å
303	R	95.6	Very high	96.5	Very high	59 Å²	59	56.4 Å²	56.4	22%	0.223	27%	0.269	C	S	.	.	H	α-helix	trans	-56.5	-48.7	176.2	-178	175.8	56.9	85.6	-9.1	111.9	A89 D93 I299 L305 I306 C307	A89-R303 PolarHBondContact O-NE 2.98Å; D93-R303 VanDerWaalsContact OD1-CD 3.31Å; D93-R303 WeakPolarHBondContact OD1-CD 3.13Å; D93-R303 IonicContact OD1-CZ 2.74Å; D93-R303 IonicContact OD1-NE 3.46Å; D93-R303 PolarHBondContact OD1-NE 2.69Å; D93-R303 IonicContact OD1-NH2 2.61Å; D93-R303 IonicContact OD2-CZ 3.19Å; D93-R303 VanDerWaalsContact OD2-CZ 3.29Å; D93-R303 IonicContact OD2-NE 2.87Å; D93-R303 PolarHBondContact OD2-NE 3.37Å; D93-R303 IonicContact OD2-NH2 3.63Å; D93-R303 PolarHBondContact OD2-NH2 2.72Å; I299-R303 PolarHBondContact O-N 2.87Å; R303-L305 VanDerWaalsContact C-N 3.32Å; R303-L305 PolarHBondContact O-N 2.91Å; R303-I306 PolarHBondContact O-N 3.16Å; R303-I306 VanDerWaalsContact O-N 3.17Å; R303-C307 PolarHBondContact O-N 3Å; R303-C307 PolarHBondContact O-SG 3.16Å
304	K	96	Very high	96.7	Very high	115 Å²	115	57 Å²	57	50%	0.5	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-41.5	177.2	-74.3	175.7	179.3	-178	0	112.6	T300 H301 I302 Q308	T300-K304 HydrophobicContact CG2-CD 4.34Å; T300-K304 WeakPolarHBondContact O-CG 3.45Å; T300-K304 PolarHBondContact O-N 3.07Å; T300-K304 VanDerWaalsContact O-N 3.07Å; H301-K304 PolarHBondContact O-N 3.24Å; I302-K304 PolarHBondContact O-N 2.6Å; K304-Q308 VanDerWaalsContact O-CG 3.3Å; K304-Q308 WeakPolarHBondContact O-CG 3.46Å; K304-Q308 PolarHBondContact O-N 3.33Å; K304-Q308 VanDerWaalsContact O-N 3.12Å
305	L	97.6	Very high	96.8	Very high	16 Å²	16	60.9 Å²	60.9	8%	0.084	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-37.6	176.2	-76.6	169.4	0	0	0	113.1	E196 I197 W200 F204 H301 I302 R303 G309	E196-L305 VanDerWaalsContact OE1-CD2 3.27Å; E196-L305 WeakPolarHBondContact OE1-CD2 3.42Å; I197-L305 WeakPolarHBondContact CD1-O 3.44Å; I197-L305 HydrophobicContact CG1-CB 4.38Å; W200-L305 HydrophobicContact CB-CD1 3.44Å; W200-L305 VanDerWaalsContact CB-CD1 3.44Å; W200-L305 HydrophobicContact CG-CD1 3.73Å; W200-L305 HydrophobicContact CG-CD2 4.49Å; F204-L305 HydrophobicContact CE2-CD1 3.86Å; H301-L305 WeakPolarHBondContact O-CB 3.44Å; H301-L305 WeakPolarHBondContact O-CG 3.37Å; H301-L305 PolarHBondContact O-N 3.04Å; I302-L305 PolarHBondContact O-N 3.42Å; R303-L305 VanDerWaalsContact C-N 3.32Å; R303-L305 PolarHBondContact O-N 2.91Å; L305-G309 PolarHBondContact O-N 3.33Å
306	I	97.9	Very high	96.9	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.072	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-50.9	175.1	-68.8	-61.7	0	0	0	110.7	Y109 A110 W113 I302 R303 Q308 G309 D310	Y109-I306 HydrophobicContact CD1-CD1 3.94Å; Y109-I306 HydrophobicContact CD1-CG1 4.09Å; Y109-I306 HydrophobicContact CD1-CG2 4.43Å; Y109-I306 HydrophobicContact CE1-CD1 4.02Å; Y109-I306 HydrophobicContact CE1-CG1 4.22Å; Y109-I306 HydrophobicContact CE1-CG2 3.78Å; A110-I306 HydrophobicContact CB-CD1 4.21Å; W113-I306 HydrophobicContact CB-CD1 3.87Å; W113-I306 HydrophobicContact CD2-CD1 4.45Å; W113-I306 HydrophobicContact CG-CD1 3.82Å; I302-I306 HydrophobicContact CG2-CG1 4.29Å; I302-I306 WeakPolarHBondContact O-CG1 3.47Å; I302-I306 PolarHBondContact O-N 3.5Å; R303-I306 PolarHBondContact O-N 3.16Å; R303-I306 VanDerWaalsContact O-N 3.17Å; I306-Q308 VanDerWaalsContact C-N 3.26Å; I306-Q308 PolarHBondContact O-N 3.36Å; I306-G309 CarbonylContact O-C 3.45Å; I306-G309 WeakPolarHBondContact O-CA 3.49Å; I306-G309 PolarHBondContact O-N 2.95Å; I306-D310 VanDerWaalsContact CG2-OD2 3.27Å; I306-D310 WeakPolarHBondContact CG2-OD2 3.42Å; I306-D310 PolarHBondContact O-N 3.4Å
307	C	96.4	Very high	97.1	Very high	59 Å²	59	56.9 Å²	56.9	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-37.9	177.9	-59.9	0	0	0	0	112.5	R303 N311	R303-C307 PolarHBondContact O-N 3Å; R303-C307 PolarHBondContact O-SG 3.16Å; C307-N311 WeakPolarHBondContact O-CB 3.26Å; C307-N311 VanDerWaalsContact O-CG 3.26Å; C307-N311 PolarHBondContact O-N 3.34Å
308	Q	97.8	Very high	97.3	Very high	99 Å²	99	53.5 Å²	53.5	46%	0.463	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-37.1	172.1	-71.8	174.7	-1.5	0	0	112.9	K304 I306 L312	K304-Q308 VanDerWaalsContact O-CG 3.3Å; K304-Q308 WeakPolarHBondContact O-CG 3.46Å; K304-Q308 PolarHBondContact O-N 3.33Å; K304-Q308 VanDerWaalsContact O-N 3.12Å; I306-Q308 VanDerWaalsContact C-N 3.26Å; I306-Q308 PolarHBondContact O-N 3.36Å; Q308-L312 PolarHBondContact O-N 2.94Å
309	G	98.2	Very high	97.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-46.2	174.3	0	0	0	0	0	112.2	W113 L305 I306 L312 L313	W113-G309 VanDerWaalsContact CZ2-C 3.44Å; W113-G309 WeakPolarHBondContact CZ2-O 3.35Å; L305-G309 PolarHBondContact O-N 3.33Å; I306-G309 CarbonylContact O-C 3.45Å; I306-G309 WeakPolarHBondContact O-CA 3.49Å; I306-G309 PolarHBondContact O-N 2.95Å; G309-L312 PolarHBondContact O-N 3.44Å; G309-L313 VanDerWaalsContact O-CB 3.28Å; G309-L313 WeakPolarHBondContact O-CB 3.46Å; G309-L313 PolarHBondContact O-N 3.28Å
310	D	98	Very high	97.3	Very high	60 Å²	60	55.8 Å²	55.8	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-40.5	-179.7	-66.9	-34.3	0	0	0	112.2	W113 I306 L313 K314	W113-D310 PolarHBondContact NE1-OD1 2.9Å; I306-D310 VanDerWaalsContact CG2-OD2 3.27Å; I306-D310 WeakPolarHBondContact CG2-OD2 3.42Å; I306-D310 PolarHBondContact O-N 3.4Å; D310-L313 PolarHBondContact O-N 3.38Å; D310-K314 WeakPolarHBondContact O-CB 3.38Å; D310-K314 PolarHBondContact O-N 3.04Å
311	N	97.9	Very high	97.4	Very high	115 Å²	115	60 Å²	60	62%	0.615	30%	0.297	S	S	*	.	H	α-helix	trans	-61.4	-46	173.8	-77.1	-9.1	0	0	0	111.8	C307 K314 E315	C307-N311 WeakPolarHBondContact O-CB 3.26Å; C307-N311 VanDerWaalsContact O-CG 3.26Å; C307-N311 PolarHBondContact O-N 3.34Å; N311-K314 WeakPolarHBondContact O-CB 3.47Å; N311-K314 PolarHBondContact O-N 3Å; N311-E315 PolarHBondContact O-N 2.99Å
312	L	98.3	Very high	97.4	Very high	37 Å²	37	60.7 Å²	60.7	19%	0.194	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-38.1	175.8	-175.2	67.6	0	0	0	111.7	A189 K193 Q308 G309 K314 E315 V316	A189-L312 HydrophobicContact CB-CD1 4.45Å; A189-L312 HydrophobicContact CB-CD2 4.44Å; A189-L312 WeakPolarHBondContact O-CD2 3.48Å; K193-L312 HydrophobicContact CB-CD2 3.46Å; K193-L312 VanDerWaalsContact CB-CD2 3.46Å; K193-L312 HydrophobicContact CG-CD2 3.87Å; Q308-L312 PolarHBondContact O-N 2.94Å; G309-L312 PolarHBondContact O-N 3.44Å; L312-K314 VanDerWaalsContact C-N 3.35Å; L312-K314 PolarHBondContact O-N 2.87Å; L312-E315 PolarHBondContact O-N 3.13Å; L312-V316 HydrophobicContact CD1-CG1 4.2Å; L312-V316 HydrophobicContact CG-CG1 4.27Å; L312-V316 WeakPolarHBondContact O-CG1 3.24Å; L312-V316 WeakPolarHBondContact O-CG2 3.3Å; L312-V316 PolarHBondContact O-N 3.03Å
313	L	98.3	Very high	97.4	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-44.2	176.2	-179.9	59.3	0	0	0	111	Y116 L120 L190 G309 D310 V316 T317	Y116-L313 HydrophobicContact CE1-CD2 3.99Å; L120-L313 HydrophobicContact CD1-CD1 3.91Å; L120-L313 HydrophobicContact CD1-CD2 4.47Å; L190-L313 HydrophobicContact CD1-CB 4.46Å; L190-L313 HydrophobicContact CD1-CD1 3.99Å; L190-L313 HydrophobicContact CD2-CD1 3.81Å; G309-L313 VanDerWaalsContact O-CB 3.28Å; G309-L313 WeakPolarHBondContact O-CB 3.46Å; G309-L313 PolarHBondContact O-N 3.28Å; D310-L313 PolarHBondContact O-N 3.38Å; L313-V316 HydrophobicContact CD1-CG2 4.43Å; L313-V316 WeakPolarHBondContact O-CG2 3.42Å; L313-T317 VanDerWaalsContact O-CB 3.31Å; L313-T317 WeakPolarHBondContact O-CB 3.38Å; L313-T317 PolarHBondContact O-N 3.03Å; L313-T317 VanDerWaalsContact O-N 3.09Å; L313-T317 PolarHBondContact O-OG1 3.5Å
314	K	98.1	Very high	97.3	Very high	153 Å²	153	60.1 Å²	60.1	67%	0.665	30%	0.295	S	S	*	.	H	α-helix	trans	-57.4	-49.4	171.3	-179	-178.1	177.8	-177.8	0	111	D310 N311 L312 T317 V318	D310-K314 WeakPolarHBondContact O-CB 3.38Å; D310-K314 PolarHBondContact O-N 3.04Å; N311-K314 WeakPolarHBondContact O-CB 3.47Å; N311-K314 PolarHBondContact O-N 3Å; L312-K314 VanDerWaalsContact C-N 3.35Å; L312-K314 PolarHBondContact O-N 2.87Å; K314-T317 PolarHBondContact O-N 3.11Å; K314-V318 WeakPolarHBondContact O-CG2 3.37Å; K314-V318 PolarHBondContact O-N 3.31Å
315	E	97.6	Very high	97.3	Very high	106 Å²	106	62.3 Å²	62.3	50%	0.495	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-51.4	-178.6	-161.6	-149.5	129.4	0	0	112.5	N311 L312 T317 V318 N319	N311-E315 PolarHBondContact O-N 2.99Å; L312-E315 PolarHBondContact O-N 3.13Å; E315-T317 VanDerWaalsContact C-N 3.27Å; E315-T317 PolarHBondContact O-N 3.48Å; E315-V318 PolarHBondContact O-N 2.89Å; E315-N319 VanDerWaalsContact O-CB 3.29Å; E315-N319 WeakPolarHBondContact O-CB 3.14Å; E315-N319 PolarHBondContact O-N 2.89Å; E315-N319 PolarHBondContact O-ND2 3.13Å; E315-N319 PolarHBondContact OE1-ND2 3Å; E315-N319 VanDerWaalsContact OE1-ND2 3.14Å
316	V	98.1	Very high	97	Very high	1 Å²	1	66.3 Å²	66.3	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-65.9	-29.8	179.6	-58.7	0	0	0	0	112.4	C186 A189 L190 L312 L313 M320	C186-V316 HydrophobicContact CB-CB 4.11Å; A189-V316 HydrophobicContact CB-CG1 4.22Å; L190-V316 HydrophobicContact CB-CG2 4.2Å; L190-V316 HydrophobicContact CD2-CG2 4.22Å; L312-V316 HydrophobicContact CD1-CG1 4.2Å; L312-V316 HydrophobicContact CG-CG1 4.27Å; L312-V316 WeakPolarHBondContact O-CG1 3.24Å; L312-V316 WeakPolarHBondContact O-CG2 3.3Å; L312-V316 PolarHBondContact O-N 3.03Å; L313-V316 HydrophobicContact CD1-CG2 4.43Å; L313-V316 WeakPolarHBondContact O-CG2 3.42Å; V316-M320 WeakPolarHBondContact O-CB 3.19Å; V316-M320 PolarHBondContact O-N 3.02Å
317	T	97.8	Very high	96.8	Very high	48 Å²	48	66.8 Å²	66.8	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-71.8	-44.7	175.6	-66.4	0	0	0	0	111.6	L313 K314 E315 M320 F321	L313-T317 VanDerWaalsContact O-CB 3.31Å; L313-T317 WeakPolarHBondContact O-CB 3.38Å; L313-T317 PolarHBondContact O-N 3.03Å; L313-T317 VanDerWaalsContact O-N 3.09Å; L313-T317 PolarHBondContact O-OG1 3.5Å; K314-T317 PolarHBondContact O-N 3.11Å; E315-T317 VanDerWaalsContact C-N 3.27Å; E315-T317 PolarHBondContact O-N 3.48Å; T317-M320 PolarHBondContact O-N 3.13Å; T317-F321 HydrophobicContact CG2-CD2 3.97Å; T317-F321 HydrophobicContact CG2-CE2 3.4Å; T317-F321 VanDerWaalsContact CG2-CE2 3.4Å; T317-F321 HydrophobicContact CG2-CZ 4.06Å; T317-F321 VanDerWaalsContact O-CD2 3.25Å; T317-F321 WeakPolarHBondContact O-CD2 3.31Å; T317-F321 PolarHBondContact O-N 3.38Å; T317-F321 VanDerWaalsContact O-N 3.1Å
318	V	97.6	Very high	96.5	Very high	89 Å²	89	68.1 Å²	68.1	54%	0.539	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-47.8	174.1	171.5	0	0	0	0	110.6	K314 E315 M320 F321 Y322	K314-V318 WeakPolarHBondContact O-CG2 3.37Å; K314-V318 PolarHBondContact O-N 3.31Å; E315-V318 PolarHBondContact O-N 2.89Å; V318-M320 VanDerWaalsContact C-N 3.33Å; V318-M320 PolarHBondContact O-N 3.44Å; V318-F321 PolarHBondContact O-N 3.07Å; V318-Y322 WeakPolarHBondContact O-CB 3.08Å; V318-Y322 PolarHBondContact O-N 2.62Å
319	N	97.3	Very high	96.3	Very high	38 Å²	38	69.8 Å²	69.8	20%	0.203	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-44.4	174.9	-82.4	-37.9	0	0	0	111.8	E315 F321 Y322 Y323	E315-N319 VanDerWaalsContact O-CB 3.29Å; E315-N319 WeakPolarHBondContact O-CB 3.14Å; E315-N319 PolarHBondContact O-N 2.89Å; E315-N319 PolarHBondContact O-ND2 3.13Å; E315-N319 PolarHBondContact OE1-ND2 3Å; E315-N319 VanDerWaalsContact OE1-ND2 3.14Å; N319-F321 PolarHBondContact O-N 3.35Å; N319-Y322 PolarHBondContact O-N 3.4Å; N319-Y323 HydrophobicContact CB-CE2 4.01Å; N319-Y323 WeakPolarHBondContact O-CD2 3.47Å; N319-Y323 PolarHBondContact O-N 3.13Å
320	M	96.9	Very high	95.8	Very high	12 Å²	12	72.5 Å²	72.5	6%	0.059	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-47.9	178.1	176.1	-179.3	72.5	0	0	112.1	W123 M124 L182 V316 T317 V318 Q324	W123-M320 HydrophobicContact CH2-CE 3.94Å; W123-M320 HydrophobicContact CH2-SD 4.05Å; W123-M320 HydrophobicContact CZ3-CE 3.99Å; W123-M320 HydrophobicContact CZ3-SD 3.91Å; M124-M320 HydrophobicContact CE-SD 4.28Å; L182-M320 HydrophobicContact CD2-CB 4.07Å; L182-M320 HydrophobicContact CD2-CG 3.92Å; V316-M320 WeakPolarHBondContact O-CB 3.19Å; V316-M320 PolarHBondContact O-N 3.02Å; T317-M320 PolarHBondContact O-N 3.13Å; V318-M320 VanDerWaalsContact C-N 3.33Å; V318-M320 PolarHBondContact O-N 3.44Å; M320-Q324 WeakPolarHBondContact O-CB 3.46Å; M320-Q324 VanDerWaalsContact O-CG 3.23Å; M320-Q324 WeakPolarHBondContact O-CG 3.45Å; M320-Q324 PolarHBondContact O-N 3.35Å
321	F	96.5	Very high	95.5	Very high	122 Å²	122	71.5 Å²	71.5	54%	0.535	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-37.3	178.5	-64	-43.9	0	0	0	112.4	T317 V318 N319 Q324 R325	T317-F321 HydrophobicContact CG2-CD2 3.97Å; T317-F321 HydrophobicContact CG2-CE2 3.4Å; T317-F321 VanDerWaalsContact CG2-CE2 3.4Å; T317-F321 HydrophobicContact CG2-CZ 4.06Å; T317-F321 VanDerWaalsContact O-CD2 3.25Å; T317-F321 WeakPolarHBondContact O-CD2 3.31Å; T317-F321 PolarHBondContact O-N 3.38Å; T317-F321 VanDerWaalsContact O-N 3.1Å; V318-F321 PolarHBondContact O-N 3.07Å; N319-F321 PolarHBondContact O-N 3.35Å; F321-Q324 PolarHBondContact O-N 3.43Å; F321-R325 WeakPolarHBondContact O-CB 3.37Å; F321-R325 PolarHBondContact O-N 3.4Å
322	Y	96.8	Very high	95.3	Very high	101 Å²	101	70.1 Å²	70.1	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-53.2	175	172.7	-91.7	0	0	0	112.1	V318 N319 Q324 R325 Q326	V318-Y322 WeakPolarHBondContact O-CB 3.08Å; V318-Y322 PolarHBondContact O-N 2.62Å; N319-Y322 PolarHBondContact O-N 3.4Å; Y322-Q324 VanDerWaalsContact C-N 3.33Å; Y322-Q324 PolarHBondContact O-N 2.98Å; Y322-R325 PolarHBondContact O-N 3.3Å; Y322-Q326 PolarHBondContact O-N 3.34Å
323	Y	96.3	Very high	95	Very high	22 Å²	22	73.2 Å²	73.2	9%	0.086	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-33.5	-179.2	-59.9	-61.5	0	0	0	112.3	I181 L182 R185 N319 Q327	I181-Y323 HydrophobicContact CG2-CD1 4.02Å; I181-Y323 HydrophobicContact CG2-CD2 3.82Å; I181-Y323 HydrophobicContact CG2-CE1 3.85Å; I181-Y323 HydrophobicContact CG2-CE2 3.67Å; I181-Y323 HydrophobicContact CG2-CG 4.03Å; L182-Y323 HydrophobicContact CD2-CD2 4.14Å; R185-Y323 WeakPolarHBondContact CD-OH 3.37Å; R185-Y323 PolarHBondContact NH1-OH 3.34Å; N319-Y323 HydrophobicContact CB-CE2 4.01Å; N319-Y323 WeakPolarHBondContact O-CD2 3.47Å; N319-Y323 PolarHBondContact O-N 3.13Å; Y323-Q327 WeakPolarHBondContact O-CB 3.42Å; Y323-Q327 PolarHBondContact O-N 2.94Å
324	Q	94.1	Very high	94.7	Very high	34 Å²	34	72.7 Å²	72.7	16%	0.159	36%	0.363	C	S	.	.	H	α-helix	trans	-68.6	-38.5	175.7	-72.8	171.7	14.5	0	0	112.5	L182 M320 F321 Y322 T328	L182-Q324 HydrophobicContact CD1-CG 4.21Å; M320-Q324 WeakPolarHBondContact O-CB 3.46Å; M320-Q324 VanDerWaalsContact O-CG 3.23Å; M320-Q324 WeakPolarHBondContact O-CG 3.45Å; M320-Q324 PolarHBondContact O-N 3.35Å; F321-Q324 PolarHBondContact O-N 3.43Å; Y322-Q324 VanDerWaalsContact C-N 3.33Å; Y322-Q324 PolarHBondContact O-N 2.98Å; Q324-T328 WeakPolarHBondContact O-CB 3.19Å; Q324-T328 PolarHBondContact O-N 2.89Å; Q324-T328 PolarHBondContact O-OG1 3.08Å
325	R	95.4	Very high	94.5	Very high	160 Å²	160	70.1 Å²	70.1	60%	0.604	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-53.9	172.2	-173.6	-178.4	72.8	-166.1	1.2	110.5	F321 Y322 Q327 T328 E329	F321-R325 WeakPolarHBondContact O-CB 3.37Å; F321-R325 PolarHBondContact O-N 3.4Å; Y322-R325 PolarHBondContact O-N 3.3Å; R325-Q327 VanDerWaalsContact C-N 3.27Å; R325-Q327 PolarHBondContact O-N 3.04Å; R325-T328 PolarHBondContact O-N 3.1Å; R325-E329 WeakPolarHBondContact O-CB 3.29Å; R325-E329 PolarHBondContact O-N 3.24Å
326	Q	92.9	Very high	94.4	Very high	101 Å²	101	70.2 Å²	70.2	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-36	-177.9	-171	178.6	42.6	0	0	113	Y322	Y322-Q326 PolarHBondContact O-N 3.34Å
327	Q	91.9	Very high	94.2	Very high	24 Å²	24	74.3 Å²	74.3	11%	0.112	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-48	171.9	175.3	-176.3	-37.3	0	0	112	E131 S175 T178 Y323 R325 S330	E131-Q327 PolarHBondContact OE1-NE2 2.64Å; E131-Q327 PolarHBondContact OE1-OE1 3.07Å; S175-Q327 PolarHBondContact OG-NE2 3.32Å; T178-Q327 HydrophobicContact CG2-CB 4.38Å; T178-Q327 PolarHBondContact OG1-OE1 3.26Å; Y323-Q327 WeakPolarHBondContact O-CB 3.42Å; Y323-Q327 PolarHBondContact O-N 2.94Å; R325-Q327 VanDerWaalsContact C-N 3.27Å; R325-Q327 PolarHBondContact O-N 3.04Å; Q327-S330 PolarHBondContact O-OG 2.9Å
328	T	91.6	Very high	94	Very high	87 Å²	87	73 Å²	73	53%	0.534	36%	0.363	S	S	.	.	H	α-helix	trans	-75.9	-38.1	-170.2	-51	0	0	0	0	112.4	Q324 R325 S330 V331 P332	Q324-T328 WeakPolarHBondContact O-CB 3.19Å; Q324-T328 PolarHBondContact O-N 2.89Å; Q324-T328 PolarHBondContact O-OG1 3.08Å; R325-T328 PolarHBondContact O-N 3.1Å; T328-S330 PolarHBondContact O-N 3.07Å; T328-V331 WeakPolarHBondContact O-CB 3.45Å; T328-V331 PolarHBondContact O-N 3.29Å; T328-P332 VanDerWaalsContact O-CD 3.28Å; T328-P332 WeakPolarHBondContact O-CD 3.32Å
329	E	92.4	Very high	93.9	Very high	134 Å²	134	73.2 Å²	73.2	63%	0.626	36%	0.358	S	S	*	.	H	α-helix	trans	-53.5	-36	-177.5	-177.2	172.4	-170.9	0	0	113.6	R325 V331	R325-E329 WeakPolarHBondContact O-CB 3.29Å; R325-E329 PolarHBondContact O-N 3.24Å; E329-V331 VanDerWaalsContact C-N 3.29Å; E329-V331 PolarHBondContact O-N 3.21Å
330	S	87.3	Confident	93.8	Very high	56 Å²	56	75.3 Å²	75.3	39%	0.392	37%	0.369	S	S	.	.	H	α-helix	trans	-73.9	-13.4	179.8	70.2	0	0	0	0	115.2	Q327 T328	Q327-S330 PolarHBondContact O-OG 2.9Å; T328-S330 PolarHBondContact O-N 3.07Å
331	V	92.5	Very high	93.5	Very high	40 Å²	40	77.7 Å²	77.7	24%	0.242	38%	0.384	C	S	.	.	H	α-helix	trans	-81.7	-48.3	-168.6	-179.5	0	0	0	0	113.4	T328 E329 L333 G334 Y335	T328-V331 WeakPolarHBondContact O-CB 3.45Å; T328-V331 PolarHBondContact O-N 3.29Å; E329-V331 VanDerWaalsContact C-N 3.29Å; E329-V331 PolarHBondContact O-N 3.21Å; V331-L333 PolarHBondContact O-N 3.4Å; V331-G334 PolarHBondContact O-N 3.35Å; V331-G334 VanDerWaalsContact O-N 3.12Å; V331-Y335 HydrophobicContact CG1-CD2 3.96Å; V331-Y335 HydrophobicContact CG1-CE2 3.5Å; V331-Y335 WeakPolarHBondContact O-CD2 3.41Å; V331-Y335 PolarHBondContact O-N 3.22Å
332	P	94.3	Very high	93.4	Very high	86 Å²	86	74.4 Å²	74.4	56%	0.558	38%	0.376	S	S	*	.	H	α-helix	trans	-59.3	-43.3	179.4	-24.9	35	0	0	0	113	T328 G334 Y335 Q336	T328-P332 VanDerWaalsContact O-CD 3.28Å; T328-P332 WeakPolarHBondContact O-CD 3.32Å; P332-G334 VanDerWaalsContact C-N 3.25Å; P332-G334 PolarHBondContact O-N 3.27Å; P332-Y335 PolarHBondContact O-N 2.85Å; P332-Y335 VanDerWaalsContact O-N 3.16Å; P332-Q336 PolarHBondContact O-N 3.02Å
333	L	92.4	Very high	93.2	Very high	101 Å²	101	78 Å²	78	53%	0.529	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-33.3	177.6	-177.2	61.6	0	0	0	112	V331 N337	V331-L333 PolarHBondContact O-N 3.4Å; L333-N337 PolarHBondContact O-N 3.33Å; L333-N337 PolarHBondContact O-ND2 3.39Å
334	G	92.1	Very high	92.6	Very high	11 Å²	11	83.4 Å²	83.4	11%	0.113	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-48.3	173.1	0	0	0	0	0	112.2	V331 P332 L338	V331-G334 PolarHBondContact O-N 3.35Å; V331-G334 VanDerWaalsContact O-N 3.12Å; P332-G334 VanDerWaalsContact C-N 3.25Å; P332-G334 PolarHBondContact O-N 3.27Å; G334-L338 WeakPolarHBondContact O-CG 3.44Å; G334-L338 PolarHBondContact O-N 3.09Å
335	Y	92.8	Very high	92.3	Very high	100 Å²	100	84.4 Å²	84.4	39%	0.392	43%	0.428	S	S	.	.	H	α-helix	trans	-72.8	-36.1	179.4	-66	-59.5	0	0	0	113.6	D168 V331 P332 N337 L338 E339	D168-Y335 PolarHBondContact OD1-OH 3.17Å; V331-Y335 HydrophobicContact CG1-CD2 3.96Å; V331-Y335 HydrophobicContact CG1-CE2 3.5Å; V331-Y335 WeakPolarHBondContact O-CD2 3.41Å; V331-Y335 PolarHBondContact O-N 3.22Å; P332-Y335 PolarHBondContact O-N 2.85Å; P332-Y335 VanDerWaalsContact O-N 3.16Å; Y335-N337 VanDerWaalsContact C-N 3.3Å; Y335-N337 PolarHBondContact O-N 3.22Å; Y335-L338 HydrophobicContact CD1-CD1 4.06Å; Y335-L338 PolarHBondContact O-N 2.86Å; Y335-L338 VanDerWaalsContact O-N 3.16Å; Y335-E339 WeakPolarHBondContact O-CB 3.49Å; Y335-E339 PolarHBondContact O-N 3.39Å
336	Q	95.1	Very high	91.9	Very high	108 Å²	108	83.5 Å²	83.5	51%	0.505	43%	0.43	S	S	.	.	H	α-helix	trans	-58.1	-41.8	175.2	-172.6	-178.2	11.8	0	0	111.9	P332 E339 L340	P332-Q336 PolarHBondContact O-N 3.02Å; Q336-E339 PolarHBondContact O-N 3.16Å; Q336-L340 HydrophobicContact CG-CD1 4.37Å; Q336-L340 WeakPolarHBondContact O-CG 3.38Å; Q336-L340 PolarHBondContact O-N 3.18Å
337	N	94.3	Very high	91.8	Very high	86 Å²	86	84.6 Å²	84.6	46%	0.46	45%	0.446	S	S	.	.	H	α-helix	trans	-67.3	-37.4	176.5	-74.8	-58.1	0	0	0	112.6	L333 Y335 T341	L333-N337 PolarHBondContact O-N 3.33Å; L333-N337 PolarHBondContact O-ND2 3.39Å; Y335-N337 VanDerWaalsContact C-N 3.3Å; Y335-N337 PolarHBondContact O-N 3.22Å; N337-T341 WeakPolarHBondContact O-CB 3.45Å; N337-T341 PolarHBondContact O-N 3.12Å; N337-T341 VanDerWaalsContact O-N 3.07Å; N337-T341 PolarHBondContact O-OG1 2.77Å
338	L	94.4	Very high	91.6	Very high	21 Å²	21	85.2 Å²	85.2	11%	0.11	46%	0.459	C	S	.	.	H	α-helix	trans	-66.3	-41	174.4	-68.7	165.2	0	0	0	111.6	M163 T164 Q167 G334 Y335 T341 C342	M163-L338 HydrophobicContact CB-CD2 3.63Å; T164-L338 HydrophobicContact CG2-CD1 4.38Å; Q167-L338 HydrophobicContact CB-CD1 4.17Å; Q167-L338 HydrophobicContact CG-CD1 4.35Å; G334-L338 WeakPolarHBondContact O-CG 3.44Å; G334-L338 PolarHBondContact O-N 3.09Å; Y335-L338 HydrophobicContact CD1-CD1 4.06Å; Y335-L338 PolarHBondContact O-N 2.86Å; Y335-L338 VanDerWaalsContact O-N 3.16Å; L338-T341 PolarHBondContact O-N 3.43Å; L338-C342 WeakPolarHBondContact O-CB 3.49Å; L338-C342 PolarHBondContact O-N 3.27Å
339	E	95.1	Very high	91.5	Very high	94 Å²	94	86 Å²	86	44%	0.439	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-51.1	176.5	-166.7	-151.4	158.1	0	0	111.5	Y335 Q336 T341 C342 R343	Y335-E339 WeakPolarHBondContact O-CB 3.49Å; Y335-E339 PolarHBondContact O-N 3.39Å; Q336-E339 PolarHBondContact O-N 3.16Å; E339-T341 VanDerWaalsContact C-N 3.25Å; E339-T341 PolarHBondContact O-N 3.41Å; E339-C342 PolarHBondContact O-N 3.27Å; E339-R343 WeakPolarHBondContact O-CG 3.43Å; E339-R343 PolarHBondContact O-N 2.8Å; E339-R343 IonicContact OE1-CZ 2.93Å; E339-R343 IonicContact OE1-NE 2.91Å; E339-R343 PolarHBondContact OE1-NE 3.44Å; E339-R343 IonicContact OE1-NH2 2.76Å; E339-R343 PolarHBondContact OE1-NH2 3Å
340	L	94.6	Very high	91.3	Very high	82 Å²	82	80.7 Å²	80.7	43%	0.429	43%	0.434	S	S	.	.	H	α-helix	trans	-60.3	-35.6	177.1	-69.9	172	0	0	0	112.2	Q336 N344	Q336-L340 HydrophobicContact CG-CD1 4.37Å; Q336-L340 WeakPolarHBondContact O-CG 3.38Å; Q336-L340 PolarHBondContact O-N 3.18Å; L340-N344 PolarHBondContact O-ND2 3.5Å
341	T	92.1	Very high	91.4	Very high	62 Å²	62	85.6 Å²	85.6	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-67	-39.8	173.7	-54.6	0	0	0	0	111.3	I160 N337 L338 E339 N344	I160-T341 HydrophobicContact CD1-CG2 4.41Å; I160-T341 HydrophobicContact CG1-CG2 3.95Å; N337-T341 WeakPolarHBondContact O-CB 3.45Å; N337-T341 PolarHBondContact O-N 3.12Å; N337-T341 VanDerWaalsContact O-N 3.07Å; N337-T341 PolarHBondContact O-OG1 2.77Å; L338-T341 PolarHBondContact O-N 3.43Å; E339-T341 VanDerWaalsContact C-N 3.25Å; E339-T341 PolarHBondContact O-N 3.41Å; T341-N344 PolarHBondContact O-N 2.91Å
342	C	93.8	Very high	91.2	Very high	52 Å²	52	88.6 Å²	88.6	35%	0.351	46%	0.459	S	S	.	.	H	α-helix	trans	-71.1	-31	-178.3	-164.9	0	0	0	0	113.9	I160 L338 E339 N344	I160-C342 HydrophobicContact CD1-CB 4.2Å; I160-C342 HydrophobicContact CG2-CB 4.3Å; L338-C342 WeakPolarHBondContact O-CB 3.49Å; L338-C342 PolarHBondContact O-N 3.27Å; E339-C342 PolarHBondContact O-N 3.27Å; C342-N344 PolarHBondContact O-N 3.49Å
343	R	92.2	Very high	90.9	Very high	177 Å²	177	88.2 Å²	88.2	67%	0.668	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.1	176.9	-71.5	174.1	177.7	-143.5	6	113.9	E339	E339-R343 WeakPolarHBondContact O-CG 3.43Å; E339-R343 PolarHBondContact O-N 2.8Å; E339-R343 IonicContact OE1-CZ 2.93Å; E339-R343 IonicContact OE1-NE 2.91Å; E339-R343 PolarHBondContact OE1-NE 3.44Å; E339-R343 IonicContact OE1-NH2 2.76Å; E339-R343 PolarHBondContact OE1-NH2 3Å
344	N	84.3	Confident	90.7	Very high	135 Å²	135	87.9 Å²	87.9	72%	0.722	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	13.6	-173.4	-62.3	-21.3	0	0	0	114.1	L340 T341 C342	L340-N344 PolarHBondContact O-ND2 3.5Å; T341-N344 PolarHBondContact O-N 2.91Å; C342-N344 PolarHBondContact O-N 3.49Å
345	V	87	Confident	90.5	Very high	56 Å²	56	91 Å²	91	34%	0.339	46%	0.457	S	S	.	.			trans	-107.3	119.9	-177.4	-179.1	0	0	0	0	111.5	L157 I160	L157-V345 HydrophobicContact CD2-CB 3.98Å; L157-V345 HydrophobicContact CD2-CG1 3.94Å; L157-V345 HydrophobicContact CD2-CG2 4.21Å; I160-V345 HydrophobicContact CD1-CG2 3.6Å
346	E	87.1	Confident	90.2	Very high	141 Å²	141	90.8 Å²	90.8	66%	0.659	46%	0.462	S	S	*	.			trans	-75.5	126.5	178.6	-72.4	-61.8	157.4	0	0	112.3	G348	E346-G348 PolarHBondContact O-N 2.81Å
347	P	90	Very high	89.7	Confident	123 Å²	123	89.6 Å²	89.6	80%	0.799	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	131.7	177.6	-25.4	35.3	0	0	0	113.2
348	G	88.4	Confident	89.1	Confident	38 Å²	38	93.1 Å²	93.1	39%	0.392	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-12	173.5	0	0	0	0	0	115.9	E346 Y351 L352	E346-G348 PolarHBondContact O-N 2.81Å; G348-Y351 WeakPolarHBondContact O-CB 3.41Å; G348-Y351 PolarHBondContact O-N 3.09Å; G348-Y351 VanDerWaalsContact O-N 3.09Å; G348-L352 PolarHBondContact O-N 3.36Å; G348-L352 VanDerWaalsContact O-N 3.09Å
349	E	89.4	Confident	88.1	Confident	104 Å²	104	101 Å²	101	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-51.8	-46.4	175.6	175.9	-175.1	-154	0	0	113.1	Y351 L352 L353	E349-Y351 VanDerWaalsContact C-N 3.26Å; E349-Y351 PolarHBondContact O-N 3.32Å; E349-L352 WeakPolarHBondContact O-CB 3.35Å; E349-L352 PolarHBondContact O-N 2.88Å; E349-L352 VanDerWaalsContact O-N 3.11Å; E349-L353 HydrophobicContact CG-CD1 3.91Å; E349-L353 HydrophobicContact CG-CG 4.3Å; E349-L353 WeakPolarHBondContact O-CG 3.28Å; E349-L353 PolarHBondContact O-N 2.92Å
350	P	87.7	Confident	86.6	Confident	22 Å²	22	107.1 Å²	107.1	14%	0.143	52%	0.52	C	S	.	.	H	α-helix	trans	-64.1	-29.9	-179.8	-24.7	37.5	0	0	0	113.6	M154 Y354	M154-P350 WeakPolarHBondContact O-CB 3.44Å; P350-Y354 WeakPolarHBondContact O-CB 3.42Å; P350-Y354 PolarHBondContact O-N 3.17Å
351	Y	89.4	Confident	85.2	Confident	158 Å²	158	109.1 Å²	109.1	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-71.9	-39.2	174.5	173.2	-106.1	0	0	0	111.8	G348 E349 Y354 I355	G348-Y351 WeakPolarHBondContact O-CB 3.41Å; G348-Y351 PolarHBondContact O-N 3.09Å; G348-Y351 VanDerWaalsContact O-N 3.09Å; E349-Y351 VanDerWaalsContact C-N 3.26Å; E349-Y351 PolarHBondContact O-N 3.32Å; Y351-Y354 WeakPolarHBondContact O-CB 3.46Å; Y351-Y354 PolarHBondContact O-N 3.43Å; Y351-I355 HydrophobicContact CD1-CD1 3.98Å; Y351-I355 HydrophobicContact CE1-CD1 3.47Å; Y351-I355 VanDerWaalsContact CE1-CD1 3.47Å; Y351-I355 HydrophobicContact CE2-CD1 4.21Å; Y351-I355 WeakPolarHBondContact O-CG1 3.39Å; Y351-I355 PolarHBondContact O-N 3.39Å
352	L	88.8	Confident	83.7	Confident	103 Å²	103	114.3 Å²	114.3	54%	0.539	56%	0.558	S	S	.	*	H	α-helix	trans	-63.7	-45.3	172.8	-64.7	174.7	0	0	0	111.1	G348 E349 Y354 I355 L356	G348-L352 PolarHBondContact O-N 3.36Å; G348-L352 VanDerWaalsContact O-N 3.09Å; E349-L352 WeakPolarHBondContact O-CB 3.35Å; E349-L352 PolarHBondContact O-N 2.88Å; E349-L352 VanDerWaalsContact O-N 3.11Å; L352-Y354 VanDerWaalsContact C-N 3.31Å; L352-Y354 PolarHBondContact O-N 3.36Å; L352-I355 PolarHBondContact O-N 3.39Å; L352-L356 WeakPolarHBondContact O-CB 3.29Å; L352-L356 VanDerWaalsContact O-CG 3.29Å; L352-L356 WeakPolarHBondContact O-CG 3.4Å; L352-L356 PolarHBondContact O-N 3.15Å
353	L	87.2	Confident	82.2	Confident	78 Å²	78	120.6 Å²	120.6	41%	0.408	58%	0.582	S	S	.	*	H	α-helix	trans	-63.2	-35.7	174.7	-66.6	171.5	0	0	0	112.1	M154 E349 L356 S357	M154-L353 HydrophobicContact CE-CB 3.32Å; M154-L353 HydrophobicContact CE-CD1 4.2Å; M154-L353 HydrophobicContact CE-CG 4.4Å; E349-L353 HydrophobicContact CG-CD1 3.91Å; E349-L353 HydrophobicContact CG-CG 4.3Å; E349-L353 WeakPolarHBondContact O-CG 3.28Å; E349-L353 PolarHBondContact O-N 2.92Å; L353-L356 PolarHBondContact O-N 3.37Å; L353-S357 WeakPolarHBondContact O-CB 3.2Å; L353-S357 PolarHBondContact O-N 3.46Å; L353-S357 PolarHBondContact O-OG 2.96Å
354	Y	88.9	Confident	80.6	Confident	95 Å²	95	118.3 Å²	118.3	37%	0.373	59%	0.588	S	S	.	*	H	α-helix	trans	-63.4	-43.9	171.8	-176.9	-95	0	0	0	112.1	M154 P350 Y351 L352 S357 R358	M154-Y354 HydrophobicContact CB-CD2 4.14Å; M154-Y354 HydrophobicContact CG-CD2 4.23Å; P350-Y354 WeakPolarHBondContact O-CB 3.42Å; P350-Y354 PolarHBondContact O-N 3.17Å; Y351-Y354 WeakPolarHBondContact O-CB 3.46Å; Y351-Y354 PolarHBondContact O-N 3.43Å; L352-Y354 VanDerWaalsContact C-N 3.31Å; L352-Y354 PolarHBondContact O-N 3.36Å; Y354-S357 PolarHBondContact O-OG 2.75Å; Y354-S357 VanDerWaalsContact O-OG 3.07Å; Y354-R358 HydrophobicContact CD1-CG 4.38Å; Y354-R358 HydrophobicContact CE1-CG 4.05Å; Y354-R358 HydrophobicContact CE2-CG 4.36Å; Y354-R358 WeakPolarHBondContact O-CB 3.28Å; Y354-R358 WeakPolarHBondContact O-CG 3.14Å; Y354-R358 PolarHBondContact O-N 3.35Å; Y354-R358 PolarHBondContact OH-NE 2.94Å; Y354-R358 VanDerWaalsContact OH-NE 3.1Å; Y354-R358 PolarHBondContact OH-NH2 2.88Å
355	I	88.4	Confident	79.5	Confident	76 Å²	76	119.6 Å²	119.6	39%	0.39	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-45.7	174.6	-68.8	165.1	0	0	0	110.9	Y351 L352 R358 R359	Y351-I355 HydrophobicContact CD1-CD1 3.98Å; Y351-I355 HydrophobicContact CE1-CD1 3.47Å; Y351-I355 VanDerWaalsContact CE1-CD1 3.47Å; Y351-I355 HydrophobicContact CE2-CD1 4.21Å; Y351-I355 WeakPolarHBondContact O-CG1 3.39Å; Y351-I355 PolarHBondContact O-N 3.39Å; L352-I355 PolarHBondContact O-N 3.39Å; I355-R358 CarbonylContact O-C 3.59Å; I355-R358 WeakPolarHBondContact O-CA 3.3Å; I355-R358 PolarHBondContact O-N 2.93Å; I355-R358 VanDerWaalsContact O-N 3.09Å; I355-R359 PolarHBondContact O-N 2.59Å; I355-R359 VanDerWaalsContact O-N 3.16Å
356	L	86.3	Confident	78.5	Confident	95 Å²	95	124.1 Å²	124.1	50%	0.497	61%	0.612	S	S	.	*	H	α-helix	trans	-65.3	-43.3	-176.6	-70.4	171.2	0	0	0	112.2	L352 L353 R358 R359	L352-L356 WeakPolarHBondContact O-CB 3.29Å; L352-L356 VanDerWaalsContact O-CG 3.29Å; L352-L356 WeakPolarHBondContact O-CG 3.4Å; L352-L356 PolarHBondContact O-N 3.15Å; L353-L356 PolarHBondContact O-N 3.37Å; L356-R358 PolarHBondContact O-N 3.09Å; L356-R359 WeakPolarHBondContact O-CB 3.45Å; L356-R359 PolarHBondContact O-N 3.31Å; L356-R359 VanDerWaalsContact O-N 3.17Å
357	S	85.1	Confident	77.4	Confident	83 Å²	83	123.3 Å²	123.3	58%	0.58	62%	0.617	S	S	*	*	H	α-helix	trans	-67.4	-15.2	173.2	57.5	0	0	0	0	113.8	L353 Y354	L353-S357 WeakPolarHBondContact O-CB 3.2Å; L353-S357 PolarHBondContact O-N 3.46Å; L353-S357 PolarHBondContact O-OG 2.96Å; Y354-S357 PolarHBondContact O-OG 2.75Å; Y354-S357 VanDerWaalsContact O-OG 3.07Å
358	R	80.7	Confident	76.5	Confident	161 Å²	161	125.6 Å²	125.6	61%	0.608	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	3	173.6	-66.3	-70.7	-164.5	-140.5	-1.7	114.1	Y354 I355 L356 R360	Y354-R358 HydrophobicContact CD1-CG 4.38Å; Y354-R358 HydrophobicContact CE1-CG 4.05Å; Y354-R358 HydrophobicContact CE2-CG 4.36Å; Y354-R358 WeakPolarHBondContact O-CB 3.28Å; Y354-R358 WeakPolarHBondContact O-CG 3.14Å; Y354-R358 PolarHBondContact O-N 3.35Å; Y354-R358 PolarHBondContact OH-NE 2.94Å; Y354-R358 VanDerWaalsContact OH-NE 3.1Å; Y354-R358 PolarHBondContact OH-NH2 2.88Å; I355-R358 CarbonylContact O-C 3.59Å; I355-R358 WeakPolarHBondContact O-CA 3.3Å; I355-R358 PolarHBondContact O-N 2.93Å; I355-R358 VanDerWaalsContact O-N 3.09Å; L356-R358 PolarHBondContact O-N 3.09Å; R358-R360 PolarHBondContact O-N 2.74Å
359	R	73.9	Confident	75.7	Confident	185 Å²	185	128.4 Å²	128.4	70%	0.698	63%	0.628	S	S	*	*			trans	-53.8	113.5	178.1	-93	-167.9	177.5	-126.9	3.8	111.1	I355 L356	I355-R359 PolarHBondContact O-N 2.59Å; I355-R359 VanDerWaalsContact O-N 3.16Å; L356-R359 WeakPolarHBondContact O-CB 3.45Å; L356-R359 PolarHBondContact O-N 3.31Å; L356-R359 VanDerWaalsContact O-N 3.17Å
360	R	63.6	Low	74.8	Confident	223 Å²	223	131.9 Å²	131.9	84%	0.842	64%	0.642	S	S	*	*			trans	-78.7	157.3	161.7	-69.8	-174.4	176.6	-169	-1.4	109.4	R358 E362	R358-R360 PolarHBondContact O-N 2.74Å; R360-E362 PolarHBondContact O-N 2.7Å
361	P	65.6	Low	73.7	Confident	125 Å²	125	139.3 Å²	139.3	81%	0.812	68%	0.675	S	S	*	*			trans	-54.3	138.3	168.9	23.9	-34.2	0	0	0	110.1	Q363	P361-Q363 PolarHBondContact O-N 3.49Å; P361-Q363 VanDerWaalsContact O-N 3.12Å
362	E	60.2	Low	72.4	Confident	171 Å²	171	137.5 Å²	137.5	80%	0.799	68%	0.676	S	S	*	*			trans	-66.8	110.3	-170.1	-164.9	155.3	-132	0	0	110.2	R360 T364	R360-E362 PolarHBondContact O-N 2.7Å; E362-T364 PolarHBondContact O-N 3.04Å; E362-T364 VanDerWaalsContact O-N 3.11Å
363	Q	62	Low	70.9	Confident	183 Å²	183	142.5 Å²	142.5	86%	0.855	69%	0.689	S	S	*	*			trans	-74.7	106.4	-175.1	-164.4	168.8	14.8	0	0	108.4	P361 L365	P361-Q363 PolarHBondContact O-N 3.49Å; P361-Q363 VanDerWaalsContact O-N 3.12Å; Q363-L365 PolarHBondContact O-N 2.93Å; Q363-L365 VanDerWaalsContact O-N 3.13Å
364	T	59.3	Low	69.3	Low	129 Å²	129	144.3 Å²	144.3	79%	0.791	70%	0.703	S	S	*	*			trans	-51	119.6	-175.3	51.2	0	0	0	0	110.7	E362 Q366	E362-T364 PolarHBondContact O-N 3.04Å; E362-T364 VanDerWaalsContact O-N 3.11Å; T364-Q366 PolarHBondContact O-N 3.34Å
365	L	61	Low	67.4	Low	163 Å²	163	144.4 Å²	144.4	85%	0.853	72%	0.715	S	S	*	*			trans	-50.8	125.7	-179.9	-76	166.7	0	0	0	110.3	Q363 T367	Q363-L365 PolarHBondContact O-N 2.93Å; Q363-L365 VanDerWaalsContact O-N 3.13Å; L365-T367 PolarHBondContact O-N 3.02Å
366	Q	65.6	Low	65.5	Low	150 Å²	150	150.3 Å²	150.3	70%	0.701	74%	0.742	S	S	*	*			trans	-74.3	94.3	-178.9	-169.4	169.4	18.2	0	0	109.1	T364 F368	T364-Q366 PolarHBondContact O-N 3.34Å; Q366-F368 HydrophobicContact CB-CE2 4.02Å; Q366-F368 HydrophobicContact CB-CZ 4.07Å; Q366-F368 HydrophobicContact CG-CE1 3.97Å; Q366-F368 HydrophobicContact CG-CE2 4.07Å; Q366-F368 HydrophobicContact CG-CZ 3.7Å; Q366-F368 WeakPolarHBondContact O-CD2 3.46Å; Q366-F368 WeakPolarHBondContact O-CE2 3.47Å; Q366-F368 PolarHBondContact O-N 3.39Å
367	T	64.6	Low	63.4	Low	125 Å²	125	149.3 Å²	149.3	77%	0.767	75%	0.754	S	S	*	*			trans	-67.6	96.9	178.9	-54.1	0	0	0	0	110.3	L365 S369	L365-T367 PolarHBondContact O-N 3.02Å; T367-S369 VanDerWaalsContact C-N 3.33Å; T367-S369 PolarHBondContact O-N 3.4Å
368	F	71.3	Confident	61.6	Low	171 Å²	171	155.6 Å²	155.6	75%	0.75	77%	0.771	S	S	*	*			trans	-74.6	83	173.5	-63.4	-77.1	0	0	0	110.6	Q366	Q366-F368 HydrophobicContact CB-CE2 4.02Å; Q366-F368 HydrophobicContact CB-CZ 4.07Å; Q366-F368 HydrophobicContact CG-CE1 3.97Å; Q366-F368 HydrophobicContact CG-CE2 4.07Å; Q366-F368 HydrophobicContact CG-CZ 3.7Å; Q366-F368 WeakPolarHBondContact O-CD2 3.46Å; Q366-F368 WeakPolarHBondContact O-CE2 3.47Å; Q366-F368 PolarHBondContact O-N 3.39Å
369	S	70.1	Confident	59.5	Low	97 Å²	97	153.8 Å²	153.8	68%	0.678	78%	0.783	S	S	*	*			trans	-81.4	140.9	166.6	52.5	0	0	0	0	111	T367 Q371	T367-S369 VanDerWaalsContact C-N 3.33Å; T367-S369 PolarHBondContact O-N 3.4Å; S369-Q371 PolarHBondContact O-N 2.96Å
370	F	71.3	Confident	57.9	Low	176 Å²	176	151.6 Å²	151.6	77%	0.772	79%	0.785	S	S	*	*			trans	-64.3	131.8	169.1	-178.2	-111.6	0	0	0	109.5	D372	F370-D372 WeakPolarHBondContact CE1-OD1 3.18Å
371	Q	63.8	Low	56.9	Low	179 Å²	179	151 Å²	151	84%	0.836	78%	0.783	S	S	*	*			trans	-110.8	102.1	-179.6	-171.1	171.8	24	0	0	109.5	S369 Y373	S369-Q371 PolarHBondContact O-N 2.96Å; Q371-Y373 PolarHBondContact O-N 3.01Å
372	D	62.1	Low	55.6	Low	119 Å²	119	156 Å²	156	64%	0.636	79%	0.785	S	S	*	*			trans	-57.4	131.5	179.7	-87	-66	0	0	0	112.6	F370 T374	F370-D372 WeakPolarHBondContact CE1-OD1 3.18Å; D372-T374 PolarHBondContact O-N 2.77Å; D372-T374 VanDerWaalsContact O-N 3.13Å
373	Y	58.8	Low	54.7	Low	208 Å²	208	157.2 Å²	157.2	82%	0.816	79%	0.788	S	S	*	*			trans	-72.8	106.2	-179.9	179.6	-95	0	0	0	111	Q371 P375	Q371-Y373 PolarHBondContact O-N 3.01Å; Y373-P375 HydrophobicContact CE1-CB 4.46Å
374	T	53.5	Low	54.3	Low	116 Å²	116	154.2 Å²	154.2	71%	0.712	78%	0.784	S	S	*	*			trans	-110.5	119.9	171.4	44.9	0	0	0	0	110.2	D372	D372-T374 PolarHBondContact O-N 2.77Å; D372-T374 VanDerWaalsContact O-N 3.13Å
375	P	47.3	Very low	53.5	Low	97 Å²	97	152.1 Å²	152.1	63%	0.63	78%	0.775	S	S	*	*			trans	-68.1	140.6	175	28.2	-33.6	0	0	0	110.2	Y373 G377	Y373-P375 HydrophobicContact CE1-CB 4.46Å; P375-G377 PolarHBondContact O-N 3.13Å
376	Q	50.1	Low	52.3	Low	201 Å²	201	150.9 Å²	150.9	94%	0.939	77%	0.769	S	S	*	*			trans	-67.5	92.7	-168.4	-73	-164.9	-6.4	0	0	114.4
377	G	41.1	Very low	51	Low	73 Å²	73	150.8 Å²	150.8	75%	0.753	77%	0.772	S	S	*	*			trans	-85.2	125.7	163.4	0	0	0	0	0	111.9	P375 S379	P375-G377 PolarHBondContact O-N 3.13Å; G377-S379 PolarHBondContact O-N 3.16Å
378	K	47	Very low	49.8	Very low	215 Å²	215	152.7 Å²	152.7	94%	0.935	78%	0.777	S	S	*	*			trans	-70.5	119.5	178.7	-59.6	171.4	-176.8	173.3	0	111.5
379	S	37.5	Very low	48.2	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	77%	0.773	S	S	*	*			trans	-159.9	178.3	152.7	-152.9	0	0	0	0	113.9	G377	G377-S379 PolarHBondContact O-N 3.16Å
380	N	41	Very low	47.3	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	77%	0.774	S	S	*	*			trans	-112.7	162.1	-163	-97.4	-68.1	0	0	0	114.2
381	R	42.7	Very low	45.7	Very low	211 Å²	211	147.9 Å²	147.9	80%	0.796	77%	0.772	S	S	*	*			trans	75.1	136.8	145.1	-82.6	176.4	-174.5	-161.7	3	121.3
382	R	37.8	Very low	44.5	Very low	229 Å²	229	145.9 Å²	145.9	86%	0.864	76%	0.763	S	S	*	*			trans	115.2	133.2	142.1	-74.5	146.8	174.5	173.8	-3.2	118.3
383	K	40.8	Very low	42.9	Very low	196 Å²	196	146.2 Å²	146.2	85%	0.852	76%	0.764	S	S	*	*			trans	-66.1	173.2	152.9	-69.1	-178.8	175.2	-175.7	0	110.2
384	P	54	Low	41.7	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	76%	0.764	S	S	*	*			cis	-123.9	-134.5	14.5	30.3	-3.8	0	0	0	111.5
385	S	41.4	Very low	40.7	Very low	85 Å²	85	142.7 Å²	142.7	59%	0.594	77%	0.769	S	S	*	*			cis	-168	158	7.2	12.2	0	0	0	0	113.5
386	N	36.1	Very low	40.8	Very low	138 Å²	138	143.3 Å²	143.3	74%	0.738	77%	0.773	S	S	*	*			trans	71.5	133.8	158.3	-55.2	-11.6	0	0	0	117.6
387	I	37.9	Very low	40.1	Very low	147 Å²	147	139 Å²	139	75%	0.754	76%	0.76	S	S	*	*			cis	84.2	111.4	30.6	-57.2	163.2	0	0	0	113.6
388	L	39.3	Very low	39.8	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	76%	0.758	S	S	*	*				-172.2	111	126.6	-102.7	165.1	0	0	0	111.4
389	S	38.6	Very low	39.1	Very low	97 Å²	97	139.9 Å²	139.9	68%	0.678	75%	0.751	S	S	*	*			trans	-91	166.1	152.3	-52.1	0	0	0	0	108.4
390	P	50.3	Low	38.7	Very low	107 Å²	107	140.6 Å²	140.6	70%	0.695	75%	0.745	S	S	*	*				-145.8	135.6	100.1	38.3	-21.7	0	0	0	114.8
391	L	39.1	Very low	38.2	Very low	138 Å²	138	138.4 Å²	138.4	72%	0.723	74%	0.741	S	S	*	*				76.1	144.6	99.5	-76	49.9	0	0	0	113.9
392	Q	38	Very low	38.6	Very low	138 Å²	138	132.7 Å²	132.7	65%	0.645	73%	0.732	S	S	*	*			cis	-166.8	158.9	-6.1	-119.4	173.8	-53.9	0	0	113.3
393	D	29.5	Very low	38.3	Very low	126 Å²	126	132.4 Å²	132.4	67%	0.674	73%	0.732	S	S	*	*			trans	54.2	159	139	-59	-11.7	0	0	0	121.9
394	S	31.9	Very low	38	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	73%	0.731	S	S	*	*			cis	-141.8	160.8	14.3	-37.6	0	0	0	0	114.2
395	V	34	Very low	37	Very low	134 Å²	134	136.9 Å²	136.9	81%	0.812	73%	0.733	S	S	*	*			trans	-124.2	145.6	178.9	168.1	0	0	0	0	111.8
396	P	48.6	Very low	36.4	Very low	111 Å²	111	137.4 Å²	137.4	72%	0.721	74%	0.737	S	S	*	*			trans	-145.3	168.2	137.9	30.8	-12	0	0	0	114.6
397	T	34.7	Very low	36.3	Very low	109 Å²	109	136 Å²	136	67%	0.669	73%	0.734	S	S	*	*			cis	-173.7	149.8	-42.1	31.1	0	0	0	0	109.2
398	I	36	Very low	36	Very low	139 Å²	139	136.7 Å²	136.7	71%	0.713	74%	0.738	S	S	*	*			trans	71.6	133.9	146.9	-72.3	165.5	0	0	0	117.8
399	E	32.7	Very low	35.7	Very low	168 Å²	168	132 Å²	132	79%	0.785	73%	0.73	S	S	*	*			cis	-169.8	177.1	-8.1	-116	165.7	-156.5	0	0	108.4
400	D	29	Very low	35.6	Very low	138 Å²	138	139.8 Å²	139.8	74%	0.738	75%	0.745	S	S	*	*			cis	-148.1	-87.5	-4.9	164.2	56.3	0	0	0	111
401	S	30	Very low	34.8	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	76%	0.755	S	S	*	*			trans	-169.4	-163.2	-161.9	-126.8	0	0	0	0	110.6
402	P	50.7	Low	34.5	Very low	91 Å²	91	146.9 Å²	146.9	59%	0.591	77%	0.765	S	S	*	*			cis	-135	169.3	0.7	32.8	-11	0	0	0	117.2
403	Y	30.8	Very low	34.2	Very low	222 Å²	222	143.1 Å²	143.1	87%	0.871	76%	0.763	S	S	*	*				176.4	177	115.3	-101.4	-75.3	0	0	0	113.3
404	K	36.2	Very low	34.4	Very low	191 Å²	191	146.1 Å²	146.1	83%	0.83	77%	0.773	S	S	*	*			trans	-117.4	179.2	-164.1	-59.5	170.2	177.5	165.3	0	111
405	R	31.7	Very low	34.4	Very low	220 Å²	220	144.8 Å²	144.8	83%	0.83	76%	0.763	S	S	*	*			cis	-173.2	143.9	26.3	-155.7	-171.6	-156.9	171.6	5.2	113.9
406	S	29.8	Very low	34.5	Very low	95 Å²	95	145.4 Å²	145.4	66%	0.664	76%	0.762	S	S	*	*			trans	55.5	167.5	149.2	69.7	0	0	0	0	120.8
407	T	33.3	Very low	33.8	Very low	110 Å²	110	145.5 Å²	145.5	68%	0.675	77%	0.766	S	S	*	*			cis	-158.4	149	14.6	-24.7	0	0	0	0	112.2
408	D	31.6	Very low	33.7	Very low	160 Å²	160	148.1 Å²	148.1	86%	0.856	77%	0.77	S	S	*	*			trans	48.5	155.7	158.8	-65	-31.7	0	0	0	122
409	G	32.3	Very low	33.7	Very low	67 Å²	67	145.7 Å²	145.7	69%	0.691	77%	0.765	S	S	*	*			cis	149	122.5	-12.5	0	0	0	0	0	115.3
410	R	36.3	Very low	33.8	Very low	261 Å²	261	145.3 Å²	145.3	99%	0.985	77%	0.767	S	S	*	*				173.5	163.5	125.4	-95.8	-178.1	177.3	-142.5	-0.4	113.3
411	R	35.2	Very low	34	Very low	244 Å²	244	142.2 Å²	142.2	92%	0.921	77%	0.768	S	S	*	*			trans	-101.9	153.7	-171.5	-58.3	174.3	178.4	167.5	-2.6	114.3
412	T	32.2	Very low	34	Very low	151 Å²	151	141.3 Å²	141.3	93%	0.926	77%	0.774	S	S	*	*			trans	-177	145.5	140.2	-76.1	0	0	0	0	108.5
413	G	31	Very low	32.9	Very low	59 Å²	59	142.6 Å²	142.6	61%	0.608	79%	0.785	S	S	*	*			cis	157.8	140.5	-13.2	0	0	0	0	0	114.1
414	H	33.3	Very low	32.9	Very low	188 Å²	188	139.3 Å²	139.3	87%	0.87	78%	0.781	S	S	*	*			trans	64.6	109.1	169.7	-74.8	84.7	0	0	0	120.9
415	S	33	Very low	32.5	Very low	87 Å²	87	138.2 Å²	138.2	61%	0.608	78%	0.779	S	S	*	*				43.5	131.9	116.5	-81.6	0	0	0	0	123.9
416	D	35.4	Very low	32.5	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	78%	0.776	S	S	*	*				51.9	139.7	124.6	-39.3	-37.3	0	0	0	119.5
417	S	33.9	Very low	32.3	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	79%	0.785	S	S	*	*			cis	-165.5	-179.1	-2.9	49.6	0	0	0	0	106.7
418	E	34	Very low	32	Very low	163 Å²	163	136 Å²	136	76%	0.762	79%	0.788	S	S	*	*			cis	-132.2	-179.9	8.6	-106	-148.1	107.1	0	0	108.8
419	S	35.8	Very low	31.8	Very low	88 Å²	88	133.6 Å²	133.6	62%	0.615	78%	0.784	S	S	*	*			cis	81.3	138.3	41.6	-144.8	0	0	0	0	116.2
420	I	33.4	Very low	32.2	Very low	160 Å²	160	136 Å²	136	82%	0.821	79%	0.788	S	S	*	*			trans	61.9	136.6	-176.4	-59.6	171.7	0	0	0	112.7
421	G	33.1	Very low	31.8	Very low	74 Å²	74	127 Å²	127	76%	0.763	77%	0.769	S	S	*	*			cis	109.7	142.4	24.8	0	0	0	0	0	108.8
422	G	30.2	Very low	31.5	Very low	75 Å²	75	122.5 Å²	122.5	77%	0.773	76%	0.758	S	S	*	*			cis	168.1	120.1	-3.9	0	0	0	0	0	109.7
423	S	28.9	Very low	31.6	Very low	119 Å²	119	124.8 Å²	124.8	83%	0.832	75%	0.75	S	S	*	*			trans	74.2	151.9	166.8	-139.2	0	0	0	0	121
424	L	29.5	Very low	31.5	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	76%	0.764	S	S	*	*			trans	83.2	143.1	152.6	-78.2	163	0	0	0	123.6
425	E	27.8	Very low	31.3	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	76%	0.76	S	S	*	*			trans	59.9	101.8	160.8	-64	-174.7	146.4	0	0	121.2
426	S	31.2	Very low	31.7	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	76%	0.763	S	S	*	*				28.3	118.1	113	-54.8	0	0	0	0	118.5
427	L	26.2	Very low	31.4	Very low	163 Å²	163	134.4 Å²	134.4	85%	0.853	77%	0.765	S	S	*	*				-172.3	158	114.3	-101.9	170.1	0	0	0	112.5
428	S	27.4	Very low	31.2	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	77%	0.767	S	S	*	*			trans	56.7	114	153.1	-59.3	0	0	0	0	121
429	S	26.5	Very low	31	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	76%	0.762	S	S	*	*			trans	-55.2	170.8	146.4	-53.8	0	0	0	0	111.6
430	P	42.6	Very low	30.7	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	77%	0.773	S	S	*	*			cis	-155.8	172.2	28.5	45.9	-24.7	0	0	0	121.4
431	A	25.9	Very low	30.5	Very low	73 Å²	73	130.3 Å²	130.3	60%	0.603	77%	0.768	S	S	*	*			trans	75.8	149.8	138	0	0	0	0	0	122.3
432	H	31	Very low	30.4	Very low	149 Å²	149	134.1 Å²	134.1	69%	0.69	77%	0.77	S	S	*	*			trans	74.1	143.3	158.8	-58	-34.4	0	0	0	116.9
433	R	32.7	Very low	30.5	Very low	199 Å²	199	137.5 Å²	137.5	75%	0.751	78%	0.776	S	S	*	*			cis	-155.5	163.7	-9.4	-90.7	147.7	-153.8	177.8	7.5	104.8
434	R	30.3	Very low	30.5	Very low	241 Å²	241	139 Å²	139	91%	0.909	78%	0.78	S	S	*	*			cis	-158.4	175.1	16.2	-142.9	177.7	-171.2	163.8	1.5	110.6
435	L	28.1	Very low	30.3	Very low	147 Å²	147	137.3 Å²	137.3	77%	0.77	78%	0.781	S	S	*	*			trans	-87.9	170.6	164.8	-92.4	154	0	0	0	110.7
436	P	41.7	Very low	30.4	Very low	106 Å²	106	134.6 Å²	134.6	69%	0.688	78%	0.78	S	S	*	*			cis	-150.2	163	36.9	43	-22.3	0	0	0	121.5
437	K	29.1	Very low	30.6	Very low	189 Å²	189	135.9 Å²	135.9	82%	0.822	78%	0.779	S	S	*	*			trans	32.9	136.5	136.6	-59.2	177.4	177.4	178.7	0	119.9
438	T	30.3	Very low	31.1	Very low	137 Å²	137	134.5 Å²	134.5	84%	0.84	77%	0.772	S	S	*	*			cis	-140.4	176	16.5	47.4	0	0	0	0	111.4
439	G	28.4	Very low	31.8	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	77%	0.774	S	S	*	*			cis	122.2	148.9	1.6	0	0	0	0	0	113.8
440	S	29.7	Very low	32.3	Very low	122 Å²	122	139.8 Å²	139.8	85%	0.853	78%	0.777	S	S	*	*			trans	71.1	143.1	-168.7	-58.3	0	0	0	0	114.9
441	T	30	Very low	32	Very low	116 Å²	116	140.1 Å²	140.1	71%	0.712	78%	0.777	S	S	*	*			cis	-159.7	143.6	-13.8	-89.1	0	0	0	0	109.6
442	L	30.3	Very low	32.1	Very low	155 Å²	155	142.5 Å²	142.5	81%	0.812	79%	0.789	S	S	*	*			trans	13.3	123.9	161.5	-63.2	165.8	0	0	0	120
443	T	32.3	Very low	32	Very low	145 Å²	145	143 Å²	143	89%	0.89	80%	0.797	S	S	*	*				-160.4	157.8	103.8	22.2	0	0	0	0	110.7
444	V	29.2	Very low	31.8	Very low	150 Å²	150	142.3 Å²	142.3	91%	0.909	80%	0.804	S	S	*	*			trans	-106.6	145.9	175.6	-73.8	0	0	0	0	110.9
445	S	25.9	Very low	31.8	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	80%	0.798	S	S	*	*			trans	-143.5	140.1	167.9	-158	0	0	0	0	108.1
446	S	29.9	Very low	31.9	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	80%	0.801	S	S	*	*			trans	-164	133.2	175	-168.1	0	0	0	0	107.7
447	D	34.4	Very low	31.3	Very low	135 Å²	135	139.9 Å²	139.9	72%	0.722	81%	0.812	S	S	*	*			trans	-116.5	154.5	171.1	-64.5	-51.6	0	0	0	109.2
448	D	36.9	Very low	31.3	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	81%	0.813	S	S	*	*			trans	48.8	119.6	146.9	-62.3	-4.6	0	0	0	120.8
449	L	42	Very low	31.4	Very low	146 Å²	146	137.2 Å²	137.2	76%	0.764	81%	0.811	S	S	*	*				75.4	141.5	74	-68.2	173.9	0	0	0	112.3
450	E	38.3	Very low	31.6	Very low	181 Å²	181	145.4 Å²	145.4	85%	0.846	82%	0.824	S	S	*	*			cis	-131.2	-131.9	19.7	-75.7	-164.2	141.3	0	0	115.4
451	V	35.1	Very low	31.7	Very low	125 Å²	125	144 Å²	144	76%	0.758	82%	0.819	S	S	*	*			trans	-132.1	147.3	-144.2	-165.5	0	0	0	0	115
452	S	28.5	Very low	31.8	Very low	123 Å²	123	146 Å²	146	86%	0.86	83%	0.826	S	S	*	*			trans	-170.8	149.6	143.6	-83.1	0	0	0	0	113
453	D	28.7	Very low	31.7	Very low	160 Å²	160	141.4 Å²	141.4	86%	0.856	82%	0.815	S	S	*	*			trans	-90.1	142.8	176.4	-81.1	-55.2	0	0	0	113.4
454	M	27.8	Very low	31.6	Very low	183 Å²	183	143.9 Å²	143.9	90%	0.901	82%	0.817	S	S	*	*			trans	-164.1	150.6	138.8	-109.2	-160.5	78.3	0	0	111.7
455	V	31.5	Very low	31.7	Very low	128 Å²	128	141.7 Å²	141.7	78%	0.776	81%	0.809	S	S	*	*			trans	-100.4	131.3	-175	176.5	0	0	0	0	111.8
456	S	29.1	Very low	32.1	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	81%	0.808	S	S	*	*			trans	-166.5	127.9	152.1	-79.3	0	0	0	0	110.5
457	E	30.1	Very low	32.3	Very low	195 Å²	195	146.1 Å²	146.1	91%	0.911	81%	0.81	S	S	*	*			trans	-97.3	139.1	172.5	-71.8	-173	139.2	0	0	111.8
458	S	29.3	Very low	32.6	Very low	121 Å²	121	145.2 Å²	145.2	85%	0.846	81%	0.809	S	S	*	*			trans	-159.4	137.1	142	43.9	0	0	0	0	109.5
459	D	32.2	Very low	33.5	Very low	150 Å²	150	146.2 Å²	146.2	80%	0.802	80%	0.803	S	S	*	*			trans	-69.6	148.3	-173	-69.2	-76.5	0	0	0	114.3
460	Y	32	Very low	34.6	Very low	235 Å²	235	146.7 Å²	146.7	92%	0.922	80%	0.803	S	S	*	*				-174	144.9	106.7	-101.2	-73.6	0	0	0	111
461	A	33.3	Very low	36.5	Very low	92 Å²	92	142.9 Å²	142.9	76%	0.76	78%	0.784	S	S	*	*			trans	-97.1	179.1	-172.5	0	0	0	0	0	112.9
462	D	30.4	Very low	38.7	Very low	159 Å²	159	138 Å²	138	85%	0.85	76%	0.755	S	S	*	*			cis	-154	153.5	0.9	-172.1	59.7	0	0	0	107.4
463	G	28.8	Very low	41.1	Very low	57 Å²	57	142.7 Å²	142.7	59%	0.588	75%	0.754	S	S	*	*			cis	147.2	158.6	-5.6	0	0	0	0	0	112
464	Q	30.4	Very low	43.5	Very low	197 Å²	197	135.5 Å²	135.5	92%	0.921	72%	0.717	S	S	*	*			trans	-156.1	105.8	170.4	-152.4	171.1	58.3	0	0	111.6	V466	Q464-V466 PolarHBondContact O-N 2.97Å
465	S	30.9	Very low	46.1	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	67%	0.674	S	S	*	*			trans	-82.1	108.9	-166.3	63.7	0	0	0	0	114.4	K467	S465-K467 PolarHBondContact O-N 2.78Å
466	V	34.5	Very low	48.5	Very low	134 Å²	134	126.3 Å²	126.3	81%	0.812	67%	0.667	S	S	*	*			trans	-72.2	117.1	160.4	178	0	0	0	0	108.4	Q464 T468	Q464-V466 PolarHBondContact O-N 2.97Å; V466-T468 PolarHBondContact O-N 3.42Å
467	K	34.3	Very low	50.9	Low	187 Å²	187	123.2 Å²	123.2	81%	0.813	64%	0.643	S	S	*	*			trans	-80.1	83.4	-179.7	-71.1	-169.2	175.9	-173.7	0	111.8	S465 R469	S465-K467 PolarHBondContact O-N 2.78Å; K467-R469 PolarHBondContact O-N 2.91Å
468	T	40.4	Very low	53.3	Low	117 Å²	117	114.5 Å²	114.5	72%	0.718	60%	0.602	S	S	*	*			trans	-51.1	124.3	158.8	-56.8	0	0	0	0	108.9	V466 M470	V466-T468 PolarHBondContact O-N 3.42Å; T468-M470 PolarHBondContact O-N 3.31Å
469	R	55.3	Low	55.8	Low	155 Å²	155	116 Å²	116	59%	0.585	59%	0.589	S	S	*	*			trans	-73.5	97.4	175.2	-80.9	-177.2	176	-119.9	-11.6	108.9	K467 F471 E517	K467-R469 PolarHBondContact O-N 2.91Å; R469-F471 PolarHBondContact O-N 2.91Å; R469-E517 IonicContact CZ-OE1 2.68Å; R469-E517 IonicContact CZ-OE2 2.65Å; R469-E517 IonicContact NH1-OE1 3.2Å; R469-E517 PolarHBondContact NH1-OE1 3.44Å; R469-E517 IonicContact NH1-OE2 2.96Å; R469-E517 PolarHBondContact NH1-OE2 2.57Å
470	M	64.8	Low	58.3	Low	156 Å²	156	111.4 Å²	111.4	77%	0.768	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.9	128.2	174.2	-59.1	-179.8	77.3	0	0	109.7	T468	T468-M470 PolarHBondContact O-N 3.31Å
471	F	78.4	Confident	60.8	Low	102 Å²	102	105.6 Å²	105.6	45%	0.447	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-66	149.5	158.7	-59.2	-51.1	0	0	0	108.8	R469 A475 L476 M516	R469-F471 PolarHBondContact O-N 2.91Å; F471-A475 HydrophobicContact CB-CB 3.95Å; F471-L476 HydrophobicContact CB-CD2 3.93Å; F471-L476 HydrophobicContact CB-CG 4.09Å; F471-L476 HydrophobicContact CD2-CD2 3.91Å; F471-L476 HydrophobicContact CG-CD2 4.43Å; F471-M516 HydrophobicContact CD1-CB 3.57Å; F471-M516 HydrophobicContact CD1-CG 4.47Å; F471-M516 HydrophobicContact CE1-CB 4.04Å
472	S	82.8	Confident	63.3	Low	22 Å²	22	108.1 Å²	108.1	15%	0.154	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-60.4	154.8	169.8	56.8	0	0	0	0	111	A474 A475 L476 M516 C519	S472-A474 PolarHBondContact O-N 3.25Å; S472-A475 WeakPolarHBondContact O-CB 3.47Å; S472-A475 PolarHBondContact O-N 3.36Å; S472-A475 WeakPolarHBondContact OG-CB 3.42Å; S472-A475 PolarHBondContact OG-N 2.95Å; S472-A475 VanDerWaalsContact OG-N 3.16Å; S472-L476 PolarHBondContact O-N 2.75Å; S472-L476 VanDerWaalsContact O-N 3.11Å; S472-M516 WeakPolarHBondContact CB-O 3.43Å; S472-M516 PolarHBondContact N-O 3.16Å; S472-M516 PolarHBondContact OG-O 3.32Å; S472-C519 VanDerWaalsContact CB-O 3.22Å; S472-C519 WeakPolarHBondContact CB-O 3.4Å; S472-C519 WeakPolarHBondContact OG-CB 3.48Å; S472-C519 PolarHBondContact OG-N 3.32Å; S472-C519 PolarHBondContact OG-O 3.31Å
473	R	78.7	Confident	65.5	Low	222 Å²	222	101.4 Å²	101.4	84%	0.838	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-41.4	175.3	-74.6	179.4	61.5	137.2	-0.1	111.8	L476	R473-L476 PolarHBondContact O-N 2.98Å
474	A	78.9	Confident	67.5	Low	8 Å²	8	108.3 Å²	108.3	7%	0.066	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-46.2	175.3	0	0	0	0	0	112.4	S472 L476 T477 H478 E522	S472-A474 PolarHBondContact O-N 3.25Å; A474-L476 VanDerWaalsContact C-N 3.25Å; A474-L476 PolarHBondContact O-N 3.2Å; A474-T477 PolarHBondContact O-N 3.19Å; A474-T477 VanDerWaalsContact O-N 3.14Å; A474-T477 PolarHBondContact O-OG1 3.29Å; A474-H478 PolarHBondContact O-CD2 3.21Å; A474-E522 HydrophobicContact CB-CG 3.83Å
475	A	81.8	Confident	69	Low	1 Å²	1	102.7 Å²	102.7	1%	0.008	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-59.8	-30.6	177	0	0	0	0	0	114.3	F471 S472 T477 H478 M516 C519	F471-A475 HydrophobicContact CB-CB 3.95Å; S472-A475 WeakPolarHBondContact O-CB 3.47Å; S472-A475 PolarHBondContact O-N 3.36Å; S472-A475 WeakPolarHBondContact OG-CB 3.42Å; S472-A475 PolarHBondContact OG-N 2.95Å; S472-A475 VanDerWaalsContact OG-N 3.16Å; A475-T477 PolarHBondContact O-N 3.06Å; A475-H478 PolarHBondContact O-N 3.07Å; A475-M516 HydrophobicContact CB-CB 4.02Å; A475-M516 HydrophobicContact CB-CE 3.41Å; A475-M516 VanDerWaalsContact CB-CE 3.41Å; A475-M516 VanDerWaalsContact CB-O 3.3Å; A475-M516 WeakPolarHBondContact CB-O 3.46Å; A475-C519 HydrophobicContact CB-CB 4.02Å
476	L	82.5	Confident	70.2	Confident	118 Å²	118	106 Å²	106	62%	0.618	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-69.7	-17.6	178.2	-68.9	171.4	0	0	0	113.9	F471 S472 R473 A474 H478	F471-L476 HydrophobicContact CB-CD2 3.93Å; F471-L476 HydrophobicContact CB-CG 4.09Å; F471-L476 HydrophobicContact CD2-CD2 3.91Å; F471-L476 HydrophobicContact CG-CD2 4.43Å; S472-L476 PolarHBondContact O-N 2.75Å; S472-L476 VanDerWaalsContact O-N 3.11Å; R473-L476 PolarHBondContact O-N 2.98Å; A474-L476 VanDerWaalsContact C-N 3.25Å; A474-L476 PolarHBondContact O-N 3.2Å; L476-H478 VanDerWaalsContact C-N 3.27Å; L476-H478 PolarHBondContact O-N 3.46Å
477	T	77.9	Confident	72	Confident	55 Å²	55	106.8 Å²	106.8	34%	0.337	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-77.6	-10.8	175.8	63.8	0	0	0	0	113.4	A474 A475 E522 C523	A474-T477 PolarHBondContact O-N 3.19Å; A474-T477 VanDerWaalsContact O-N 3.14Å; A474-T477 PolarHBondContact O-OG1 3.29Å; A475-T477 PolarHBondContact O-N 3.06Å; T477-E522 HydrophobicContact CG2-CB 4.49Å; T477-E522 HydrophobicContact CG2-CG 4.16Å; T477-E522 WeakPolarHBondContact OG1-CA 3.47Å; T477-C523 WeakPolarHBondContact O-CB 3.33Å; T477-C523 PolarHBondContact OG1-N 3.03Å
478	H	81.5	Confident	74.2	Confident	11 Å²	11	99.1 Å²	99.1	5%	0.051	46%	0.464	C	S	.	.	S	Bend	trans	-93.3	126.9	-179.4	-66.4	-107.8	0	0	0	110.8	A474 A475 L476 L480 C504 C507 L521 C523	A474-H478 PolarHBondContact O-CD2 3.21Å; A475-H478 PolarHBondContact O-N 3.07Å; L476-H478 VanDerWaalsContact C-N 3.27Å; L476-H478 PolarHBondContact O-N 3.46Å; H478-L480 HydrophobicContact CB-CD1 4.34Å; H478-L480 HydrophobicContact CB-CD2 3.79Å; H478-L480 HydrophobicContact CB-CG 3.81Å; H478-L480 WeakPolarHBondContact O-CG 3.28Å; H478-L480 PolarHBondContact O-N 2.84Å; H478-C504 HydrophobicContact CB-CB 4.21Å; H478-C507 VanDerWaalsContact CE1-SG 3.56Å; H478-C507 PolarHBondContact ND1-SG 3.13Å; H478-C507 VanDerWaalsContact ND1-SG 3.37Å; H478-L521 PolarHBondContact NE2-O 3.38Å; H478-C523 HydrophobicContact CB-CB 4.4Å; H478-C523 PolarHBondContact NE2-N 3.47Å
479	R	81.6	Confident	76.4	Confident	152 Å²	152	98.8 Å²	98.8	57%	0.574	45%	0.452	S	S	*	.			trans	-70.8	109.4	160.7	-175.7	-176.1	-58.4	-127	-5.3	109	C504 E505 E506	R479-C504 CarbonylContact O-C 3.26Å; R479-C504 VanDerWaalsContact O-CA 3.24Å; R479-C504 WeakPolarHBondContact O-CA 3.48Å; R479-C504 PolarHBondContact O-SG 3.49Å; R479-E505 WeakPolarHBondContact CD-OE2 3.15Å; R479-E505 HydrophobicContact CG-CB 4.31Å; R479-E505 HydrophobicContact CG-CG 4.37Å; R479-E505 PolarHBondContact O-N 2.81Å; R479-E506 HydrophobicContact CB-CG 4.1Å; R479-E506 WeakPolarHBondContact CB-OE1 3.4Å; R479-E506 IonicContact CZ-OE1 3.68Å; R479-E506 IonicContact NE-OE1 3.85Å; R479-E506 PolarHBondContact NE-OE1 3.49Å; R479-E506 IonicContact NH2-OE1 2.79Å
480	L	85	Confident	78.1	Confident	54 Å²	54	91.4 Å²	91.4	28%	0.283	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.9	-169.8	-66.8	163.8	0	0	0	112.3	H478 V502 C504 M516	H478-L480 HydrophobicContact CB-CD1 4.34Å; H478-L480 HydrophobicContact CB-CD2 3.79Å; H478-L480 HydrophobicContact CB-CG 3.81Å; H478-L480 WeakPolarHBondContact O-CG 3.28Å; H478-L480 PolarHBondContact O-N 2.84Å; L480-V502 HydrophobicContact CB-CB 4.39Å; L480-V502 HydrophobicContact CD2-CB 4.24Å; L480-V502 HydrophobicContact CD2-CG2 3.98Å; L480-C504 HydrophobicContact CD2-CB 4.23Å; L480-M516 HydrophobicContact CD1-CE 3.56Å; L480-M516 HydrophobicContact CD2-CE 4.02Å; L480-M516 HydrophobicContact CG-CE 4.41Å
481	R	84.3	Confident	79.1	Confident	114 Å²	114	89.2 Å²	89.2	43%	0.43	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	163.1	167	70.1	167.1	170.7	-117.5	-1.6	112.3	M483 V502 E503 E505	R481-M483 PolarHBondContact O-N 3.37Å; R481-V502 CarbonylContact O-C 3.54Å; R481-V502 VanDerWaalsContact O-CA 3.24Å; R481-V502 WeakPolarHBondContact O-CA 3.33Å; R481-V502 WeakPolarHBondContact O-CB 3.5Å; R481-E503 HydrophobicContact CG-CG 3.65Å; R481-E503 IonicContact CZ-OE1 3.51Å; R481-E503 VanDerWaalsContact CZ-OE1 3.25Å; R481-E503 PolarHBondContact N-O 3.45Å; R481-E503 IonicContact NE-OE1 3.22Å; R481-E503 PolarHBondContact NE-OE1 3.19Å; R481-E503 IonicContact NH2-OE1 3.51Å; R481-E503 PolarHBondContact NH2-OE1 2.9Å; R481-E503 PolarHBondContact O-N 3.3Å; R481-E505 HydrophobicContact CB-CG 4.03Å; R481-E505 VanDerWaalsContact CD-OE1 3.29Å; R481-E505 WeakPolarHBondContact CD-OE1 3.25Å; R481-E505 HydrophobicContact CG-CG 3.78Å; R481-E505 IonicContact CZ-OE1 2.65Å; R481-E505 IonicContact NE-OE1 2.73Å; R481-E505 IonicContact NH1-OE1 3.43Å; R481-E505 PolarHBondContact NH1-OE1 3.03Å
482	K	84.9	Confident	79.4	Confident	144 Å²	144	87.1 Å²	87.1	63%	0.626	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.4	171.5	-176.9	-177	178	-174.2	0	109.4
483	M	77.4	Confident	79.6	Confident	19 Å²	19	88.5 Å²	88.5	9%	0.094	41%	0.411	C	S	.	.			trans	-64.1	141.7	179.8	62.8	176.6	45.1	0	0	112.6	R481 A488 I497 E503 A510	R481-M483 PolarHBondContact O-N 3.37Å; M483-A488 HydrophobicContact CE-CB 4.07Å; M483-I497 HydrophobicContact CE-CB 4.39Å; M483-I497 HydrophobicContact CE-CD1 3.72Å; M483-I497 HydrophobicContact CE-CG2 4.01Å; M483-I497 HydrophobicContact SD-CB 4.23Å; M483-I497 HydrophobicContact SD-CG2 3.55Å; M483-I497 VanDerWaalsContact SD-CG2 3.55Å; M483-E503 VanDerWaalsContact CA-OE2 3.25Å; M483-E503 WeakPolarHBondContact CA-OE2 3.25Å; M483-E503 HydrophobicContact CB-CB 4.44Å; M483-E503 HydrophobicContact CB-CG 4.14Å; M483-E503 WeakPolarHBondContact CB-OE2 3.31Å; M483-A510 HydrophobicContact CE-CB 3.91Å
484	K	70.3	Confident	79.8	Confident	201 Å²	201	82.5 Å²	82.5	87%	0.874	40%	0.396	S	S	*	.			trans	-90.3	-27.7	172.9	-64.1	-179.8	-178.7	177.2	0	112
485	S	62.6	Low	80.2	Confident	79 Å²	79	87.3 Å²	87.3	55%	0.552	42%	0.42	S	S	*	.			trans	-76.9	143.5	-179.2	-61.1	0	0	0	0	112.8
486	K	57.1	Low	80.5	Confident	176 Å²	176	94.2 Å²	94.2	77%	0.765	45%	0.447	S	S	*	.	S	Bend	trans	-93.8	-5.4	-174.5	-67	-177.9	-179.1	174	0	115.6
487	M	70.9	Confident	80.6	Confident	150 Å²	150	88.6 Å²	88.6	74%	0.739	42%	0.418	S	S	*	.			trans	-144.5	97.8	179.6	-67.8	-178.1	70	0	0	110.4
488	A	80.8	Confident	80.5	Confident	25 Å²	25	91.1 Å²	91.1	21%	0.207	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.3	169.7	0	0	0	0	0	109.5	M483 Y496 I497 A510	M483-A488 HydrophobicContact CE-CB 4.07Å; A488-Y496 CarbonylContact O-C 3.51Å; A488-Y496 WeakPolarHBondContact O-CA 3.33Å; A488-I497 HydrophobicContact CB-CD1 4.38Å; A488-I497 WeakPolarHBondContact O-CB 3.36Å; A488-I497 PolarHBondContact O-N 3.3Å; A488-A510 HydrophobicContact CB-CB 3.87Å
489	K	87.4	Confident	80	Confident	111 Å²	111	96.3 Å²	96.3	48%	0.483	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.8	177	-159.2	-169.9	-170.3	-156.8	0	109.3	K491 D494	K489-K491 PolarHBondContact O-N 3.49Å; K489-D494 WeakPolarHBondContact CE-O 3.31Å; K489-D494 WeakPolarHBondContact CE-OD1 3.14Å; K489-D494 WeakPolarHBondContact CG-O 3.3Å; K489-D494 IonicContact NZ-OD1 2.63Å; K489-D494 PolarHBondContact NZ-OD1 3.07Å
490	C	89.5	Confident	79.5	Confident	0 Å²	0	92.1 Å²	92.1	0%	0	46%	0.459	C	S	.	.			trans	-72.7	121	179.1	179	0	0	0	0	111.1	Q492 C493 D494 N495 I497 A510 H512	C490-Q492 VanDerWaalsContact C-N 3.27Å; C490-Q492 PolarHBondContact O-N 2.75Å; C490-C493 PolarHBondContact O-N 2.9Å; C490-D494 VanDerWaalsContact O-CA 3.24Å; C490-D494 WeakPolarHBondContact O-CA 3.38Å; C490-D494 PolarHBondContact O-N 3.25Å; C490-N495 VanDerWaalsContact CB-O 3.25Å; C490-N495 WeakPolarHBondContact CB-O 3.41Å; C490-N495 PolarHBondContact N-O 2.91Å; C490-I497 HydrophobicContact CB-CD1 3.91Å; C490-I497 HydrophobicContact CB-CG1 3.8Å; C490-A510 WeakPolarHBondContact CA-O 3.41Å; C490-H512 VanDerWaalsContact CB-CE1 3.4Å; C490-H512 WeakPolarHBondContact CB-CE1 3.27Å; C490-H512 VanDerWaalsContact CB-ND1 3.33Å; C490-H512 WeakPolarHBondContact CB-ND1 3.41Å; C490-H512 PolarHBondContact SG-N 3.23Å; C490-H512 VanDerWaalsContact SG-N 3.42Å; C490-H512 PolarHBondContact SG-ND1 2.65Å; C490-H512 VanDerWaalsContact SG-ND1 3.36Å
491	K	86.2	Confident	79.5	Confident	110 Å²	110	89.5 Å²	89.5	48%	0.478	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.4	-176.4	179.3	61.7	178.6	178.5	0	114.1	K489 L509 A510 F511 L521	K489-K491 PolarHBondContact O-N 3.49Å; K491-L509 HydrophobicContact CB-CD2 4.3Å; K491-L509 HydrophobicContact CD-CD2 4.27Å; K491-L509 HydrophobicContact CG-CD1 4.26Å; K491-L509 HydrophobicContact CG-CD2 4.03Å; K491-A510 PolarHBondContact N-O 3.49Å; K491-F511 HydrophobicContact CB-CD1 4.35Å; K491-F511 HydrophobicContact CB-CE1 3.85Å; K491-F511 HydrophobicContact CB-CZ 4.2Å; K491-F511 HydrophobicContact CG-CE1 4.35Å; K491-L521 HydrophobicContact CD-CD1 4.29Å; K491-L521 HydrophobicContact CG-CD1 3.53Å
492	Q	85.9	Confident	79.6	Confident	58 Å²	58	84.9 Å²	84.9	27%	0.271	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.7	-176.9	-177.2	58.7	42.6	0	0	114.2	C490 F511 C515 V518	C490-Q492 VanDerWaalsContact C-N 3.27Å; C490-Q492 PolarHBondContact O-N 2.75Å; Q492-F511 HydrophobicContact CB-CD1 3.92Å; Q492-F511 HydrophobicContact CB-CE1 4.12Å; Q492-C515 HydrophobicContact CB-CB 3.78Å; Q492-C515 HydrophobicContact CG-CB 3.9Å; Q492-V518 HydrophobicContact CG-CG2 4.31Å; Q492-V518 PolarHBondContact NE2-O 3.24Å
493	C	86.9	Confident	79.9	Confident	50 Å²	50	79.7 Å²	79.7	34%	0.338	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	5.7	-175.4	72.3	0	0	0	0	114.6	C490 N495 H512	C490-C493 PolarHBondContact O-N 2.9Å; C493-N495 PolarHBondContact O-N 3.35Å; C493-N495 PolarHBondContact O-ND2 2.91Å; C493-H512 VanDerWaalsContact SG-CE1 3.55Å; C493-H512 PolarHBondContact SG-ND1 3.41Å; C493-H512 VanDerWaalsContact SG-ND1 3.41Å
494	D	83.3	Confident	80.3	Confident	96 Å²	96	78.9 Å²	78.9	51%	0.513	40%	0.404	S	S	.	.			trans	52.8	10.9	-179.4	-83.6	-56.4	0	0	0	116.8	K489 C490	K489-D494 WeakPolarHBondContact CE-O 3.31Å; K489-D494 WeakPolarHBondContact CE-OD1 3.14Å; K489-D494 WeakPolarHBondContact CG-O 3.3Å; K489-D494 IonicContact NZ-OD1 2.63Å; K489-D494 PolarHBondContact NZ-OD1 3.07Å; C490-D494 VanDerWaalsContact O-CA 3.24Å; C490-D494 WeakPolarHBondContact O-CA 3.38Å; C490-D494 PolarHBondContact O-N 3.25Å
495	N	86.3	Confident	80.6	Confident	110 Å²	110	73.2 Å²	73.2	59%	0.588	38%	0.38	S	S	*	.			trans	-92.4	149.2	176.8	-78.4	-90.6	0	0	0	111.6	C490 C493 H512	C490-N495 VanDerWaalsContact CB-O 3.25Å; C490-N495 WeakPolarHBondContact CB-O 3.41Å; C490-N495 PolarHBondContact N-O 2.91Å; C493-N495 PolarHBondContact O-N 3.35Å; C493-N495 PolarHBondContact O-ND2 2.91Å; N495-H512 PolarHBondContact O-CE1 3.07Å
496	Y	87.3	Confident	81	Confident	145 Å²	145	71.4 Å²	71.4	57%	0.569	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	142.3	177.8	-71.7	-81.9	0	0	0	112.6	A488 H512	A488-Y496 CarbonylContact O-C 3.51Å; A488-Y496 WeakPolarHBondContact O-CA 3.33Å; Y496-H512 PolarHBondContact O-NE2 3.29Å
497	I	85	Confident	81.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	95.5	176.6	-55.9	167.4	0	0	0	107.2	M483 A488 C490 A510	M483-I497 HydrophobicContact CE-CB 4.39Å; M483-I497 HydrophobicContact CE-CD1 3.72Å; M483-I497 HydrophobicContact CE-CG2 4.01Å; M483-I497 HydrophobicContact SD-CB 4.23Å; M483-I497 HydrophobicContact SD-CG2 3.55Å; M483-I497 VanDerWaalsContact SD-CG2 3.55Å; A488-I497 HydrophobicContact CB-CD1 4.38Å; A488-I497 WeakPolarHBondContact O-CB 3.36Å; A488-I497 PolarHBondContact O-N 3.3Å; C490-I497 HydrophobicContact CB-CD1 3.91Å; C490-I497 HydrophobicContact CB-CG1 3.8Å; I497-A510 HydrophobicContact CD1-CB 3.84Å
498	V	75.4	Confident	82.2	Confident	108 Å²	108	60.4 Å²	60.4	66%	0.655	33%	0.332	S	S	*	.			trans	-91.1	-21.5	-177.2	-172.3	0	0	0	0	111.9
499	V	70.9	Confident	82.4	Confident	120 Å²	120	61.8 Å²	61.8	73%	0.727	34%	0.335	S	S	*	.	S	Bend	trans	-143.3	123.7	-177.9	-175.9	0	0	0	0	110.7	G501	V499-G501 PolarHBondContact O-N 3.31Å
500	S	71	Confident	82.5	Confident	63 Å²	63	57.1 Å²	57.1	44%	0.441	32%	0.318	S	S	.	.	S	Bend	trans	46.4	60.9	163.7	-153.9	0	0	0	0	115.9
501	G	85.1	Confident	82.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-177.4	167.9	0	0	0	0	0	114	V499 F511	V499-G501 PolarHBondContact O-N 3.31Å; G501-F511 WeakPolarHBondContact CA-O 3.48Å
502	V	88.4	Confident	82.7	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	150.5	164.8	-68.1	0	0	0	0	109.4	L480 R481 A510 F511 R513 M516	L480-V502 HydrophobicContact CB-CB 4.39Å; L480-V502 HydrophobicContact CD2-CB 4.24Å; L480-V502 HydrophobicContact CD2-CG2 3.98Å; R481-V502 CarbonylContact O-C 3.54Å; R481-V502 VanDerWaalsContact O-CA 3.24Å; R481-V502 WeakPolarHBondContact O-CA 3.33Å; R481-V502 WeakPolarHBondContact O-CB 3.5Å; V502-A510 WeakPolarHBondContact O-CA 3.26Å; V502-F511 HydrophobicContact CG2-CB 4.19Å; V502-F511 PolarHBondContact N-O 3.24Å; V502-F511 PolarHBondContact O-N 3.03Å; V502-R513 HydrophobicContact CG1-CG 4.33Å; V502-M516 HydrophobicContact CG2-CG 4.05Å; V502-M516 HydrophobicContact CG2-SD 3.98Å
503	E	89.5	Confident	82.7	Confident	36 Å²	36	58.2 Å²	58.2	17%	0.168	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.1	171.6	61.2	-172.6	-130.4	0	0	108.4	R481 M483 L509	R481-E503 HydrophobicContact CG-CG 3.65Å; R481-E503 IonicContact CZ-OE1 3.51Å; R481-E503 VanDerWaalsContact CZ-OE1 3.25Å; R481-E503 PolarHBondContact N-O 3.45Å; R481-E503 IonicContact NE-OE1 3.22Å; R481-E503 PolarHBondContact NE-OE1 3.19Å; R481-E503 IonicContact NH2-OE1 3.51Å; R481-E503 PolarHBondContact NH2-OE1 2.9Å; R481-E503 PolarHBondContact O-N 3.3Å; M483-E503 VanDerWaalsContact CA-OE2 3.25Å; M483-E503 WeakPolarHBondContact CA-OE2 3.25Å; M483-E503 HydrophobicContact CB-CB 4.44Å; M483-E503 HydrophobicContact CB-CG 4.14Å; M483-E503 WeakPolarHBondContact CB-OE2 3.31Å; E503-L509 WeakPolarHBondContact CA-O 3.4Å
504	C	85.6	Confident	82.6	Confident	2 Å²	2	63 Å²	63	1%	0.014	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	133.6	174.2	-176.7	0	0	0	0	110.5	H478 R479 L480 E506 C507 G508 L509	H478-C504 HydrophobicContact CB-CB 4.21Å; R479-C504 CarbonylContact O-C 3.26Å; R479-C504 VanDerWaalsContact O-CA 3.24Å; R479-C504 WeakPolarHBondContact O-CA 3.48Å; R479-C504 PolarHBondContact O-SG 3.49Å; L480-C504 HydrophobicContact CD2-CB 4.23Å; C504-E506 VanDerWaalsContact C-N 3.29Å; C504-E506 PolarHBondContact SG-N 2.87Å; C504-E506 VanDerWaalsContact SG-N 3.37Å; C504-C507 VanDerWaalsContact CB-SG 3.53Å; C504-C507 VanDerWaalsContact SG-SG 3.62Å; C504-G508 WeakPolarHBondContact O-CA 3.43Å; C504-G508 PolarHBondContact O-N 2.73Å; C504-G508 VanDerWaalsContact O-N 3.08Å; C504-L509 PolarHBondContact N-O 3.25Å
505	E	77.4	Confident	82.8	Confident	81 Å²	81	59.2 Å²	59.2	38%	0.379	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.6	177.6	-57.2	-157.7	114.3	0	0	113.6	R479 R481	R479-E505 WeakPolarHBondContact CD-OE2 3.15Å; R479-E505 HydrophobicContact CG-CB 4.31Å; R479-E505 HydrophobicContact CG-CG 4.37Å; R479-E505 PolarHBondContact O-N 2.81Å; R481-E505 HydrophobicContact CB-CG 4.03Å; R481-E505 VanDerWaalsContact CD-OE1 3.29Å; R481-E505 WeakPolarHBondContact CD-OE1 3.25Å; R481-E505 HydrophobicContact CG-CG 3.78Å; R481-E505 IonicContact CZ-OE1 2.65Å; R481-E505 IonicContact NE-OE1 2.73Å; R481-E505 IonicContact NH1-OE1 3.43Å; R481-E505 PolarHBondContact NH1-OE1 3.03Å
506	E	70.6	Confident	82.6	Confident	41 Å²	41	54 Å²	54	19%	0.192	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-48.4	-173.3	-67	169.4	-167.7	0	0	111.4	R479 C504 Q525	R479-E506 HydrophobicContact CB-CG 4.1Å; R479-E506 WeakPolarHBondContact CB-OE1 3.4Å; R479-E506 IonicContact CZ-OE1 3.68Å; R479-E506 IonicContact NE-OE1 3.85Å; R479-E506 PolarHBondContact NE-OE1 3.49Å; R479-E506 IonicContact NH2-OE1 2.79Å; C504-E506 VanDerWaalsContact C-N 3.29Å; C504-E506 PolarHBondContact SG-N 2.87Å; C504-E506 VanDerWaalsContact SG-N 3.37Å; E506-Q525 PolarHBondContact OE2-NE2 3.07Å
507	C	77.3	Confident	82.5	Confident	38 Å²	38	50.4 Å²	50.4	26%	0.257	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-0.4	178.1	71.3	0	0	0	0	115	H478 C504 L509	H478-C507 VanDerWaalsContact CE1-SG 3.56Å; H478-C507 PolarHBondContact ND1-SG 3.13Å; H478-C507 VanDerWaalsContact ND1-SG 3.37Å; C504-C507 VanDerWaalsContact CB-SG 3.53Å; C504-C507 VanDerWaalsContact SG-SG 3.62Å; C507-L509 HydrophobicContact CB-CG 4.5Å; C507-L509 PolarHBondContact O-N 2.9Å
508	G	75.6	Confident	82.4	Confident	57 Å²	57	54.5 Å²	54.5	59%	0.588	30%	0.3	S	S	*	.			trans	68.8	-3.2	178.6	0	0	0	0	0	116.2	C504	C504-G508 WeakPolarHBondContact O-CA 3.43Å; C504-G508 PolarHBondContact O-N 2.73Å; C504-G508 VanDerWaalsContact O-N 3.08Å
509	L	86.7	Confident	82.7	Confident	54 Å²	54	49.6 Å²	49.6	28%	0.283	27%	0.27	S	S	.	.			trans	-67.9	134.3	-176.4	-66.8	178	0	0	0	112.1	K491 E503 C504 C507 F511	K491-L509 HydrophobicContact CB-CD2 4.3Å; K491-L509 HydrophobicContact CD-CD2 4.27Å; K491-L509 HydrophobicContact CG-CD1 4.26Å; K491-L509 HydrophobicContact CG-CD2 4.03Å; E503-L509 WeakPolarHBondContact CA-O 3.4Å; C504-L509 PolarHBondContact N-O 3.25Å; C507-L509 HydrophobicContact CB-CG 4.5Å; C507-L509 PolarHBondContact O-N 2.9Å; L509-F511 HydrophobicContact CB-CD2 4.42Å; L509-F511 HydrophobicContact CB-CE2 3.58Å; L509-F511 HydrophobicContact CB-CZ 3.95Å; L509-F511 HydrophobicContact CD1-CZ 4.24Å
510	A	88.7	Confident	83.2	Confident	14 Å²	14	52 Å²	52	12%	0.116	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.6	-179.8	0	0	0	0	0	112	M483 A488 C490 K491 I497 V502	M483-A510 HydrophobicContact CE-CB 3.91Å; A488-A510 HydrophobicContact CB-CB 3.87Å; C490-A510 WeakPolarHBondContact CA-O 3.41Å; K491-A510 PolarHBondContact N-O 3.49Å; I497-A510 HydrophobicContact CD1-CB 3.84Å; V502-A510 WeakPolarHBondContact O-CA 3.26Å
511	F	89	Confident	83.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.2	-177.7	-59.1	-88.9	0	0	0	112.6	K491 Q492 G501 V502 L509 M516	K491-F511 HydrophobicContact CB-CD1 4.35Å; K491-F511 HydrophobicContact CB-CE1 3.85Å; K491-F511 HydrophobicContact CB-CZ 4.2Å; K491-F511 HydrophobicContact CG-CE1 4.35Å; Q492-F511 HydrophobicContact CB-CD1 3.92Å; Q492-F511 HydrophobicContact CB-CE1 4.12Å; G501-F511 WeakPolarHBondContact CA-O 3.48Å; V502-F511 HydrophobicContact CG2-CB 4.19Å; V502-F511 PolarHBondContact N-O 3.24Å; V502-F511 PolarHBondContact O-N 3.03Å; L509-F511 HydrophobicContact CB-CD2 4.42Å; L509-F511 HydrophobicContact CB-CE2 3.58Å; L509-F511 HydrophobicContact CB-CZ 3.95Å; L509-F511 HydrophobicContact CD1-CZ 4.24Å; F511-M516 HydrophobicContact CB-CG 4.48Å; F511-M516 HydrophobicContact CB-SD 3.26Å; F511-M516 WeakPolarHBondContact CB-SD 3.42Å; F511-M516 HydrophobicContact CD1-SD 4.08Å; F511-M516 HydrophobicContact CD2-CE 4.18Å; F511-M516 HydrophobicContact CD2-SD 3.76Å; F511-M516 HydrophobicContact CG-CE 4.4Å; F511-M516 HydrophobicContact CG-SD 3.46Å; F511-M516 WeakPolarHBondContact CG-SD 3.42Å
512	H	90.4	Very high	83.2	Confident	46 Å²	46	58.4 Å²	58.4	21%	0.213	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	144.6	161.6	-54.1	105.2	0	0	0	109.3	C490 C493 N495 Y496 K514 C515	C490-H512 VanDerWaalsContact CB-CE1 3.4Å; C490-H512 WeakPolarHBondContact CB-CE1 3.27Å; C490-H512 VanDerWaalsContact CB-ND1 3.33Å; C490-H512 WeakPolarHBondContact CB-ND1 3.41Å; C490-H512 PolarHBondContact SG-N 3.23Å; C490-H512 VanDerWaalsContact SG-N 3.42Å; C490-H512 PolarHBondContact SG-ND1 2.65Å; C490-H512 VanDerWaalsContact SG-ND1 3.36Å; C493-H512 VanDerWaalsContact SG-CE1 3.55Å; C493-H512 PolarHBondContact SG-ND1 3.41Å; C493-H512 VanDerWaalsContact SG-ND1 3.41Å; N495-H512 PolarHBondContact O-CE1 3.07Å; Y496-H512 PolarHBondContact O-NE2 3.29Å; H512-K514 PolarHBondContact O-N 3.16Å; H512-K514 VanDerWaalsContact O-N 3.11Å; H512-C515 HydrophobicContact CB-CB 4.4Å; H512-C515 WeakPolarHBondContact O-CA 3.23Å; H512-C515 WeakPolarHBondContact O-CB 3.46Å; H512-C515 PolarHBondContact O-N 3.43Å
513	R	86.4	Confident	82.5	Confident	144 Å²	144	58.3 Å²	58.3	54%	0.543	30%	0.298	S	S	.	.	H	α-helix	trans	-50.4	-40	175.8	-73.1	-177.9	168.2	-149.4	-8.6	113.6	V502 C515 M516	V502-R513 HydrophobicContact CG1-CG 4.33Å; R513-C515 VanDerWaalsContact C-N 3.29Å; R513-C515 PolarHBondContact O-N 3.12Å; R513-M516 PolarHBondContact O-N 3.42Å
514	K	84.8	Confident	81.1	Confident	152 Å²	152	64.9 Å²	64.9	66%	0.661	33%	0.328	S	S	*	.	H	α-helix	trans	-67.6	-22	176.2	-66.7	-176.5	-179.7	178.4	0	114.7	H512 E517	H512-K514 PolarHBondContact O-N 3.16Å; H512-K514 VanDerWaalsContact O-N 3.11Å; K514-E517 WeakPolarHBondContact CA-OE1 3.35Å
515	C	87.7	Confident	79.6	Confident	15 Å²	15	71.2 Å²	71.2	10%	0.101	36%	0.358	C	S	.	.	H	α-helix	trans	-79.2	-22.6	177.7	-71.4	0	0	0	0	112.1	Q492 H512 R513 E517 V518 C519	Q492-C515 HydrophobicContact CB-CB 3.78Å; Q492-C515 HydrophobicContact CG-CB 3.9Å; H512-C515 HydrophobicContact CB-CB 4.4Å; H512-C515 WeakPolarHBondContact O-CA 3.23Å; H512-C515 WeakPolarHBondContact O-CB 3.46Å; H512-C515 PolarHBondContact O-N 3.43Å; R513-C515 VanDerWaalsContact C-N 3.29Å; R513-C515 PolarHBondContact O-N 3.12Å; C515-E517 VanDerWaalsContact C-N 3.26Å; C515-E517 PolarHBondContact O-N 3.15Å; C515-V518 CarbonylContact O-C 3.57Å; C515-V518 WeakPolarHBondContact O-CG2 3.29Å; C515-V518 PolarHBondContact O-N 3.5Å; C515-V518 VanDerWaalsContact O-N 3.09Å; C515-C519 PolarHBondContact O-N 3.1Å
516	M	80.9	Confident	78.1	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-65.9	-29.5	175.7	-53.8	-47.5	-64.8	0	0	112.5	F471 S472 A475 L480 V502 F511 R513 V518	F471-M516 HydrophobicContact CD1-CB 3.57Å; F471-M516 HydrophobicContact CD1-CG 4.47Å; F471-M516 HydrophobicContact CE1-CB 4.04Å; S472-M516 WeakPolarHBondContact CB-O 3.43Å; S472-M516 PolarHBondContact N-O 3.16Å; S472-M516 PolarHBondContact OG-O 3.32Å; A475-M516 HydrophobicContact CB-CB 4.02Å; A475-M516 HydrophobicContact CB-CE 3.41Å; A475-M516 VanDerWaalsContact CB-CE 3.41Å; A475-M516 VanDerWaalsContact CB-O 3.3Å; A475-M516 WeakPolarHBondContact CB-O 3.46Å; L480-M516 HydrophobicContact CD1-CE 3.56Å; L480-M516 HydrophobicContact CD2-CE 4.02Å; L480-M516 HydrophobicContact CG-CE 4.41Å; V502-M516 HydrophobicContact CG2-CG 4.05Å; V502-M516 HydrophobicContact CG2-SD 3.98Å; F511-M516 HydrophobicContact CB-CG 4.48Å; F511-M516 HydrophobicContact CB-SD 3.26Å; F511-M516 WeakPolarHBondContact CB-SD 3.42Å; F511-M516 HydrophobicContact CD1-SD 4.08Å; F511-M516 HydrophobicContact CD2-CE 4.18Å; F511-M516 HydrophobicContact CD2-SD 3.76Å; F511-M516 HydrophobicContact CG-CE 4.4Å; F511-M516 HydrophobicContact CG-SD 3.46Å; F511-M516 WeakPolarHBondContact CG-SD 3.42Å; R513-M516 PolarHBondContact O-N 3.42Å; M516-V518 PolarHBondContact O-N 3.35Å
517	E	85.4	Confident	77.2	Confident	69 Å²	69	78.9 Å²	78.9	32%	0.322	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.3	173.2	-67.9	160.1	-125.7	0	0	112.3	R469 K514 C515	R469-E517 IonicContact CZ-OE1 2.68Å; R469-E517 IonicContact CZ-OE2 2.65Å; R469-E517 IonicContact NH1-OE1 3.2Å; R469-E517 PolarHBondContact NH1-OE1 3.44Å; R469-E517 IonicContact NH1-OE2 2.96Å; R469-E517 PolarHBondContact NH1-OE2 2.57Å; K514-E517 WeakPolarHBondContact CA-OE1 3.35Å; C515-E517 VanDerWaalsContact C-N 3.26Å; C515-E517 PolarHBondContact O-N 3.15Å
518	V	83.9	Confident	76.4	Confident	88 Å²	88	78 Å²	78	53%	0.533	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	16	-175.8	-62.2	0	0	0	0	113.7	Q492 C515 M516	Q492-V518 HydrophobicContact CG-CG2 4.31Å; Q492-V518 PolarHBondContact NE2-O 3.24Å; C515-V518 CarbonylContact O-C 3.57Å; C515-V518 WeakPolarHBondContact O-CG2 3.29Å; C515-V518 PolarHBondContact O-N 3.5Å; C515-V518 VanDerWaalsContact O-N 3.09Å; M516-V518 PolarHBondContact O-N 3.35Å
519	C	80.6	Confident	76.5	Confident	4 Å²	4	79 Å²	79	3%	0.027	38%	0.382	C	S	.	.			trans	-65.5	141.4	178.6	-163.5	0	0	0	0	110.6	S472 A475 C515 L521	S472-C519 VanDerWaalsContact CB-O 3.22Å; S472-C519 WeakPolarHBondContact CB-O 3.4Å; S472-C519 WeakPolarHBondContact OG-CB 3.48Å; S472-C519 PolarHBondContact OG-N 3.32Å; S472-C519 PolarHBondContact OG-O 3.31Å; A475-C519 HydrophobicContact CB-CB 4.02Å; C515-C519 PolarHBondContact O-N 3.1Å; C519-L521 PolarHBondContact SG-N 2.93Å
520	Q	82.3	Confident	76.3	Confident	172 Å²	172	76.5 Å²	76.5	80%	0.804	37%	0.369	S	S	*	.			trans	-120.7	0.7	173.2	-63.6	-179.2	0.2	0	0	112.3
521	L	76.6	Confident	76.3	Confident	67 Å²	67	76.9 Å²	76.9	35%	0.351	37%	0.368	S	S	.	.			trans	-94.3	108.1	178.5	-60.8	172.5	0	0	0	109	H478 K491 C519	H478-L521 PolarHBondContact NE2-O 3.38Å; K491-L521 HydrophobicContact CD-CD1 4.29Å; K491-L521 HydrophobicContact CG-CD1 3.53Å; C519-L521 PolarHBondContact SG-N 2.93Å
522	E	79.5	Confident	76.1	Confident	130 Å²	130	78.1 Å²	78.1	61%	0.607	38%	0.38	S	S	*	.			trans	-66.7	158.1	167.7	-75.1	173.6	176.1	0	0	110	A474 T477 E524	A474-E522 HydrophobicContact CB-CG 3.83Å; T477-E522 HydrophobicContact CG2-CB 4.49Å; T477-E522 HydrophobicContact CG2-CG 4.16Å; T477-E522 WeakPolarHBondContact OG1-CA 3.47Å; E522-E524 PolarHBondContact O-N 3.41Å
523	C	74.2	Confident	76	Confident	14 Å²	14	77.2 Å²	77.2	10%	0.095	38%	0.378	C	S	.	.			trans	-79.1	104.7	-179.5	-163.6	0	0	0	0	108.4	T477 H478 Q525	T477-C523 WeakPolarHBondContact O-CB 3.33Å; T477-C523 PolarHBondContact OG1-N 3.03Å; H478-C523 HydrophobicContact CB-CB 4.4Å; H478-C523 PolarHBondContact NE2-N 3.47Å; C523-Q525 VanDerWaalsContact C-N 3.25Å; C523-Q525 PolarHBondContact O-N 3.17Å
524	E	59.6	Low	76	Confident	173 Å²	173	72.5 Å²	72.5	81%	0.808	36%	0.364	S	S	*	.			trans	-65.8	90.3	166.9	-69.5	175.2	-171.4	0	0	108.1	E522 K526	E522-E524 PolarHBondContact O-N 3.41Å; E524-K526 VanDerWaalsContact C-N 3.27Å; E524-K526 PolarHBondContact O-N 3.13Å
525	Q	53.4	Low	76.2	Confident	136 Å²	136	65.3 Å²	65.3	64%	0.636	33%	0.332	S	S	*	.			trans	-69.6	83.2	-178.2	-76.8	-174.9	-43.5	0	0	111	E506 C523	E506-Q525 PolarHBondContact OE2-NE2 3.07Å; C523-Q525 VanDerWaalsContact C-N 3.25Å; C523-Q525 PolarHBondContact O-N 3.17Å
526	K	46.8	Very low	76.1	Confident	127 Å²	127	66.9 Å²	66.9	55%	0.552	34%	0.344	S	S	*	.			trans	-134	88.7	156.3	-75.4	-159.9	172.9	-163.4	0	111.5	E524 E585	E524-K526 VanDerWaalsContact C-N 3.27Å; E524-K526 PolarHBondContact O-N 3.13Å; K526-E585 PolarHBondContact NZ-O 2.91Å; K526-E585 VanDerWaalsContact NZ-O 3.1Å
527	K	50.7	Low	76.3	Confident	156 Å²	156	70.6 Å²	70.6	68%	0.678	37%	0.366	S	S	*	.	S	Bend		-58.6	142	120.3	-83.3	-166.7	174	-169.2	0	106.7
528	G	61.7	Low	76.3	Confident	19 Å²	19	68 Å²	68	20%	0.196	36%	0.355	C	S	.	.			trans	-52.7	151.9	-177.9	0	0	0	0	0	113.3	V533 E585	G528-V533 WeakPolarHBondContact O-CG2 3.41Å; G528-E585 WeakPolarHBondContact CA-OE1 3.47Å; G528-E585 WeakPolarHBondContact CA-OE2 3.4Å
529	T	76.3	Confident	76.2	Confident	79 Å²	79	64.7 Å²	64.7	49%	0.485	33%	0.334	S	S	.	.	S	Bend	trans	-77.6	-5.9	158.4	47.1	0	0	0	0	112.8	E585	T529-E585 WeakPolarHBondContact CA-OE2 3.41Å; T529-E585 PolarHBondContact N-OE1 3.43Å; T529-E585 PolarHBondContact N-OE2 3.01Å; T529-E585 PolarHBondContact OG1-OE2 3.26Å
530	V	82.5	Confident	75.7	Confident	1 Å²	1	72 Å²	72	1%	0.006	37%	0.367	C	S	.	.	S	Bend	trans	-133.4	-47.9	-172.4	-166	0	0	0	0	111.7	I538 F548 V549 E585 F608	V530-I538 WeakPolarHBondContact O-CD1 3.17Å; V530-F548 HydrophobicContact CB-CZ 4.3Å; V530-F548 HydrophobicContact CG1-CE1 4.2Å; V530-F548 HydrophobicContact CG1-CE2 4.14Å; V530-F548 HydrophobicContact CG1-CZ 3.51Å; V530-F548 HydrophobicContact CG2-CZ 3.72Å; V530-V549 HydrophobicContact CG1-CG2 3.34Å; V530-E585 WeakPolarHBondContact CA-OE1 3.41Å; V530-E585 VanDerWaalsContact CB-OE1 3.28Å; V530-E585 WeakPolarHBondContact CB-OE1 3.26Å; V530-E585 PolarHBondContact N-OE1 3.29Å; V530-E585 PolarHBondContact N-OE2 3.14Å; V530-F608 HydrophobicContact CG1-CE2 4.41Å
531	F	88.6	Confident	74.8	Confident	22 Å²	22	70.1 Å²	70.1	10%	0.096	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	129.4	178.4	-62.5	-92.8	0	0	0	111.2	V549 C581 F584 E585 I604 F608	F531-V549 HydrophobicContact CZ-CG1 4.32Å; F531-C581 HydrophobicContact CD2-CB 4.2Å; F531-C581 HydrophobicContact CE2-CB 3.94Å; F531-C581 HydrophobicContact CZ-CB 4.28Å; F531-F584 HydrophobicContact CE2-CB 3.87Å; F531-F584 HydrophobicContact CZ-CB 4.4Å; F531-F584 HydrophobicContact CZ-CD2 4.38Å; F531-E585 HydrophobicContact CD2-CG 4.11Å; F531-E585 PolarHBondContact N-OE1 2.87Å; F531-I604 HydrophobicContact CE1-CG2 4.13Å; F531-I604 HydrophobicContact CZ-CG2 3.88Å; F531-F608 HydrophobicContact CD1-CB 4.33Å; F531-F608 HydrophobicContact CD1-CD2 4.26Å; F531-F608 HydrophobicContact CE1-CB 3.98Å; F531-F608 HydrophobicContact CE1-CD2 4.26Å
532	G	86.1	Confident	74.2	Confident	26 Å²	26	69 Å²	69	27%	0.268	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	16.6	-177.8	0	0	0	0	0	114.7	E611	G532-E611 WeakPolarHBondContact CA-O 3.38Å
533	V	87.2	Confident	73.2	Confident	27 Å²	27	69 Å²	69	16%	0.164	37%	0.37	C	S	.	.	S	Bend	trans	-104.5	151.6	174.5	-176	0	0	0	0	109.1	G528 V537 I538 P613	G528-V533 WeakPolarHBondContact O-CG2 3.41Å; V533-V537 HydrophobicContact CG1-CB 3.9Å; V533-V537 HydrophobicContact CG1-CG1 3.89Å; V533-I538 HydrophobicContact CB-CD1 4.07Å; V533-I538 HydrophobicContact CB-CG1 3.92Å; V533-I538 HydrophobicContact CG1-CG1 3.9Å; V533-P613 WeakPolarHBondContact O-CD 3.39Å
534	D	87.3	Confident	72.7	Confident	45 Å²	45	71.3 Å²	71.3	24%	0.241	38%	0.382	C	S	.	.			trans	-66.8	144.9	174.7	175.3	-111.7	0	0	0	112.2	S536 V537 I538 Y665	D534-S536 VanDerWaalsContact C-N 3.29Å; D534-S536 PolarHBondContact O-N 3.4Å; D534-S536 WeakPolarHBondContact OD1-CA 3.43Å; D534-S536 WeakPolarHBondContact OD1-CB 3.07Å; D534-S536 PolarHBondContact OD1-N 2.93Å; D534-S536 PolarHBondContact OD1-OG 3.16Å; D534-V537 HydrophobicContact CB-CG2 4.33Å; D534-V537 PolarHBondContact O-N 3.42Å; D534-V537 VanDerWaalsContact O-N 3.13Å; D534-I538 WeakPolarHBondContact O-CG1 3.46Å; D534-I538 PolarHBondContact O-N 3.03Å; D534-I538 VanDerWaalsContact O-N 3.12Å; D534-Y665 PolarHBondContact OD2-OH 2.94Å
535	L	88.6	Confident	73.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-36.8	-176	-169.5	63	0	0	0	112.4	V537 I538 L539 P547 L616 Y665	L535-V537 VanDerWaalsContact C-N 3.29Å; L535-V537 PolarHBondContact O-N 3.29Å; L535-I538 PolarHBondContact O-N 3.01Å; L535-L539 HydrophobicContact CD1-CD1 4.15Å; L535-L539 HydrophobicContact CG-CD1 4.01Å; L535-L539 WeakPolarHBondContact O-CG 3.44Å; L535-L539 PolarHBondContact O-N 3.29Å; L535-P547 HydrophobicContact CD1-CG 3.37Å; L535-L616 HydrophobicContact CD2-CD1 4.07Å; L535-Y665 HydrophobicContact CB-CE1 4.24Å; L535-Y665 HydrophobicContact CB-CE2 3.82Å; L535-Y665 HydrophobicContact CD2-CD1 3.78Å; L535-Y665 HydrophobicContact CD2-CD2 3.84Å; L535-Y665 HydrophobicContact CD2-CE1 3.91Å; L535-Y665 HydrophobicContact CD2-CE2 3.98Å; L535-Y665 HydrophobicContact CD2-CG 3.71Å; L535-Y665 HydrophobicContact CG-CE2 4.43Å
536	S	86.1	Confident	75.4	Confident	49 Å²	49	62.7 Å²	62.7	34%	0.343	34%	0.342	S	S	.	.	H	α-helix	trans	-63.8	-36	178.2	-27.3	0	0	0	0	111.9	D534 Q540 H664	D534-S536 VanDerWaalsContact C-N 3.29Å; D534-S536 PolarHBondContact O-N 3.4Å; D534-S536 WeakPolarHBondContact OD1-CA 3.43Å; D534-S536 WeakPolarHBondContact OD1-CB 3.07Å; D534-S536 PolarHBondContact OD1-N 2.93Å; D534-S536 PolarHBondContact OD1-OG 3.16Å; S536-Q540 PolarHBondContact O-N 2.81Å; S536-H664 PolarHBondContact OG-NE2 3.48Å
537	V	85.3	Confident	77.5	Confident	79 Å²	79	56.7 Å²	56.7	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-77	-38.8	-179.6	179.6	0	0	0	0	111.1	V533 D534 L535 L539 Q540	V533-V537 HydrophobicContact CG1-CB 3.9Å; V533-V537 HydrophobicContact CG1-CG1 3.89Å; D534-V537 HydrophobicContact CB-CG2 4.33Å; D534-V537 PolarHBondContact O-N 3.42Å; D534-V537 VanDerWaalsContact O-N 3.13Å; L535-V537 VanDerWaalsContact C-N 3.29Å; L535-V537 PolarHBondContact O-N 3.29Å; V537-L539 PolarHBondContact O-N 3.35Å; V537-Q540 PolarHBondContact O-N 3.16Å
538	I	84.6	Confident	79.5	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.077	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-34.3	176.3	-65.7	165.4	0	0	0	111.3	V530 V533 D534 L535 P547 F608 L612	V530-I538 WeakPolarHBondContact O-CD1 3.17Å; V533-I538 HydrophobicContact CB-CD1 4.07Å; V533-I538 HydrophobicContact CB-CG1 3.92Å; V533-I538 HydrophobicContact CG1-CG1 3.9Å; D534-I538 WeakPolarHBondContact O-CG1 3.46Å; D534-I538 PolarHBondContact O-N 3.03Å; D534-I538 VanDerWaalsContact O-N 3.12Å; L535-I538 PolarHBondContact O-N 3.01Å; I538-P547 HydrophobicContact CG2-CB 4.15Å; I538-P547 HydrophobicContact CG2-CG 4.47Å; I538-F608 HydrophobicContact CD1-CE2 3.92Å; I538-F608 HydrophobicContact CD1-CZ 3.96Å; I538-L612 HydrophobicContact CD1-CD2 4.41Å
539	L	82.8	Confident	81	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-92.9	-8.5	-176.3	-65.2	170.2	0	0	0	114.2	L535 V537 D541 T542 P547 H664	L535-L539 HydrophobicContact CD1-CD1 4.15Å; L535-L539 HydrophobicContact CG-CD1 4.01Å; L535-L539 WeakPolarHBondContact O-CG 3.44Å; L535-L539 PolarHBondContact O-N 3.29Å; V537-L539 PolarHBondContact O-N 3.35Å; L539-D541 PolarHBondContact O-N 3.37Å; L539-T542 WeakPolarHBondContact CA-OG1 3.31Å; L539-T542 PolarHBondContact O-N 3.46Å; L539-T542 VanDerWaalsContact O-N 3.11Å; L539-T542 PolarHBondContact O-OG1 3.01Å; L539-P547 HydrophobicContact CD1-CG 4.48Å; L539-P547 HydrophobicContact CD2-CB 4.47Å; L539-P547 HydrophobicContact CD2-CG 4.03Å; L539-P547 HydrophobicContact CG-CG 4.36Å; L539-H664 HydrophobicContact CD1-CB 3.46Å; L539-H664 VanDerWaalsContact CD1-CB 3.46Å
540	Q	69.6	Low	81.9	Confident	156 Å²	156	45.5 Å²	45.5	73%	0.729	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.7	-177	-169.9	170.9	6.8	0	0	113.5	S536 V537	S536-Q540 PolarHBondContact O-N 2.81Å; V537-Q540 PolarHBondContact O-N 3.16Å
541	D	62.7	Low	82.4	Confident	133 Å²	133	48.6 Å²	48.6	71%	0.711	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-4.1	179	-77.4	-13.7	0	0	0	113.7	L539 K588	L539-D541 PolarHBondContact O-N 3.37Å; D541-K588 IonicContact OD2-NZ 3.74Å
542	T	63.8	Low	82.7	Confident	44 Å²	44	49.1 Å²	49.1	27%	0.27	27%	0.273	S	S	.	.			trans	-121.9	139.9	-169.3	53.9	0	0	0	0	113.6	L539 D544	L539-T542 WeakPolarHBondContact CA-OG1 3.31Å; L539-T542 PolarHBondContact O-N 3.46Å; L539-T542 VanDerWaalsContact O-N 3.11Å; L539-T542 PolarHBondContact O-OG1 3.01Å; T542-D544 PolarHBondContact O-N 3.04Å
543	P	59.1	Low	83.2	Confident	130 Å²	130	47.9 Å²	47.9	84%	0.844	26%	0.26	S	S	*	.	S	Bend	trans	-76	-7.5	174.5	34.2	-37	0	0	0	113.4
544	D	63.8	Low	83.6	Confident	63 Å²	63	46.6 Å²	46.6	34%	0.337	25%	0.253	S	S	.	.	S	Bend	trans	-91.8	137.3	-179.9	-54.2	-86.8	0	0	0	111.1	T542 V546 R551	T542-D544 PolarHBondContact O-N 3.04Å; D544-V546 PolarHBondContact O-N 3.24Å; D544-R551 IonicContact OD1-CZ 3.18Å; D544-R551 IonicContact OD1-NH1 3.25Å; D544-R551 PolarHBondContact OD1-NH1 2.93Å; D544-R551 IonicContact OD1-NH2 2.85Å; D544-R551 IonicContact OD2-CZ 2.75Å; D544-R551 IonicContact OD2-NH1 3.63Å; D544-R551 PolarHBondContact OD2-NH1 3.13Å; D544-R551 IonicContact OD2-NH2 3.47Å; D544-R551 PolarHBondContact OD2-NH2 3.14Å
545	E	78.9	Confident	84	Confident	113 Å²	113	48.5 Å²	48.5	53%	0.528	26%	0.263	S	S	.	.	S	Bend	trans	-76.9	-0	179.6	-57.1	-170	174.4	0	0	114.6	S667 T668	E545-S667 VanDerWaalsContact OE2-CB 3.28Å; E545-S667 WeakPolarHBondContact OE2-CB 3.3Å; E545-S667 PolarHBondContact OE2-OG 2.74Å; E545-T668 PolarHBondContact O-OG1 3.5Å
546	V	90.9	Very high	84.4	Confident	15 Å²	15	50.2 Å²	50.2	9%	0.091	27%	0.271	C	S	.	.	S	Bend	trans	-131.6	128	-172.7	-176	0	0	0	0	110.7	D544 V550 R551 Y671	D544-V546 PolarHBondContact O-N 3.24Å; V546-V550 HydrophobicContact CG1-CB 4.09Å; V546-V550 HydrophobicContact CG1-CG1 3.96Å; V546-R551 HydrophobicContact CB-CG 4.23Å; V546-R551 HydrophobicContact CG1-CG 3.92Å; V546-R551 PolarHBondContact O-NE 3.34Å; V546-Y671 HydrophobicContact CG1-CD1 3.68Å; V546-Y671 HydrophobicContact CG1-CE1 4.21Å; V546-Y671 HydrophobicContact CG1-CG 3.96Å; V546-Y671 HydrophobicContact CG2-CG 4.23Å
547	P	92.1	Very high	84.9	Confident	1 Å²	1	48 Å²	48	1%	0.006	26%	0.255	C	S	.	.			trans	-58.1	143.2	-173.4	-26.6	33.3	0	0	0	113.7	L535 I538 L539 V549 V550 R551 F608 T668	L535-P547 HydrophobicContact CD1-CG 3.37Å; I538-P547 HydrophobicContact CG2-CB 4.15Å; I538-P547 HydrophobicContact CG2-CG 4.47Å; L539-P547 HydrophobicContact CD1-CG 4.48Å; L539-P547 HydrophobicContact CD2-CB 4.47Å; L539-P547 HydrophobicContact CD2-CG 4.03Å; L539-P547 HydrophobicContact CG-CG 4.36Å; P547-V549 VanDerWaalsContact C-N 3.27Å; P547-V549 PolarHBondContact O-N 3.19Å; P547-V550 HydrophobicContact CB-CG2 4.12Å; P547-V550 HydrophobicContact CG-CG2 4.28Å; P547-V550 WeakPolarHBondContact O-CB 3.25Å; P547-V550 PolarHBondContact O-N 2.94Å; P547-R551 PolarHBondContact O-N 2.76Å; P547-R551 VanDerWaalsContact O-N 3.09Å; P547-F608 HydrophobicContact CB-CE1 4.3Å; P547-F608 HydrophobicContact CB-CZ 3.93Å; P547-F608 HydrophobicContact CG-CE1 4.18Å; P547-F608 HydrophobicContact CG-CZ 3.98Å; P547-T668 VanDerWaalsContact CD-OG1 3.29Å; P547-T668 WeakPolarHBondContact CD-OG1 3.35Å
548	F	90.8	Very high	85.4	Confident	19 Å²	19	46.1 Å²	46.1	8%	0.083	24%	0.241	C	C	.	.	H	α-helix	trans	-57.3	-37.3	178.6	65.7	-89	0	0	0	112.7	V530 V550 R551 C552 F584 K588 D589	V530-F548 HydrophobicContact CB-CZ 4.3Å; V530-F548 HydrophobicContact CG1-CE1 4.2Å; V530-F548 HydrophobicContact CG1-CE2 4.14Å; V530-F548 HydrophobicContact CG1-CZ 3.51Å; V530-F548 HydrophobicContact CG2-CZ 3.72Å; F548-V550 VanDerWaalsContact C-N 3.29Å; F548-V550 PolarHBondContact O-N 3.49Å; F548-R551 PolarHBondContact O-N 2.91Å; F548-C552 VanDerWaalsContact O-CB 3.29Å; F548-C552 WeakPolarHBondContact O-CB 3.18Å; F548-C552 PolarHBondContact O-N 3.39Å; F548-C552 PolarHBondContact O-SG 2.89Å; F548-F584 HydrophobicContact CD2-CD1 4.44Å; F548-F584 HydrophobicContact CE2-CD1 4.08Å; F548-K588 VanDerWaalsContact CD2-C 3.48Å; F548-K588 VanDerWaalsContact CD2-O 3.27Å; F548-K588 WeakPolarHBondContact CD2-O 3.44Å; F548-K588 HydrophobicContact CE2-CB 4.16Å; F548-K588 WeakPolarHBondContact CE2-O 3.48Å; F548-K588 HydrophobicContact CZ-CB 4.06Å; F548-K588 HydrophobicContact CZ-CG 4.33Å; F548-D589 HydrophobicContact CB-CB 4.29Å; F548-D589 HydrophobicContact CG-CB 4.47Å
549	V	93.4	Very high	85.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-42.2	175.2	-178.4	0	0	0	0	111.5	V530 F531 P547 C553 F584 I604 F608	V530-V549 HydrophobicContact CG1-CG2 3.34Å; F531-V549 HydrophobicContact CZ-CG1 4.32Å; P547-V549 VanDerWaalsContact C-N 3.27Å; P547-V549 PolarHBondContact O-N 3.19Å; V549-C553 VanDerWaalsContact O-CB 3.3Å; V549-C553 WeakPolarHBondContact O-CB 3.46Å; V549-C553 PolarHBondContact O-N 3.06Å; V549-C553 VanDerWaalsContact O-N 3.11Å; V549-C553 PolarHBondContact O-SG 2.87Å; V549-F584 HydrophobicContact CG1-CE1 4.49Å; V549-F584 HydrophobicContact CG1-CZ 4.47Å; V549-F584 HydrophobicContact CG2-CD1 3.97Å; V549-F584 HydrophobicContact CG2-CE1 4.33Å; V549-F584 HydrophobicContact CG2-CG 4.37Å; V549-I604 HydrophobicContact CG1-CG2 3.98Å; V549-F608 HydrophobicContact CB-CD2 4.23Å; V549-F608 HydrophobicContact CB-CE2 4.45Å; V549-F608 HydrophobicContact CG1-CB 4.26Å; V549-F608 HydrophobicContact CG1-CD2 4.18Å; V549-F608 HydrophobicContact CG1-CG 4.21Å; V549-F608 HydrophobicContact CG2-CD2 4.44Å
550	V	95.5	Very high	86.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-55.2	178.1	179.2	0	0	0	0	109	V546 P547 F548 C552 C553 T554 L605 F608 F609 T668 Y671	V546-V550 HydrophobicContact CG1-CB 4.09Å; V546-V550 HydrophobicContact CG1-CG1 3.96Å; P547-V550 HydrophobicContact CB-CG2 4.12Å; P547-V550 HydrophobicContact CG-CG2 4.28Å; P547-V550 WeakPolarHBondContact O-CB 3.25Å; P547-V550 PolarHBondContact O-N 2.94Å; F548-V550 VanDerWaalsContact C-N 3.29Å; F548-V550 PolarHBondContact O-N 3.49Å; V550-C552 PolarHBondContact O-N 3.35Å; V550-C553 PolarHBondContact O-N 3.24Å; V550-T554 HydrophobicContact CG1-CG2 4.38Å; V550-T554 WeakPolarHBondContact O-CG2 3.44Å; V550-T554 PolarHBondContact O-N 3.08Å; V550-T554 PolarHBondContact O-OG1 3.48Å; V550-L605 HydrophobicContact CB-CD1 4.19Å; V550-L605 HydrophobicContact CG1-CD1 4.18Å; V550-L605 HydrophobicContact CG2-CD1 4.09Å; V550-F608 HydrophobicContact CG2-CD1 3.86Å; V550-F608 HydrophobicContact CG2-CE1 3.68Å; V550-F609 HydrophobicContact CB-CZ 4.48Å; V550-F609 HydrophobicContact CG1-CZ 4.08Å; V550-F609 HydrophobicContact CG2-CE1 4.08Å; V550-F609 HydrophobicContact CG2-CE2 4.2Å; V550-F609 HydrophobicContact CG2-CZ 3.52Å; V550-T668 HydrophobicContact CG2-CG2 4.39Å; V550-Y671 HydrophobicContact CG1-CD1 3.8Å; V550-Y671 HydrophobicContact CG1-CE1 3.94Å
551	R	93.8	Very high	87.7	Confident	66 Å²	66	45.7 Å²	45.7	25%	0.249	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-46.4	-178.4	-63.3	-171.1	-68.3	162.6	-3.7	113.7	D544 V546 P547 F548 C553 T554 N555 Y671	D544-R551 IonicContact OD1-CZ 3.18Å; D544-R551 IonicContact OD1-NH1 3.25Å; D544-R551 PolarHBondContact OD1-NH1 2.93Å; D544-R551 IonicContact OD1-NH2 2.85Å; D544-R551 IonicContact OD2-CZ 2.75Å; D544-R551 IonicContact OD2-NH1 3.63Å; D544-R551 PolarHBondContact OD2-NH1 3.13Å; D544-R551 IonicContact OD2-NH2 3.47Å; D544-R551 PolarHBondContact OD2-NH2 3.14Å; V546-R551 HydrophobicContact CB-CG 4.23Å; V546-R551 HydrophobicContact CG1-CG 3.92Å; V546-R551 PolarHBondContact O-NE 3.34Å; P547-R551 PolarHBondContact O-N 2.76Å; P547-R551 VanDerWaalsContact O-N 3.09Å; F548-R551 PolarHBondContact O-N 2.91Å; R551-C553 PolarHBondContact O-N 2.66Å; R551-T554 WeakPolarHBondContact CA-OG1 3.49Å; R551-T554 PolarHBondContact O-OG1 2.79Å; R551-T554 VanDerWaalsContact O-OG1 3.11Å; R551-N555 WeakPolarHBondContact O-CB 3.25Å; R551-N555 PolarHBondContact O-N 3.31Å; R551-N555 PolarHBondContact O-ND2 3.27Å; R551-N555 PolarHBondContact O-OD1 3.34Å; R551-Y671 HydrophobicContact CG-CE1 4.07Å
552	C	93.8	Very high	89.2	Confident	33 Å²	33	41.4 Å²	41.4	22%	0.223	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-42.5	179.3	-67.1	0	0	0	0	111.2	F548 V550 E556 F584 L593	F548-C552 VanDerWaalsContact O-CB 3.29Å; F548-C552 WeakPolarHBondContact O-CB 3.18Å; F548-C552 PolarHBondContact O-N 3.39Å; F548-C552 PolarHBondContact O-SG 2.89Å; V550-C552 PolarHBondContact O-N 3.35Å; C552-E556 VanDerWaalsContact O-CB 3.27Å; C552-E556 WeakPolarHBondContact O-CB 3.38Å; C552-E556 PolarHBondContact O-N 3.27Å; C552-F584 HydrophobicContact CB-CE1 4.32Å; C552-L593 HydrophobicContact CB-CD1 4.06Å; C552-L593 WeakPolarHBondContact O-CD1 3.33Å
553	C	96.7	Very high	90.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69	-44.9	177.5	-70.7	0	0	0	0	112.9	V549 V550 R551 E556 I557 I601 L605	V549-C553 VanDerWaalsContact O-CB 3.3Å; V549-C553 WeakPolarHBondContact O-CB 3.46Å; V549-C553 PolarHBondContact O-N 3.06Å; V549-C553 VanDerWaalsContact O-N 3.11Å; V549-C553 PolarHBondContact O-SG 2.87Å; V550-C553 PolarHBondContact O-N 3.24Å; R551-C553 PolarHBondContact O-N 2.66Å; C553-E556 PolarHBondContact O-N 3.33Å; C553-I557 WeakPolarHBondContact O-CB 3.48Å; C553-I557 VanDerWaalsContact O-CD1 3.25Å; C553-I557 WeakPolarHBondContact O-CD1 3.32Å; C553-I557 WeakPolarHBondContact O-CG1 3.43Å; C553-I557 PolarHBondContact O-N 3.4Å; C553-I601 HydrophobicContact CB-CG2 3.85Å; C553-L605 HydrophobicContact CB-CB 4.12Å; C553-L605 HydrophobicContact CB-CD1 4.18Å
554	T	96.8	Very high	92.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-47.5	-179.7	49.9	0	0	0	0	111.9	V550 R551 E556 I557 E558 L605 Y671 H675	V550-T554 HydrophobicContact CG1-CG2 4.38Å; V550-T554 WeakPolarHBondContact O-CG2 3.44Å; V550-T554 PolarHBondContact O-N 3.08Å; V550-T554 PolarHBondContact O-OG1 3.48Å; R551-T554 WeakPolarHBondContact CA-OG1 3.49Å; R551-T554 PolarHBondContact O-OG1 2.79Å; R551-T554 VanDerWaalsContact O-OG1 3.11Å; T554-E556 VanDerWaalsContact C-N 3.25Å; T554-E556 PolarHBondContact O-N 2.96Å; T554-I557 PolarHBondContact O-N 3.49Å; T554-I557 VanDerWaalsContact O-N 3.13Å; T554-E558 WeakPolarHBondContact O-CB 3.33Å; T554-E558 VanDerWaalsContact O-CG 3.26Å; T554-E558 WeakPolarHBondContact O-CG 3.18Å; T554-E558 PolarHBondContact O-N 3.4Å; T554-L605 HydrophobicContact CG2-CD2 4.03Å; T554-Y671 HydrophobicContact CG2-CE1 4.03Å; T554-Y671 VanDerWaalsContact OG1-CE1 3.22Å; T554-Y671 WeakPolarHBondContact OG1-CE1 3.32Å; T554-Y671 PolarHBondContact OG1-OH 3.23Å; T554-H675 WeakPolarHBondContact CB-ND1 3.15Å; T554-H675 HydrophobicContact CG2-CB 3.86Å; T554-H675 VanDerWaalsContact CG2-CG 3.49Å
555	N	95.4	Very high	93.9	Very high	85 Å²	85	40.5 Å²	40.5	46%	0.455	21%	0.21	S	C	.	.	H	α-helix	trans	-57.8	-39.3	178.5	-68.7	-9.6	0	0	0	111.6	R551 E558 S559 Y671	R551-N555 WeakPolarHBondContact O-CB 3.25Å; R551-N555 PolarHBondContact O-N 3.31Å; R551-N555 PolarHBondContact O-ND2 3.27Å; R551-N555 PolarHBondContact O-OD1 3.34Å; N555-E558 PolarHBondContact O-N 3.29Å; N555-S559 VanDerWaalsContact O-CB 3.31Å; N555-S559 WeakPolarHBondContact O-CB 3.46Å; N555-S559 PolarHBondContact O-N 3.11Å; N555-S559 PolarHBondContact O-OG 2.88Å; N555-Y671 PolarHBondContact OD1-OH 3.24Å; N555-Y671 VanDerWaalsContact OD1-OH 3.07Å
556	E	95.9	Very high	94.6	Very high	36 Å²	36	35.7 Å²	35.7	17%	0.168	19%	0.19	C	C	.	.	H	α-helix	trans	-76.1	-28.5	179.7	-174.9	66.3	176.7	0	0	113.5	C552 C553 T554 S559 R560 L593 S594 I601	C552-E556 VanDerWaalsContact O-CB 3.27Å; C552-E556 WeakPolarHBondContact O-CB 3.38Å; C552-E556 PolarHBondContact O-N 3.27Å; C553-E556 PolarHBondContact O-N 3.33Å; T554-E556 VanDerWaalsContact C-N 3.25Å; T554-E556 PolarHBondContact O-N 2.96Å; E556-S559 PolarHBondContact O-OG 3.22Å; E556-S559 VanDerWaalsContact O-OG 3.12Å; E556-S559 PolarHBondContact OE2-OG 3.01Å; E556-R560 WeakPolarHBondContact O-CG 3.44Å; E556-R560 IonicContact OE1-CZ 2.73Å; E556-R560 IonicContact OE1-NE 2.71Å; E556-R560 PolarHBondContact OE1-NE 2.97Å; E556-R560 IonicContact OE1-NH2 3.31Å; E556-R560 PolarHBondContact OE1-NH2 3.33Å; E556-L593 HydrophobicContact CB-CB 4.32Å; E556-L593 HydrophobicContact CB-CD1 4.04Å; E556-L593 HydrophobicContact CG-CB 3.71Å; E556-L593 HydrophobicContact CG-CD1 4.29Å; E556-S594 WeakPolarHBondContact OE1-CA 3.45Å; E556-I601 HydrophobicContact CG-CD1 3.8Å
557	I	96.6	Very high	94.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-73.6	-38.1	172	-68.8	161.8	0	0	0	110	C553 T554 A561 L562 V567 Y568 I601 T602	C553-I557 WeakPolarHBondContact O-CB 3.48Å; C553-I557 VanDerWaalsContact O-CD1 3.25Å; C553-I557 WeakPolarHBondContact O-CD1 3.32Å; C553-I557 WeakPolarHBondContact O-CG1 3.43Å; C553-I557 PolarHBondContact O-N 3.4Å; T554-I557 PolarHBondContact O-N 3.49Å; T554-I557 VanDerWaalsContact O-N 3.13Å; I557-A561 HydrophobicContact CB-CB 4.49Å; I557-A561 HydrophobicContact CG2-CB 4.23Å; I557-A561 CarbonylContact O-C 3.43Å; I557-A561 VanDerWaalsContact O-CA 3.29Å; I557-A561 WeakPolarHBondContact O-CA 3.31Å; I557-A561 WeakPolarHBondContact O-CB 3.43Å; I557-A561 PolarHBondContact O-N 2.88Å; I557-L562 PolarHBondContact O-N 2.88Å; I557-V567 HydrophobicContact CG2-CG2 4.19Å; I557-Y568 HydrophobicContact CD1-CE1 4.43Å; I557-Y568 VanDerWaalsContact CD1-OH 3.25Å; I557-Y568 WeakPolarHBondContact CD1-OH 3.45Å; I557-Y568 HydrophobicContact CG2-CE2 4.45Å; I557-I601 HydrophobicContact CD1-CG2 4.12Å; I557-I601 HydrophobicContact CG1-CG2 4.1Å; I557-T602 HydrophobicContact CD1-CG2 3.45Å; I557-T602 VanDerWaalsContact CD1-CG2 3.45Å; I557-T602 HydrophobicContact CG1-CG2 3.91Å
558	E	96.3	Very high	95.1	Very high	41 Å²	41	34.9 Å²	34.9	19%	0.192	19%	0.185	C	C	.	.	H	α-helix	trans	-68	-41.4	176.2	-72.5	165.6	-154.2	0	0	112.6	T554 N555 R560 L562 H675 R678	T554-E558 WeakPolarHBondContact O-CB 3.33Å; T554-E558 VanDerWaalsContact O-CG 3.26Å; T554-E558 WeakPolarHBondContact O-CG 3.18Å; T554-E558 PolarHBondContact O-N 3.4Å; N555-E558 PolarHBondContact O-N 3.29Å; E558-R560 PolarHBondContact O-N 3.32Å; E558-L562 HydrophobicContact CG-CD2 4.34Å; E558-L562 WeakPolarHBondContact O-CD1 3.49Å; E558-H675 IonicContact OE1-CE1 2.74Å; E558-H675 IonicContact OE1-CG 2.96Å; E558-H675 IonicContact OE1-ND1 2.7Å; E558-H675 PolarHBondContact OE1-ND1 3.14Å; E558-R678 IonicContact OE1-CZ 2.59Å; E558-R678 IonicContact OE1-NH1 3.12Å; E558-R678 PolarHBondContact OE1-NH1 3.24Å; E558-R678 IonicContact OE1-NH2 3.84Å; E558-R678 PolarHBondContact OE1-NH2 2.95Å; E558-R678 IonicContact OE2-CZ 2.62Å; E558-R678 IonicContact OE2-NH1 3.37Å; E558-R678 PolarHBondContact OE2-NH1 3.03Å; E558-R678 IonicContact OE2-NH2 3.4Å; E558-R678 PolarHBondContact OE2-NH2 2.86Å
559	S	95.6	Very high	95.3	Very high	81 Å²	81	43.1 Å²	43.1	57%	0.566	22%	0.216	S	C	*	.	H	α-helix	trans	-65.6	-34.1	-175.6	70.6	0	0	0	0	113.8	N555 E556	N555-S559 VanDerWaalsContact O-CB 3.31Å; N555-S559 WeakPolarHBondContact O-CB 3.46Å; N555-S559 PolarHBondContact O-N 3.11Å; N555-S559 PolarHBondContact O-OG 2.88Å; E556-S559 PolarHBondContact O-OG 3.22Å; E556-S559 VanDerWaalsContact O-OG 3.12Å; E556-S559 PolarHBondContact OE2-OG 3.01Å
560	R	95.3	Very high	95.3	Very high	98 Å²	98	46.1 Å²	46.1	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-146.6	-4.1	-172.4	64	168.4	170.8	117.6	3.7	117.6	E556 E558 L593 S594 H596	E556-R560 WeakPolarHBondContact O-CG 3.44Å; E556-R560 IonicContact OE1-CZ 2.73Å; E556-R560 IonicContact OE1-NE 2.71Å; E556-R560 PolarHBondContact OE1-NE 2.97Å; E556-R560 IonicContact OE1-NH2 3.31Å; E556-R560 PolarHBondContact OE1-NH2 3.33Å; E558-R560 PolarHBondContact O-N 3.32Å; R560-L593 PolarHBondContact NH2-O 2.88Å; R560-S594 PolarHBondContact NH1-O 3.28Å; R560-S594 PolarHBondContact NH2-O 3.38Å; R560-H596 PolarHBondContact NH1-O 3.09Å; R560-H596 PolarHBondContact NH2-O 2.89Å
561	A	93.6	Very high	95.1	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-0.9	-171.8	0	0	0	0	0	115.7	I557 S563 V564 V567 P598	I557-A561 HydrophobicContact CB-CB 4.49Å; I557-A561 HydrophobicContact CG2-CB 4.23Å; I557-A561 CarbonylContact O-C 3.43Å; I557-A561 VanDerWaalsContact O-CA 3.29Å; I557-A561 WeakPolarHBondContact O-CA 3.31Å; I557-A561 WeakPolarHBondContact O-CB 3.43Å; I557-A561 PolarHBondContact O-N 2.88Å; A561-S563 PolarHBondContact O-N 3.26Å; A561-S563 VanDerWaalsContact O-N 3.09Å; A561-V564 HydrophobicContact CB-CG2 4.12Å; A561-V564 WeakPolarHBondContact O-CB 3.42Å; A561-V564 PolarHBondContact O-N 3.16Å; A561-V567 HydrophobicContact CB-CG2 4.23Å; A561-P598 HydrophobicContact CB-CB 3.73Å; A561-P598 HydrophobicContact CB-CG 3.99Å
562	L	95	Very high	95	Very high	43 Å²	43	48 Å²	48	23%	0.225	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.1	-176.8	-65.8	179.1	0	0	0	114.9	I557 E558 V679 N682 N685	I557-L562 PolarHBondContact O-N 2.88Å; E558-L562 HydrophobicContact CG-CD2 4.34Å; E558-L562 WeakPolarHBondContact O-CD1 3.49Å; L562-V679 HydrophobicContact CD2-CG2 3.75Å; L562-N682 HydrophobicContact CB-CB 4.46Å; L562-N682 WeakPolarHBondContact O-CB 3.34Å; L562-N682 PolarHBondContact O-ND2 2.9Å; L562-N685 VanDerWaalsContact O-CB 3.31Å; L562-N685 WeakPolarHBondContact O-CB 3.37Å; L562-N685 PolarHBondContact O-ND2 3.12Å
563	S	94.3	Very high	95	Very high	68 Å²	68	48.4 Å²	48.4	48%	0.476	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2.3	176.2	55.2	0	0	0	0	114.3	A561 Q565	A561-S563 PolarHBondContact O-N 3.26Å; A561-S563 VanDerWaalsContact O-N 3.09Å; S563-Q565 PolarHBondContact O-N 2.93Å
564	V	96	Very high	94.6	Very high	39 Å²	39	56.5 Å²	56.5	24%	0.236	30%	0.298	C	S	.	.	S	Bend	trans	-75.5	116.5	-175.9	174.7	0	0	0	0	110.7	A561 G566 V567 N685	A561-V564 HydrophobicContact CB-CG2 4.12Å; A561-V564 WeakPolarHBondContact O-CB 3.42Å; A561-V564 PolarHBondContact O-N 3.16Å; V564-G566 PolarHBondContact O-N 3.21Å; V564-V567 HydrophobicContact CB-CB 4.23Å; V564-V567 HydrophobicContact CB-CG2 4.49Å; V564-V567 HydrophobicContact CG1-CB 4.47Å; V564-V567 WeakPolarHBondContact O-CB 3.45Å; V564-V567 PolarHBondContact O-N 2.99Å; V564-N685 VanDerWaalsContact O-CB 3.31Å; V564-N685 WeakPolarHBondContact O-CB 3.36Å
565	Q	95.2	Very high	94.2	Very high	111 Å²	111	60.6 Å²	60.6	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	123.5	-177.9	-79.8	179.7	33.1	0	0	113	S563 V567 D684 N685 K686	S563-Q565 PolarHBondContact O-N 2.93Å; Q565-V567 VanDerWaalsContact C-N 3.32Å; Q565-V567 PolarHBondContact O-N 2.92Å; Q565-D684 WeakPolarHBondContact CG-O 3.41Å; Q565-N685 WeakPolarHBondContact CA-O 3.31Å; Q565-K686 VanDerWaalsContact CD-NZ 3.3Å; Q565-K686 HydrophobicContact CG-CD 4.12Å; Q565-K686 HydrophobicContact CG-CG 4.43Å
566	G	93.9	Very high	94.1	Very high	11 Å²	11	62.5 Å²	62.5	11%	0.113	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	26.6	-178.2	0	0	0	0	0	114.2	V564 Y568 R569 V570 N685	V564-G566 PolarHBondContact O-N 3.21Å; G566-Y568 PolarHBondContact O-N 3.27Å; G566-R569 PolarHBondContact O-N 2.97Å; G566-V570 PolarHBondContact O-N 3.43Å; G566-N685 PolarHBondContact N-O 3Å
567	V	95.8	Very high	93.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-39.5	-46.2	-173.8	60.4	0	0	0	0	114.6	I557 A561 V564 Q565 H599 T602 V679 N685 M687	I557-V567 HydrophobicContact CG2-CG2 4.19Å; A561-V567 HydrophobicContact CB-CG2 4.23Å; V564-V567 HydrophobicContact CB-CB 4.23Å; V564-V567 HydrophobicContact CB-CG2 4.49Å; V564-V567 HydrophobicContact CG1-CB 4.47Å; V564-V567 WeakPolarHBondContact O-CB 3.45Å; V564-V567 PolarHBondContact O-N 2.99Å; Q565-V567 VanDerWaalsContact C-N 3.32Å; Q565-V567 PolarHBondContact O-N 2.92Å; V567-H599 PolarHBondContact O-ND1 3.1Å; V567-T602 HydrophobicContact CG2-CG2 3.55Å; V567-T602 WeakPolarHBondContact O-CB 3.38Å; V567-T602 WeakPolarHBondContact O-CG2 3.33Å; V567-T602 PolarHBondContact O-OG1 2.82Å; V567-V679 HydrophobicContact CG1-CG1 4.01Å; V567-N685 HydrophobicContact CG1-CB 4.47Å; V567-M687 HydrophobicContact CG1-CG 4.13Å
568	Y	96.8	Very high	93.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-21.8	175.1	-83.4	-71	0	0	0	115.7	I557 G566 T602 L605 K606 H675 L676 V679 L692 F696	I557-Y568 HydrophobicContact CD1-CE1 4.43Å; I557-Y568 VanDerWaalsContact CD1-OH 3.25Å; I557-Y568 WeakPolarHBondContact CD1-OH 3.45Å; I557-Y568 HydrophobicContact CG2-CE2 4.45Å; G566-Y568 PolarHBondContact O-N 3.27Å; Y568-T602 HydrophobicContact CD1-CG2 4.09Å; Y568-T602 HydrophobicContact CE1-CG2 3.91Å; Y568-T602 HydrophobicContact CE2-CG2 4.47Å; Y568-T602 HydrophobicContact CG-CG2 4.42Å; Y568-L605 HydrophobicContact CE1-CD2 4.18Å; Y568-L605 WeakPolarHBondContact OH-CD2 3.22Å; Y568-K606 HydrophobicContact CD1-CD 4.2Å; Y568-K606 HydrophobicContact CD1-CG 4.28Å; Y568-K606 PolarHBondContact O-NZ 3.27Å; Y568-H675 AromaticContact CE2-NE2 3.43Å; Y568-H675 WeakPolarHBondContact CE2-NE2 3.36Å; Y568-H675 AromaticContact CZ-NE2 3.51Å; Y568-H675 PolarHBondContact OH-CD2 3.36Å; Y568-H675 VanDerWaalsContact OH-CD2 3.28Å; Y568-H675 PolarHBondContact OH-NE2 3.17Å; Y568-L676 HydrophobicContact CD2-CD2 4.27Å; Y568-L676 HydrophobicContact CE2-CD2 4Å; Y568-V679 HydrophobicContact CD2-CG1 4.33Å; Y568-V679 HydrophobicContact CE2-CG2 4.21Å; Y568-L692 HydrophobicContact CD2-CD2 3.96Å; Y568-L692 HydrophobicContact CG-CD2 4.31Å; Y568-F696 AromaticContact CD1-CE2 3.6Å; Y568-F696 HydrophobicContact CD1-CE2 3.6Å; Y568-F696 AromaticContact CD1-CZ 3.68Å; Y568-F696 HydrophobicContact CD1-CZ 3.68Å; Y568-F696 HydrophobicContact CD2-CE2 4.35Å; Y568-F696 AromaticContact CE1-CE2 3.92Å; Y568-F696 HydrophobicContact CE1-CE2 3.92Å; Y568-F696 AromaticContact CE1-CZ 3.58Å; Y568-F696 HydrophobicContact CE1-CZ 3.58Å; Y568-F696 AromaticContact CG-CE2 3.85Å; Y568-F696 HydrophobicContact CG-CE2 3.85Å; Y568-F696 HydrophobicContact CG-CZ 4.37Å
569	R	94.8	Very high	93.2	Very high	191 Å²	191	72 Å²	72	72%	0.721	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-39.1	179.7	-178.9	177.1	176.8	-129.9	-1.2	112.5	G566 M687	G566-R569 PolarHBondContact O-N 2.97Å; R569-M687 HydrophobicContact CB-CE 3.97Å; R569-M687 HydrophobicContact CB-SD 3.66Å
570	V	94.1	Very high	93.1	Very high	64 Å²	64	68.2 Å²	68.2	39%	0.388	34%	0.341	S	S	.	.	S	Bend	trans	-71	144.2	174.1	178.6	0	0	0	0	109.1	G566 H599 K606	G566-V570 PolarHBondContact O-N 3.43Å; V570-H599 HydrophobicContact CG1-CB 4.26Å; V570-K606 PolarHBondContact O-NZ 3.44Å
571	S	92.2	Very high	92.9	Very high	92 Å²	92	64.2 Å²	64.2	64%	0.643	33%	0.328	S	S	*	.			trans	-105.3	139.4	178.4	-65.5	0	0	0	0	111.1
572	G	91.6	Very high	92.6	Very high	13 Å²	13	70.4 Å²	70.4	13%	0.134	36%	0.357	C	S	.	.			trans	-71.7	176.4	175.7	0	0	0	0	0	113.6	K574 H599 D600 S603	G572-K574 PolarHBondContact O-N 2.91Å; G572-H599 WeakPolarHBondContact CA-O 3.27Å; G572-H599 PolarHBondContact N-O 3.09Å; G572-H599 VanDerWaalsContact N-O 3.14Å; G572-D600 WeakPolarHBondContact CA-OD1 3.47Å; G572-S603 PolarHBondContact N-OG 3.14Å
573	S	93.7	Very high	92.4	Very high	42 Å²	42	69.9 Å²	69.9	29%	0.294	36%	0.355	S	S	.	.			trans	-77.6	113.1	-180	-172.1	0	0	0	0	110.5	P575 R576 I577 D600	S573-P575 VanDerWaalsContact C-CD 3.5Å; S573-P575 VanDerWaalsContact O-N 3.15Å; S573-R576 VanDerWaalsContact CB-CZ 3.43Å; S573-R576 WeakPolarHBondContact O-CA 3.4Å; S573-R576 WeakPolarHBondContact O-CB 3.37Å; S573-R576 PolarHBondContact O-N 3.04Å; S573-I577 WeakPolarHBondContact O-CG1 3.43Å; S573-I577 PolarHBondContact O-N 3.46Å; S573-D600 PolarHBondContact N-OD1 2.9Å
574	K	87.1	Confident	92.2	Very high	169 Å²	169	66.6 Å²	66.6	74%	0.735	33%	0.333	S	S	*	.	H	α-helix	trans	-41.1	-49.2	179.9	-67.1	-176	178.9	179.8	0	115.2	G572 R576 I577 Q578	G572-K574 PolarHBondContact O-N 2.91Å; K574-R576 PolarHBondContact O-N 3.2Å; K574-I577 PolarHBondContact O-N 3.38Å; K574-Q578 WeakPolarHBondContact O-CG 3.47Å; K574-Q578 PolarHBondContact O-N 3.29Å
575	P	89.4	Confident	91.9	Very high	87 Å²	87	65.8 Å²	65.8	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-68.2	-30.1	177.3	26.3	-35.8	0	0	0	114.1	S573 K579	S573-P575 VanDerWaalsContact C-CD 3.5Å; S573-P575 VanDerWaalsContact O-N 3.15Å; P575-K579 PolarHBondContact O-N 2.58Å
576	R	92.3	Very high	91.4	Very high	124 Å²	124	65.7 Å²	65.7	47%	0.468	33%	0.333	S	S	.	.	H	α-helix	trans	-73.7	-40	174.5	-59.4	-165.1	-51.4	-117.6	-3.2	111.3	S573 K574 K579 L580 D600	S573-R576 VanDerWaalsContact CB-CZ 3.43Å; S573-R576 WeakPolarHBondContact O-CA 3.4Å; S573-R576 WeakPolarHBondContact O-CB 3.37Å; S573-R576 PolarHBondContact O-N 3.04Å; K574-R576 PolarHBondContact O-N 3.2Å; R576-K579 PolarHBondContact O-N 3.19Å; R576-L580 WeakPolarHBondContact O-CB 3.28Å; R576-L580 PolarHBondContact O-N 3.23Å; R576-D600 IonicContact CZ-OD1 2.7Å; R576-D600 IonicContact CZ-OD2 2.73Å; R576-D600 IonicContact NE-OD1 2.95Å; R576-D600 IonicContact NE-OD2 3.94Å; R576-D600 PolarHBondContact NE-OD2 2.81Å; R576-D600 VanDerWaalsContact NH2-CG 3.26Å; R576-D600 IonicContact NH2-OD1 3.64Å; R576-D600 PolarHBondContact NH2-OD1 3.21Å; R576-D600 IonicContact NH2-OD2 3.61Å; R576-D600 PolarHBondContact NH2-OD2 2.77Å
577	I	92.8	Very high	90.9	Very high	20 Å²	20	69.5 Å²	69.5	10%	0.103	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-51	171.4	-63.4	163.5	0	0	0	109.6	S573 K574 K579 L580 C581 D600 S603 I604	S573-I577 WeakPolarHBondContact O-CG1 3.43Å; S573-I577 PolarHBondContact O-N 3.46Å; K574-I577 PolarHBondContact O-N 3.38Å; I577-K579 VanDerWaalsContact C-N 3.34Å; I577-K579 PolarHBondContact O-N 3.25Å; I577-L580 PolarHBondContact O-N 3.14Å; I577-L580 VanDerWaalsContact O-N 3.11Å; I577-C581 PolarHBondContact O-N 3.23Å; I577-C581 PolarHBondContact O-SG 3.41Å; I577-D600 HydrophobicContact CG1-CB 4.44Å; I577-S603 VanDerWaalsContact CD1-CB 3.43Å; I577-I604 HydrophobicContact CG2-CD1 3.8Å; I577-I604 HydrophobicContact CG2-CG1 4.48Å; I577-I604 WeakPolarHBondContact O-CD1 3.28Å
578	Q	88.6	Confident	90.4	Very high	126 Å²	126	74 Å²	74	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-59.3	-41	178.1	-75.2	176.5	-33.3	0	0	113.2	K574 Q582	K574-Q578 WeakPolarHBondContact O-CG 3.47Å; K574-Q578 PolarHBondContact O-N 3.29Å; Q578-Q582 WeakPolarHBondContact O-CG 3.45Å; Q578-Q582 PolarHBondContact O-N 2.75Å
579	K	90.3	Very high	89.7	Confident	133 Å²	133	78.6 Å²	78.6	58%	0.578	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-46.3	173.2	-172.3	-165.7	173.5	-158.8	0	111.2	P575 R576 I577 C581 Q582 T583	P575-K579 PolarHBondContact O-N 2.58Å; R576-K579 PolarHBondContact O-N 3.19Å; I577-K579 VanDerWaalsContact C-N 3.34Å; I577-K579 PolarHBondContact O-N 3.25Å; K579-C581 PolarHBondContact O-N 2.74Å; K579-Q582 WeakPolarHBondContact O-CB 3.49Å; K579-Q582 PolarHBondContact O-N 2.89Å; K579-Q582 VanDerWaalsContact O-N 3.1Å; K579-T583 PolarHBondContact O-N 2.99Å; K579-T583 PolarHBondContact O-OG1 3.2Å
580	L	92.3	Very high	89.3	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.005	39%	0.393	C	S	.	.	H	α-helix	trans	-67.4	-34.4	-178.1	-177.8	54.2	0	0	0	112.1	R576 I577 Q582 T583 F584 V591 L593 I604	R576-L580 WeakPolarHBondContact O-CB 3.28Å; R576-L580 PolarHBondContact O-N 3.23Å; I577-L580 PolarHBondContact O-N 3.14Å; I577-L580 VanDerWaalsContact O-N 3.11Å; L580-Q582 VanDerWaalsContact C-N 3.35Å; L580-Q582 PolarHBondContact O-N 3.4Å; L580-T583 WeakPolarHBondContact O-CB 3.29Å; L580-T583 PolarHBondContact O-N 3.29Å; L580-T583 VanDerWaalsContact O-N 3.16Å; L580-F584 HydrophobicContact CD1-CD2 4.11Å; L580-F584 HydrophobicContact CD1-CE2 3.93Å; L580-F584 HydrophobicContact CG-CD2 4.13Å; L580-F584 HydrophobicContact CG-CE2 3.94Å; L580-F584 WeakPolarHBondContact O-CD2 3.41Å; L580-F584 PolarHBondContact O-N 3.4Å; L580-V591 HydrophobicContact CD1-CG1 3.86Å; L580-L593 HydrophobicContact CD1-CD2 3.87Å; L580-L593 HydrophobicContact CD2-CD2 4.16Å; L580-I604 HydrophobicContact CB-CD1 3.99Å; L580-I604 HydrophobicContact CB-CG1 4.34Å; L580-I604 HydrophobicContact CD2-CD1 4.27Å; L580-I604 HydrophobicContact CD2-CG1 3.69Å; L580-I604 HydrophobicContact CG-CD1 3.96Å; L580-I604 HydrophobicContact CG-CG1 3.9Å
581	C	90.9	Very high	89.1	Confident	14 Å²	14	74.5 Å²	74.5	10%	0.095	38%	0.378	C	S	.	.	H	α-helix	trans	-56.4	-48.4	167.1	-62.6	0	0	0	0	111.3	F531 I577 K579 T583 F584 E585 I604 H607	F531-C581 HydrophobicContact CD2-CB 4.2Å; F531-C581 HydrophobicContact CE2-CB 3.94Å; F531-C581 HydrophobicContact CZ-CB 4.28Å; I577-C581 PolarHBondContact O-N 3.23Å; I577-C581 PolarHBondContact O-SG 3.41Å; K579-C581 PolarHBondContact O-N 2.74Å; C581-T583 PolarHBondContact O-N 3Å; C581-F584 PolarHBondContact O-N 2.9Å; C581-E585 WeakPolarHBondContact O-CB 2.95Å; C581-E585 VanDerWaalsContact O-CG 3.26Å; C581-E585 WeakPolarHBondContact O-CG 3.4Å; C581-E585 PolarHBondContact O-N 2.88Å; C581-I604 WeakPolarHBondContact SG-CD1 3.5Å; C581-H607 VanDerWaalsContact SG-CD2 3.59Å
582	Q	87.8	Confident	89	Confident	131 Å²	131	74.9 Å²	74.9	61%	0.612	37%	0.373	S	S	*	.	H	α-helix	trans	-62.4	-31.1	177.1	-67.6	172.9	-9.6	0	0	112.6	Q578 K579 L580 E585 T586	Q578-Q582 WeakPolarHBondContact O-CG 3.45Å; Q578-Q582 PolarHBondContact O-N 2.75Å; K579-Q582 WeakPolarHBondContact O-CB 3.49Å; K579-Q582 PolarHBondContact O-N 2.89Å; K579-Q582 VanDerWaalsContact O-N 3.1Å; L580-Q582 VanDerWaalsContact C-N 3.35Å; L580-Q582 PolarHBondContact O-N 3.4Å; Q582-E585 PolarHBondContact O-N 3.47Å; Q582-T586 WeakPolarHBondContact O-CB 3.27Å; Q582-T586 PolarHBondContact O-N 2.89Å; Q582-T586 PolarHBondContact O-OG1 2.74Å
583	T	90.3	Very high	89.1	Confident	31 Å²	31	74.7 Å²	74.7	19%	0.19	37%	0.369	C	S	.	.	H	α-helix	trans	-67.3	-49.5	174.3	-53	0	0	0	0	111.3	K579 L580 C581 E585 T586 Q587 V591	K579-T583 PolarHBondContact O-N 2.99Å; K579-T583 PolarHBondContact O-OG1 3.2Å; L580-T583 WeakPolarHBondContact O-CB 3.29Å; L580-T583 PolarHBondContact O-N 3.29Å; L580-T583 VanDerWaalsContact O-N 3.16Å; C581-T583 PolarHBondContact O-N 3Å; T583-E585 VanDerWaalsContact C-N 3.31Å; T583-E585 PolarHBondContact O-N 3.27Å; T583-T586 PolarHBondContact O-N 3.24Å; T583-T586 VanDerWaalsContact O-N 3.07Å; T583-Q587 WeakPolarHBondContact O-CB 3.5Å; T583-Q587 PolarHBondContact O-N 2.84Å; T583-V591 HydrophobicContact CG2-CG1 4.04Å; T583-V591 HydrophobicContact CG2-CG2 4.16Å
584	F	91.1	Very high	88.9	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-57.7	-39.5	171	-81	-70.4	0	0	0	112.8	F531 F548 V549 C552 L580 C581 T586 K588 V591 L593 I604	F531-F584 HydrophobicContact CE2-CB 3.87Å; F531-F584 HydrophobicContact CZ-CB 4.4Å; F531-F584 HydrophobicContact CZ-CD2 4.38Å; F548-F584 HydrophobicContact CD2-CD1 4.44Å; F548-F584 HydrophobicContact CE2-CD1 4.08Å; V549-F584 HydrophobicContact CG1-CE1 4.49Å; V549-F584 HydrophobicContact CG1-CZ 4.47Å; V549-F584 HydrophobicContact CG2-CD1 3.97Å; V549-F584 HydrophobicContact CG2-CE1 4.33Å; V549-F584 HydrophobicContact CG2-CG 4.37Å; C552-F584 HydrophobicContact CB-CE1 4.32Å; L580-F584 HydrophobicContact CD1-CD2 4.11Å; L580-F584 HydrophobicContact CD1-CE2 3.93Å; L580-F584 HydrophobicContact CG-CD2 4.13Å; L580-F584 HydrophobicContact CG-CE2 3.94Å; L580-F584 WeakPolarHBondContact O-CD2 3.41Å; L580-F584 PolarHBondContact O-N 3.4Å; C581-F584 PolarHBondContact O-N 2.9Å; F584-T586 PolarHBondContact O-N 2.82Å; F584-T586 VanDerWaalsContact O-N 3.17Å; F584-K588 WeakPolarHBondContact O-CA 3.31Å; F584-K588 PolarHBondContact O-N 3.19Å; F584-V591 HydrophobicContact CB-CG2 4.39Å; F584-V591 HydrophobicContact CD1-CB 4.06Å; F584-V591 HydrophobicContact CD1-CG1 4.44Å; F584-V591 HydrophobicContact CD1-CG2 3.57Å; F584-V591 HydrophobicContact CE1-CB 3.94Å; F584-V591 HydrophobicContact CE1-CG1 4.23Å; F584-V591 HydrophobicContact CE1-CG2 3.99Å; F584-V591 HydrophobicContact CE2-CG1 4.35Å; F584-V591 HydrophobicContact CG-CG2 3.95Å; F584-V591 HydrophobicContact CZ-CB 4.4Å; F584-V591 HydrophobicContact CZ-CG1 4.19Å; F584-L593 HydrophobicContact CE2-CD2 4.07Å; F584-L593 HydrophobicContact CZ-CD1 4.22Å; F584-L593 HydrophobicContact CZ-CD2 3.85Å; F584-L593 HydrophobicContact CZ-CG 4.49Å; F584-I604 HydrophobicContact CD2-CG2 4.15Å; F584-I604 HydrophobicContact CE2-CG2 3.79Å
585	E	88.3	Confident	89	Confident	21 Å²	21	76.3 Å²	76.3	10%	0.098	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-6.3	175.5	-74.3	-64.9	169.9	0	0	115.9	K526 G528 T529 V530 F531 C581 Q582 T583	K526-E585 PolarHBondContact NZ-O 2.91Å; K526-E585 VanDerWaalsContact NZ-O 3.1Å; G528-E585 WeakPolarHBondContact CA-OE1 3.47Å; G528-E585 WeakPolarHBondContact CA-OE2 3.4Å; T529-E585 WeakPolarHBondContact CA-OE2 3.41Å; T529-E585 PolarHBondContact N-OE1 3.43Å; T529-E585 PolarHBondContact N-OE2 3.01Å; T529-E585 PolarHBondContact OG1-OE2 3.26Å; V530-E585 WeakPolarHBondContact CA-OE1 3.41Å; V530-E585 VanDerWaalsContact CB-OE1 3.28Å; V530-E585 WeakPolarHBondContact CB-OE1 3.26Å; V530-E585 PolarHBondContact N-OE1 3.29Å; V530-E585 PolarHBondContact N-OE2 3.14Å; F531-E585 HydrophobicContact CD2-CG 4.11Å; F531-E585 PolarHBondContact N-OE1 2.87Å; C581-E585 WeakPolarHBondContact O-CB 2.95Å; C581-E585 VanDerWaalsContact O-CG 3.26Å; C581-E585 WeakPolarHBondContact O-CG 3.4Å; C581-E585 PolarHBondContact O-N 2.88Å; Q582-E585 PolarHBondContact O-N 3.47Å; T583-E585 VanDerWaalsContact C-N 3.31Å; T583-E585 PolarHBondContact O-N 3.27Å
586	T	85.3	Confident	89.2	Confident	109 Å²	109	74.4 Å²	74.4	67%	0.669	37%	0.365	S	S	*	.	H	α-helix	trans	-121.7	-35.9	-176.8	-53.2	0	0	0	0	112.1	Q582 T583 F584	Q582-T586 WeakPolarHBondContact O-CB 3.27Å; Q582-T586 PolarHBondContact O-N 2.89Å; Q582-T586 PolarHBondContact O-OG1 2.74Å; T583-T586 PolarHBondContact O-N 3.24Å; T583-T586 VanDerWaalsContact O-N 3.07Å; F584-T586 PolarHBondContact O-N 2.82Å; F584-T586 VanDerWaalsContact O-N 3.17Å
587	Q	84.2	Confident	89.4	Confident	91 Å²	91	70.5 Å²	70.5	43%	0.425	36%	0.356	S	S	.	.	H	α-helix	trans	-108.5	-6.3	-175.3	-64.5	177.4	-26.9	0	0	113.6	T583 D589 Q590 V591	T583-Q587 WeakPolarHBondContact O-CB 3.5Å; T583-Q587 PolarHBondContact O-N 2.84Å; Q587-D589 PolarHBondContact O-N 3.42Å; Q587-D589 VanDerWaalsContact O-N 3.08Å; Q587-Q590 PolarHBondContact O-N 2.92Å; Q587-V591 HydrophobicContact CB-CG2 3.89Å
588	K	85.2	Confident	89.5	Confident	96 Å²	96	70.7 Å²	70.7	42%	0.417	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	-109.5	-175.9	-67.4	-168.5	172.9	-166.5	0	112.4	D541 F548 F584 V591	D541-K588 IonicContact OD2-NZ 3.74Å; F548-K588 VanDerWaalsContact CD2-C 3.48Å; F548-K588 VanDerWaalsContact CD2-O 3.27Å; F548-K588 WeakPolarHBondContact CD2-O 3.44Å; F548-K588 HydrophobicContact CE2-CB 4.16Å; F548-K588 WeakPolarHBondContact CE2-O 3.48Å; F548-K588 HydrophobicContact CZ-CB 4.06Å; F548-K588 HydrophobicContact CZ-CG 4.33Å; F584-K588 WeakPolarHBondContact O-CA 3.31Å; F584-K588 PolarHBondContact O-N 3.19Å; K588-V591 WeakPolarHBondContact O-CG2 3.45Å
589	D	82.4	Confident	89.9	Confident	96 Å²	96	66.6 Å²	66.6	51%	0.513	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-20	-177	59.6	-27.9	0	0	0	113.5	F548 Q587 V591	F548-D589 HydrophobicContact CB-CB 4.29Å; F548-D589 HydrophobicContact CG-CB 4.47Å; Q587-D589 PolarHBondContact O-N 3.42Å; Q587-D589 VanDerWaalsContact O-N 3.08Å; D589-V591 PolarHBondContact O-N 3.14Å
590	Q	85.3	Confident	90.2	Very high	155 Å²	155	60.4 Å²	60.4	72%	0.724	31%	0.313	S	S	*	.			trans	-86.7	24.2	-176.4	-67.4	158.9	65.8	0	0	113.9	Q587 D592	Q587-Q590 PolarHBondContact O-N 2.92Å; Q590-D592 PolarHBondContact O-N 3.13Å
591	V	89.8	Confident	90.4	Very high	13 Å²	13	60.4 Å²	60.4	8%	0.079	31%	0.313	C	S	.	.			trans	-79.7	117.2	178.5	178.2	0	0	0	0	110.8	L580 T583 F584 Q587 K588 D589 L593	L580-V591 HydrophobicContact CD1-CG1 3.86Å; T583-V591 HydrophobicContact CG2-CG1 4.04Å; T583-V591 HydrophobicContact CG2-CG2 4.16Å; F584-V591 HydrophobicContact CB-CG2 4.39Å; F584-V591 HydrophobicContact CD1-CB 4.06Å; F584-V591 HydrophobicContact CD1-CG1 4.44Å; F584-V591 HydrophobicContact CD1-CG2 3.57Å; F584-V591 HydrophobicContact CE1-CB 3.94Å; F584-V591 HydrophobicContact CE1-CG1 4.23Å; F584-V591 HydrophobicContact CE1-CG2 3.99Å; F584-V591 HydrophobicContact CE2-CG1 4.35Å; F584-V591 HydrophobicContact CG-CG2 3.95Å; F584-V591 HydrophobicContact CZ-CB 4.4Å; F584-V591 HydrophobicContact CZ-CG1 4.19Å; Q587-V591 HydrophobicContact CB-CG2 3.89Å; K588-V591 WeakPolarHBondContact O-CG2 3.45Å; D589-V591 PolarHBondContact O-N 3.14Å; V591-L593 HydrophobicContact CG1-CD2 3.69Å; V591-L593 HydrophobicContact CG1-CG 4.25Å; V591-L593 PolarHBondContact O-N 3.45Å
592	D	90.6	Very high	90.7	Very high	101 Å²	101	59.7 Å²	59.7	54%	0.54	31%	0.308	S	S	.	.			trans	-74.8	117.2	168.3	-175.5	2.2	0	0	0	110.9	Q590 S594 H596	Q590-D592 PolarHBondContact O-N 3.13Å; D592-S594 VanDerWaalsContact OD1-CB 3.22Å; D592-S594 WeakPolarHBondContact OD1-CB 3.32Å; D592-S594 PolarHBondContact OD1-N 3.32Å; D592-S594 PolarHBondContact OD1-OG 3.44Å; D592-S594 PolarHBondContact OD2-OG 3.07Å; D592-H596 PolarHBondContact O-CE1 2.98Å; D592-H596 VanDerWaalsContact O-CE1 3.23Å; D592-H596 PolarHBondContact O-ND1 3.3Å; D592-H596 VanDerWaalsContact O-ND1 3.12Å
593	L	93.3	Very high	91.1	Very high	9 Å²	9	54 Å²	54	5%	0.047	28%	0.283	C	S	.	.			trans	-99.8	-7	178.3	-61.2	177.1	0	0	0	113.4	C552 E556 R560 L580 F584 V591 E595 H596 I601	C552-L593 HydrophobicContact CB-CD1 4.06Å; C552-L593 WeakPolarHBondContact O-CD1 3.33Å; E556-L593 HydrophobicContact CB-CB 4.32Å; E556-L593 HydrophobicContact CB-CD1 4.04Å; E556-L593 HydrophobicContact CG-CB 3.71Å; E556-L593 HydrophobicContact CG-CD1 4.29Å; R560-L593 PolarHBondContact NH2-O 2.88Å; L580-L593 HydrophobicContact CD1-CD2 3.87Å; L580-L593 HydrophobicContact CD2-CD2 4.16Å; F584-L593 HydrophobicContact CE2-CD2 4.07Å; F584-L593 HydrophobicContact CZ-CD1 4.22Å; F584-L593 HydrophobicContact CZ-CD2 3.85Å; F584-L593 HydrophobicContact CZ-CG 4.49Å; V591-L593 HydrophobicContact CG1-CD2 3.69Å; V591-L593 HydrophobicContact CG1-CG 4.25Å; V591-L593 PolarHBondContact O-N 3.45Å; L593-E595 PolarHBondContact O-N 3.46Å; L593-H596 VanDerWaalsContact O-CB 3.32Å; L593-H596 WeakPolarHBondContact O-CB 3.5Å; L593-H596 PolarHBondContact O-N 2.69Å; L593-I601 HydrophobicContact CB-CD1 4.21Å; L593-I601 HydrophobicContact CD1-CG2 4.35Å
594	S	90.3	Very high	91.4	Very high	62 Å²	62	52.5 Å²	52.5	43%	0.434	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-45.6	-169.4	64	0	0	0	0	113.8	E556 R560 D592 H596	E556-S594 WeakPolarHBondContact OE1-CA 3.45Å; R560-S594 PolarHBondContact NH1-O 3.28Å; R560-S594 PolarHBondContact NH2-O 3.38Å; D592-S594 VanDerWaalsContact OD1-CB 3.22Å; D592-S594 WeakPolarHBondContact OD1-CB 3.32Å; D592-S594 PolarHBondContact OD1-N 3.32Å; D592-S594 PolarHBondContact OD1-OG 3.44Å; D592-S594 PolarHBondContact OD2-OG 3.07Å; S594-H596 PolarHBondContact O-N 3.4Å
595	E	89.6	Confident	91.7	Very high	182 Å²	182	52.5 Å²	52.5	85%	0.85	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.1	176.6	-61.3	-163.6	150.6	0	0	113.9	L593	L593-E595 PolarHBondContact O-N 3.46Å
596	H	93.7	Very high	92.1	Very high	48 Å²	48	52.9 Å²	52.9	22%	0.222	28%	0.275	C	S	.	.	S	Bend	trans	-83.7	150.6	-173.8	-64.3	85.2	0	0	0	112.2	R560 D592 L593 S594 I601	R560-H596 PolarHBondContact NH1-O 3.09Å; R560-H596 PolarHBondContact NH2-O 2.89Å; D592-H596 PolarHBondContact O-CE1 2.98Å; D592-H596 VanDerWaalsContact O-CE1 3.23Å; D592-H596 PolarHBondContact O-ND1 3.3Å; D592-H596 VanDerWaalsContact O-ND1 3.12Å; L593-H596 VanDerWaalsContact O-CB 3.32Å; L593-H596 WeakPolarHBondContact O-CB 3.5Å; L593-H596 PolarHBondContact O-N 2.69Å; S594-H596 PolarHBondContact O-N 3.4Å; H596-I601 HydrophobicContact CB-CD1 4.08Å; H596-I601 HydrophobicContact CB-CG1 4.08Å
597	S	94.8	Very high	92.5	Very high	42 Å²	42	50.6 Å²	50.6	29%	0.294	26%	0.256	S	S	.	.			trans	-73	135.8	178.8	-173.4	0	0	0	0	110.7	H599 D600 I601	S597-H599 PolarHBondContact O-N 3.28Å; S597-H599 VanDerWaalsContact O-N 3.12Å; S597-D600 WeakPolarHBondContact CB-OD2 3.24Å; S597-D600 WeakPolarHBondContact O-CA 3.5Å; S597-D600 WeakPolarHBondContact O-CB 3.35Å; S597-D600 PolarHBondContact O-N 2.94Å; S597-I601 PolarHBondContact O-N 2.72Å; S597-I601 VanDerWaalsContact O-N 3.15Å
598	P	95.8	Very high	93	Very high	23 Å²	23	46.3 Å²	46.3	15%	0.149	24%	0.236	C	C	.	.	H	α-helix	trans	-51.7	-37.6	177.2	-31.1	37.3	0	0	0	114.1	A561 D600 I601 T602	A561-P598 HydrophobicContact CB-CB 3.73Å; A561-P598 HydrophobicContact CB-CG 3.99Å; P598-D600 VanDerWaalsContact C-N 3.32Å; P598-D600 PolarHBondContact O-N 2.96Å; P598-I601 PolarHBondContact O-N 2.99Å; P598-T602 WeakPolarHBondContact O-CG2 3.48Å; P598-T602 PolarHBondContact O-N 2.82Å; P598-T602 PolarHBondContact O-OG1 3.38Å
599	H	96.7	Very high	93.6	Very high	40 Å²	40	41.7 Å²	41.7	19%	0.185	22%	0.216	C	C	.	.	H	α-helix	trans	-71.1	-24	177.7	-56.7	-52.7	0	0	0	113.9	V567 V570 G572 S597 T602 S603	V567-H599 PolarHBondContact O-ND1 3.1Å; V570-H599 HydrophobicContact CG1-CB 4.26Å; G572-H599 WeakPolarHBondContact CA-O 3.27Å; G572-H599 PolarHBondContact N-O 3.09Å; G572-H599 VanDerWaalsContact N-O 3.14Å; S597-H599 PolarHBondContact O-N 3.28Å; S597-H599 VanDerWaalsContact O-N 3.12Å; H599-T602 PolarHBondContact O-OG1 3.49Å; H599-S603 VanDerWaalsContact O-CB 3.25Å; H599-S603 WeakPolarHBondContact O-CB 3.47Å; H599-S603 PolarHBondContact O-N 3.16Å; H599-S603 PolarHBondContact O-OG 2.93Å
600	D	96.6	Very high	94	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-73.5	-44.5	170.9	-59.1	-31.1	0	0	0	109.6	G572 S573 R576 I577 S597 P598 S603 I604	G572-D600 WeakPolarHBondContact CA-OD1 3.47Å; S573-D600 PolarHBondContact N-OD1 2.9Å; R576-D600 IonicContact CZ-OD1 2.7Å; R576-D600 IonicContact CZ-OD2 2.73Å; R576-D600 IonicContact NE-OD1 2.95Å; R576-D600 IonicContact NE-OD2 3.94Å; R576-D600 PolarHBondContact NE-OD2 2.81Å; R576-D600 VanDerWaalsContact NH2-CG 3.26Å; R576-D600 IonicContact NH2-OD1 3.64Å; R576-D600 PolarHBondContact NH2-OD1 3.21Å; R576-D600 IonicContact NH2-OD2 3.61Å; R576-D600 PolarHBondContact NH2-OD2 2.77Å; I577-D600 HydrophobicContact CG1-CB 4.44Å; S597-D600 WeakPolarHBondContact CB-OD2 3.24Å; S597-D600 WeakPolarHBondContact O-CA 3.5Å; S597-D600 WeakPolarHBondContact O-CB 3.35Å; S597-D600 PolarHBondContact O-N 2.94Å; P598-D600 VanDerWaalsContact C-N 3.32Å; P598-D600 PolarHBondContact O-N 2.96Å; D600-S603 CarbonylContact O-C 3.44Å; D600-S603 WeakPolarHBondContact O-CA 3.35Å; D600-S603 WeakPolarHBondContact O-CB 3.34Å; D600-S603 PolarHBondContact O-N 3.1Å; D600-S603 VanDerWaalsContact O-N 3.14Å; D600-I604 WeakPolarHBondContact O-CG1 3.47Å; D600-I604 PolarHBondContact O-N 2.77Å
601	I	96.9	Very high	94.3	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-47.4	179.4	-58.4	162.4	0	0	0	111	C553 E556 I557 L593 H596 S597 P598 S603 I604 L605	C553-I601 HydrophobicContact CB-CG2 3.85Å; E556-I601 HydrophobicContact CG-CD1 3.8Å; I557-I601 HydrophobicContact CD1-CG2 4.12Å; I557-I601 HydrophobicContact CG1-CG2 4.1Å; L593-I601 HydrophobicContact CB-CD1 4.21Å; L593-I601 HydrophobicContact CD1-CG2 4.35Å; H596-I601 HydrophobicContact CB-CD1 4.08Å; H596-I601 HydrophobicContact CB-CG1 4.08Å; S597-I601 PolarHBondContact O-N 2.72Å; S597-I601 VanDerWaalsContact O-N 3.15Å; P598-I601 PolarHBondContact O-N 2.99Å; I601-S603 PolarHBondContact O-N 3.41Å; I601-I604 WeakPolarHBondContact O-CB 3.49Å; I601-I604 PolarHBondContact O-N 2.98Å; I601-I604 VanDerWaalsContact O-N 3.11Å; I601-L605 PolarHBondContact O-N 3.32Å
602	T	97	Very high	94.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-29	175.9	67.2	0	0	0	0	111.7	I557 V567 Y568 P598 H599 K606	I557-T602 HydrophobicContact CD1-CG2 3.45Å; I557-T602 VanDerWaalsContact CD1-CG2 3.45Å; I557-T602 HydrophobicContact CG1-CG2 3.91Å; V567-T602 HydrophobicContact CG2-CG2 3.55Å; V567-T602 WeakPolarHBondContact O-CB 3.38Å; V567-T602 WeakPolarHBondContact O-CG2 3.33Å; V567-T602 PolarHBondContact O-OG1 2.82Å; Y568-T602 HydrophobicContact CD1-CG2 4.09Å; Y568-T602 HydrophobicContact CE1-CG2 3.91Å; Y568-T602 HydrophobicContact CE2-CG2 4.47Å; Y568-T602 HydrophobicContact CG-CG2 4.42Å; P598-T602 WeakPolarHBondContact O-CG2 3.48Å; P598-T602 PolarHBondContact O-N 2.82Å; P598-T602 PolarHBondContact O-OG1 3.38Å; H599-T602 PolarHBondContact O-OG1 3.49Å; T602-K606 WeakPolarHBondContact O-CE 3.18Å; T602-K606 WeakPolarHBondContact O-CG 3.49Å; T602-K606 PolarHBondContact O-N 3.39Å; T602-K606 VanDerWaalsContact O-N 3.15Å
603	S	97	Very high	94.2	Very high	11 Å²	11	38.3 Å²	38.3	8%	0.077	20%	0.198	C	C	.	.	H	α-helix	trans	-77.3	-30.8	175.1	-59	0	0	0	0	113.2	G572 I577 H599 D600 I601 H607	G572-S603 PolarHBondContact N-OG 3.14Å; I577-S603 VanDerWaalsContact CD1-CB 3.43Å; H599-S603 VanDerWaalsContact O-CB 3.25Å; H599-S603 WeakPolarHBondContact O-CB 3.47Å; H599-S603 PolarHBondContact O-N 3.16Å; H599-S603 PolarHBondContact O-OG 2.93Å; D600-S603 CarbonylContact O-C 3.44Å; D600-S603 WeakPolarHBondContact O-CA 3.35Å; D600-S603 WeakPolarHBondContact O-CB 3.34Å; D600-S603 PolarHBondContact O-N 3.1Å; D600-S603 VanDerWaalsContact O-N 3.14Å; I601-S603 PolarHBondContact O-N 3.41Å; S603-H607 WeakPolarHBondContact O-CB 3.42Å; S603-H607 PolarHBondContact O-N 3.06Å
604	I	96.3	Very high	94	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-49.1	167.4	-67.8	-72	0	0	0	110.2	F531 V549 I577 L580 C581 F584 D600 I601 K606 H607 F608	F531-I604 HydrophobicContact CE1-CG2 4.13Å; F531-I604 HydrophobicContact CZ-CG2 3.88Å; V549-I604 HydrophobicContact CG1-CG2 3.98Å; I577-I604 HydrophobicContact CG2-CD1 3.8Å; I577-I604 HydrophobicContact CG2-CG1 4.48Å; I577-I604 WeakPolarHBondContact O-CD1 3.28Å; L580-I604 HydrophobicContact CB-CD1 3.99Å; L580-I604 HydrophobicContact CB-CG1 4.34Å; L580-I604 HydrophobicContact CD2-CD1 4.27Å; L580-I604 HydrophobicContact CD2-CG1 3.69Å; L580-I604 HydrophobicContact CG-CD1 3.96Å; L580-I604 HydrophobicContact CG-CG1 3.9Å; C581-I604 WeakPolarHBondContact SG-CD1 3.5Å; F584-I604 HydrophobicContact CD2-CG2 4.15Å; F584-I604 HydrophobicContact CE2-CG2 3.79Å; D600-I604 WeakPolarHBondContact O-CG1 3.47Å; D600-I604 PolarHBondContact O-N 2.77Å; I601-I604 WeakPolarHBondContact O-CB 3.49Å; I601-I604 PolarHBondContact O-N 2.98Å; I601-I604 VanDerWaalsContact O-N 3.11Å; I604-K606 PolarHBondContact O-N 3.11Å; I604-H607 CarbonylContact O-C 3.54Å; I604-H607 WeakPolarHBondContact O-CB 3.49Å; I604-H607 PolarHBondContact O-N 3.4Å; I604-H607 VanDerWaalsContact O-N 3.08Å; I604-F608 PolarHBondContact O-N 3.04Å
605	L	96.9	Very high	94.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-46.2	-178.2	-171.7	66.1	0	0	0	112	V550 C553 T554 Y568 I601 H607 F608 F609 L672	V550-L605 HydrophobicContact CB-CD1 4.19Å; V550-L605 HydrophobicContact CG1-CD1 4.18Å; V550-L605 HydrophobicContact CG2-CD1 4.09Å; C553-L605 HydrophobicContact CB-CB 4.12Å; C553-L605 HydrophobicContact CB-CD1 4.18Å; T554-L605 HydrophobicContact CG2-CD2 4.03Å; Y568-L605 HydrophobicContact CE1-CD2 4.18Å; Y568-L605 WeakPolarHBondContact OH-CD2 3.22Å; I601-L605 PolarHBondContact O-N 3.32Å; L605-H607 VanDerWaalsContact C-N 3.31Å; L605-H607 PolarHBondContact O-N 2.68Å; L605-F608 PolarHBondContact O-N 3.3Å; L605-F609 HydrophobicContact CD1-CD2 4.3Å; L605-F609 HydrophobicContact CD1-CE2 3.62Å; L605-F609 HydrophobicContact CD1-CZ 4.38Å; L605-F609 HydrophobicContact CG-CD2 4.26Å; L605-F609 HydrophobicContact CG-CE2 3.86Å; L605-F609 VanDerWaalsContact O-CD2 3.26Å; L605-F609 WeakPolarHBondContact O-CD2 3.35Å; L605-F609 PolarHBondContact O-N 3.49Å; L605-L672 HydrophobicContact CD2-CD1 4.14Å
606	K	96	Very high	94.4	Very high	29 Å²	29	28.8 Å²	28.8	13%	0.126	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-38.9	173.4	-71.8	175.9	-66.1	-179.1	0	112.3	Y568 V570 T602 I604 K610 V695 F696	Y568-K606 HydrophobicContact CD1-CD 4.2Å; Y568-K606 HydrophobicContact CD1-CG 4.28Å; Y568-K606 PolarHBondContact O-NZ 3.27Å; V570-K606 PolarHBondContact O-NZ 3.44Å; T602-K606 WeakPolarHBondContact O-CE 3.18Å; T602-K606 WeakPolarHBondContact O-CG 3.49Å; T602-K606 PolarHBondContact O-N 3.39Å; T602-K606 VanDerWaalsContact O-N 3.15Å; I604-K606 PolarHBondContact O-N 3.11Å; K606-K610 VanDerWaalsContact O-CB 3.26Å; K606-K610 WeakPolarHBondContact O-CB 3.46Å; K606-K610 PolarHBondContact O-N 3.35Å; K606-V695 HydrophobicContact CD-CG1 3.6Å; K606-V695 HydrophobicContact CG-CG1 4.39Å; K606-F696 HydrophobicContact CG-CE1 4.4Å; K606-F696 HydrophobicContact CG-CZ 4.11Å
607	H	94.1	Very high	94.4	Very high	60 Å²	60	26.5 Å²	26.5	28%	0.278	14%	0.135	S	C	.	.	H	α-helix	trans	-69.9	-41.5	179.2	-176	35.9	0	0	0	111.8	C581 S603 I604 L605 F609 K610 E611	C581-H607 VanDerWaalsContact SG-CD2 3.59Å; S603-H607 WeakPolarHBondContact O-CB 3.42Å; S603-H607 PolarHBondContact O-N 3.06Å; I604-H607 CarbonylContact O-C 3.54Å; I604-H607 WeakPolarHBondContact O-CB 3.49Å; I604-H607 PolarHBondContact O-N 3.4Å; I604-H607 VanDerWaalsContact O-N 3.08Å; L605-H607 VanDerWaalsContact C-N 3.31Å; L605-H607 PolarHBondContact O-N 2.68Å; H607-F609 PolarHBondContact O-N 3.09Å; H607-K610 PolarHBondContact O-N 2.96Å; H607-K610 VanDerWaalsContact O-N 3.14Å; H607-E611 VanDerWaalsContact CE1-CD 3.44Å; H607-E611 WeakPolarHBondContact CE1-CG 3.31Å; H607-E611 IonicContact CE1-OE1 2.77Å; H607-E611 PolarHBondContact CE1-OE1 2.95Å; H607-E611 VanDerWaalsContact CE1-OE1 3.25Å; H607-E611 VanDerWaalsContact ND1-CG 3.28Å; H607-E611 WeakPolarHBondContact ND1-CG 3.33Å; H607-E611 IonicContact ND1-OE1 2.64Å; H607-E611 PolarHBondContact ND1-OE1 3.27Å; H607-E611 WeakPolarHBondContact O-CG 3.28Å; H607-E611 PolarHBondContact O-N 2.93Å
608	F	95.6	Very high	94.4	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-52.3	-59.1	175.5	177.5	-101	0	0	0	111.5	V530 F531 I538 P547 V549 V550 I604 L605 K610 E611 L612	V530-F608 HydrophobicContact CG1-CE2 4.41Å; F531-F608 HydrophobicContact CD1-CB 4.33Å; F531-F608 HydrophobicContact CD1-CD2 4.26Å; F531-F608 HydrophobicContact CE1-CB 3.98Å; F531-F608 HydrophobicContact CE1-CD2 4.26Å; I538-F608 HydrophobicContact CD1-CE2 3.92Å; I538-F608 HydrophobicContact CD1-CZ 3.96Å; P547-F608 HydrophobicContact CB-CE1 4.3Å; P547-F608 HydrophobicContact CB-CZ 3.93Å; P547-F608 HydrophobicContact CG-CE1 4.18Å; P547-F608 HydrophobicContact CG-CZ 3.98Å; V549-F608 HydrophobicContact CB-CD2 4.23Å; V549-F608 HydrophobicContact CB-CE2 4.45Å; V549-F608 HydrophobicContact CG1-CB 4.26Å; V549-F608 HydrophobicContact CG1-CD2 4.18Å; V549-F608 HydrophobicContact CG1-CG 4.21Å; V549-F608 HydrophobicContact CG2-CD2 4.44Å; V550-F608 HydrophobicContact CG2-CD1 3.86Å; V550-F608 HydrophobicContact CG2-CE1 3.68Å; I604-F608 PolarHBondContact O-N 3.04Å; L605-F608 PolarHBondContact O-N 3.3Å; F608-K610 PolarHBondContact O-N 3.42Å; F608-E611 PolarHBondContact O-N 3.17Å; F608-L612 HydrophobicContact CE1-CD2 4.29Å; F608-L612 HydrophobicContact CE2-CD2 4.48Å; F608-L612 HydrophobicContact CZ-CD2 4.08Å; F608-L612 PolarHBondContact O-N 3.37Å
609	F	96.1	Very high	94.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-30.1	178.9	-68.6	-61.9	0	0	0	113.6	V550 L605 H607 L612 L616 T668 L672 T699 L700 R702	V550-F609 HydrophobicContact CB-CZ 4.48Å; V550-F609 HydrophobicContact CG1-CZ 4.08Å; V550-F609 HydrophobicContact CG2-CE1 4.08Å; V550-F609 HydrophobicContact CG2-CE2 4.2Å; V550-F609 HydrophobicContact CG2-CZ 3.52Å; L605-F609 HydrophobicContact CD1-CD2 4.3Å; L605-F609 HydrophobicContact CD1-CE2 3.62Å; L605-F609 HydrophobicContact CD1-CZ 4.38Å; L605-F609 HydrophobicContact CG-CD2 4.26Å; L605-F609 HydrophobicContact CG-CE2 3.86Å; L605-F609 VanDerWaalsContact O-CD2 3.26Å; L605-F609 WeakPolarHBondContact O-CD2 3.35Å; L605-F609 PolarHBondContact O-N 3.49Å; H607-F609 PolarHBondContact O-N 3.09Å; F609-L612 HydrophobicContact CD1-CD1 4.01Å; F609-L616 HydrophobicContact CD1-CB 4.45Å; F609-L616 HydrophobicContact CD1-CD1 4.48Å; F609-L616 HydrophobicContact CD1-CD2 4.02Å; F609-L616 HydrophobicContact CE1-CD1 4.22Å; F609-L616 HydrophobicContact CE1-CD2 3.72Å; F609-L616 HydrophobicContact CE1-CG 4.49Å; F609-L616 HydrophobicContact CZ-CD2 4.39Å; F609-T668 HydrophobicContact CE1-CG2 3.76Å; F609-T668 HydrophobicContact CZ-CG2 4.11Å; F609-L672 HydrophobicContact CD2-CD2 4.19Å; F609-L672 HydrophobicContact CE1-CD2 4.48Å; F609-L672 HydrophobicContact CE2-CD1 3.92Å; F609-L672 HydrophobicContact CE2-CD2 3.67Å; F609-L672 HydrophobicContact CE2-CG 4.33Å; F609-L672 HydrophobicContact CZ-CD1 4.39Å; F609-L672 HydrophobicContact CZ-CD2 3.84Å; F609-L672 HydrophobicContact CZ-CG 4.47Å; F609-T699 HydrophobicContact CB-CG2 3.85Å; F609-L700 HydrophobicContact CB-CD2 4.16Å; F609-L700 HydrophobicContact CD1-CD2 4.3Å; F609-L700 HydrophobicContact CD2-CD2 4.41Å; F609-L700 HydrophobicContact CG-CD2 4.05Å; F609-R702 PolarHBondContact O-NH1 3.43Å; F609-R702 PolarHBondContact O-NH2 3.34Å
610	K	92.5	Very high	93.9	Very high	128 Å²	128	31 Å²	31	56%	0.557	15%	0.154	S	C	*	.	H	α-helix	trans	-72.8	-36.6	178.5	-179	166.9	-179.9	164.1	0	113.6	K606 H607 F608 R702	K606-K610 VanDerWaalsContact O-CB 3.26Å; K606-K610 WeakPolarHBondContact O-CB 3.46Å; K606-K610 PolarHBondContact O-N 3.35Å; H607-K610 PolarHBondContact O-N 2.96Å; H607-K610 VanDerWaalsContact O-N 3.14Å; F608-K610 PolarHBondContact O-N 3.42Å; K610-R702 VanDerWaalsContact O-CZ 3.32Å; K610-R702 PolarHBondContact O-NH2 3.38Å
611	E	90.6	Very high	93.8	Very high	88 Å²	88	31.6 Å²	31.6	41%	0.411	16%	0.157	S	C	.	.	H	α-helix	trans	-85.4	-10.6	-179.4	-57.6	-57.5	130.4	0	0	113.7	G532 H607 F608	G532-E611 WeakPolarHBondContact CA-O 3.38Å; H607-E611 VanDerWaalsContact CE1-CD 3.44Å; H607-E611 WeakPolarHBondContact CE1-CG 3.31Å; H607-E611 IonicContact CE1-OE1 2.77Å; H607-E611 PolarHBondContact CE1-OE1 2.95Å; H607-E611 VanDerWaalsContact CE1-OE1 3.25Å; H607-E611 VanDerWaalsContact ND1-CG 3.28Å; H607-E611 WeakPolarHBondContact ND1-CG 3.33Å; H607-E611 IonicContact ND1-OE1 2.64Å; H607-E611 PolarHBondContact ND1-OE1 3.27Å; H607-E611 WeakPolarHBondContact O-CG 3.28Å; H607-E611 PolarHBondContact O-N 2.93Å; F608-E611 PolarHBondContact O-N 3.17Å
612	L	90.6	Very high	93.6	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	16%	0.16	C	C	.	.	S	Bend	trans	-51	134.6	175.8	-68.2	176.2	0	0	0	110.8	I538 F608 F609 E614 R702	I538-L612 HydrophobicContact CD1-CD2 4.41Å; F608-L612 HydrophobicContact CE1-CD2 4.29Å; F608-L612 HydrophobicContact CE2-CD2 4.48Å; F608-L612 HydrophobicContact CZ-CD2 4.08Å; F608-L612 PolarHBondContact O-N 3.37Å; F609-L612 HydrophobicContact CD1-CD1 4.01Å; L612-E614 WeakPolarHBondContact CB-O 3.36Å; L612-E614 PolarHBondContact O-N 3.19Å; L612-R702 PolarHBondContact O-NH2 2.89Å
613	P	87.7	Confident	93.3	Very high	72 Å²	72	38.2 Å²	38.2	47%	0.468	19%	0.192	S	C	.	.	S	Bend	trans	-55.2	-37.7	178.1	-27.2	35.4	0	0	0	113	V533 F619	V533-P613 WeakPolarHBondContact O-CD 3.39Å; P613-F619 WeakPolarHBondContact O-CE2 3.26Å
614	E	89.3	Confident	93.2	Very high	53 Å²	53	41.4 Å²	41.4	25%	0.248	21%	0.206	C	C	.	.	S	Bend	trans	-113.1	135.2	171.2	168.2	139.7	-123.5	0	0	109.8	L612 T618 F619 Y665	L612-E614 WeakPolarHBondContact CB-O 3.36Å; L612-E614 PolarHBondContact O-N 3.19Å; E614-T618 HydrophobicContact CG-CG2 4.16Å; E614-T618 WeakPolarHBondContact OE1-CA 3.44Å; E614-T618 WeakPolarHBondContact OE1-CB 3.47Å; E614-F619 HydrophobicContact CG-CD2 4.48Å; E614-F619 PolarHBondContact OE1-N 3.12Å; E614-Y665 HydrophobicContact CG-CE1 4.1Å
615	P	93.1	Very high	93.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.			trans	-63.1	155.1	173.3	26.9	-35.4	0	0	0	112	L617 T618 F619 L700 R702	P615-L617 PolarHBondContact O-N 2.99Å; P615-L617 VanDerWaalsContact O-N 3.13Å; P615-T618 WeakPolarHBondContact O-CA 3.3Å; P615-T618 PolarHBondContact O-N 3Å; P615-F619 VanDerWaalsContact CD-CE2 3.45Å; P615-F619 HydrophobicContact CG-CD1 3.84Å; P615-F619 HydrophobicContact CG-CD2 4.48Å; P615-F619 HydrophobicContact CG-CE1 3.85Å; P615-F619 HydrophobicContact CG-CE2 4.5Å; P615-F619 HydrophobicContact CG-CG 4.18Å; P615-F619 HydrophobicContact CG-CZ 4.2Å; P615-L700 WeakPolarHBondContact CB-O 3.44Å; P615-R702 HydrophobicContact CB-CB 4.24Å; P615-R702 HydrophobicContact CB-CG 4.34Å; P615-R702 HydrophobicContact CG-CB 4.32Å
616	L	94.6	Very high	93.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.7	-173.7	-167.9	66.4	0	0	0	113.6	L535 F609 Y665 T668 L669 L672 L700	L535-L616 HydrophobicContact CD2-CD1 4.07Å; F609-L616 HydrophobicContact CD1-CB 4.45Å; F609-L616 HydrophobicContact CD1-CD1 4.48Å; F609-L616 HydrophobicContact CD1-CD2 4.02Å; F609-L616 HydrophobicContact CE1-CD1 4.22Å; F609-L616 HydrophobicContact CE1-CD2 3.72Å; F609-L616 HydrophobicContact CE1-CG 4.49Å; F609-L616 HydrophobicContact CZ-CD2 4.39Å; L616-Y665 HydrophobicContact CD1-CD1 3.99Å; L616-T668 HydrophobicContact CD1-CG2 3.87Å; L616-T668 HydrophobicContact CD2-CG2 4.42Å; L616-L669 HydrophobicContact CD2-CB 3.97Å; L616-L669 HydrophobicContact CD2-CD1 3.87Å; L616-L669 HydrophobicContact CG-CB 4.24Å; L616-L669 HydrophobicContact CG-CD1 4.42Å; L616-L672 HydrophobicContact CD2-CD2 4.15Å; L616-L700 HydrophobicContact CB-CD2 4.03Å; L616-L700 HydrophobicContact CD2-CD2 3.84Å; L616-L700 PolarHBondContact N-O 2.98Å
617	L	95.1	Very high	92.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	18.5	174.4	-70.9	168.5	0	0	0	113.5	P615 F625 L658 L661 L669 L700 L701	P615-L617 PolarHBondContact O-N 2.99Å; P615-L617 VanDerWaalsContact O-N 3.13Å; L617-F625 HydrophobicContact CB-CD2 3.99Å; L617-F625 HydrophobicContact CB-CE2 3.95Å; L617-F625 HydrophobicContact CD2-CD2 4.37Å; L617-F625 HydrophobicContact CD2-CE1 4.14Å; L617-F625 HydrophobicContact CD2-CE2 3.82Å; L617-F625 HydrophobicContact CD2-CZ 3.7Å; L617-F625 HydrophobicContact CG-CE2 4.47Å; L617-F625 WeakPolarHBondContact O-CD2 3.47Å; L617-F625 WeakPolarHBondContact O-CE2 3.46Å; L617-L658 HydrophobicContact CD2-CD2 4.28Å; L617-L661 HydrophobicContact CD2-CD1 4.19Å; L617-L669 HydrophobicContact CD2-CD1 4.2Å; L617-L669 HydrophobicContact CD2-CD2 3.57Å; L617-L669 HydrophobicContact CG-CD1 4.43Å; L617-L700 HydrophobicContact CD1-CB 4.17Å; L617-L700 PolarHBondContact N-O 3.4Å; L617-L701 HydrophobicContact CB-CD2 3.63Å; L617-L701 HydrophobicContact CB-CG 4Å; L617-L701 HydrophobicContact CD1-CD1 3.91Å; L617-L701 HydrophobicContact CD1-CD2 4.16Å; L617-L701 HydrophobicContact CD1-CG 3.73Å; L617-L701 HydrophobicContact CG-CG 4.49Å
618	T	93.4	Very high	92.9	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.043	21%	0.206	C	C	.	.			trans	55.6	161.7	-179.3	68.2	0	0	0	0	116.4	E614 P615 L621 L661 Y665	E614-T618 HydrophobicContact CG-CG2 4.16Å; E614-T618 WeakPolarHBondContact OE1-CA 3.44Å; E614-T618 WeakPolarHBondContact OE1-CB 3.47Å; P615-T618 WeakPolarHBondContact O-CA 3.3Å; P615-T618 PolarHBondContact O-N 3Å; T618-L621 WeakPolarHBondContact OG1-CB 3.32Å; T618-L621 WeakPolarHBondContact OG1-CG 3.09Å; T618-L661 HydrophobicContact CG2-CD2 3.82Å; T618-Y665 HydrophobicContact CG2-CD1 4.48Å
619	F	91.6	Very high	92.8	Very high	49 Å²	49	39.5 Å²	39.5	22%	0.215	21%	0.206	C	C	.	.	S	Bend	trans	-77.6	-39.9	172.5	-71.3	-61.2	0	0	0	111.6	P613 E614 P615 L621 Y622 R702 L704	P613-F619 WeakPolarHBondContact O-CE2 3.26Å; E614-F619 HydrophobicContact CG-CD2 4.48Å; E614-F619 PolarHBondContact OE1-N 3.12Å; P615-F619 VanDerWaalsContact CD-CE2 3.45Å; P615-F619 HydrophobicContact CG-CD1 3.84Å; P615-F619 HydrophobicContact CG-CD2 4.48Å; P615-F619 HydrophobicContact CG-CE1 3.85Å; P615-F619 HydrophobicContact CG-CE2 4.5Å; P615-F619 HydrophobicContact CG-CG 4.18Å; P615-F619 HydrophobicContact CG-CZ 4.2Å; F619-L621 VanDerWaalsContact C-N 3.33Å; F619-L621 PolarHBondContact O-N 2.94Å; F619-Y622 VanDerWaalsContact O-CB 3.25Å; F619-Y622 WeakPolarHBondContact O-CB 3.32Å; F619-Y622 PolarHBondContact O-N 3.46Å; F619-R702 WeakPolarHBondContact CD1-O 3.27Å; F619-R702 HydrophobicContact CE1-CB 4.31Å; F619-R702 WeakPolarHBondContact CE1-O 3.42Å; F619-L704 HydrophobicContact CB-CD1 4.45Å; F619-L704 HydrophobicContact CD1-CB 3.83Å; F619-L704 HydrophobicContact CD1-CD1 3.96Å; F619-L704 HydrophobicContact CD1-CG 4.49Å; F619-L704 HydrophobicContact CD2-CD1 3.87Å; F619-L704 HydrophobicContact CE1-CB 4.24Å; F619-L704 HydrophobicContact CE1-CD1 4.07Å; F619-L704 HydrophobicContact CE2-CD1 3.97Å; F619-L704 HydrophobicContact CG-CB 4.29Å; F619-L704 HydrophobicContact CG-CD1 3.85Å; F619-L704 HydrophobicContact CZ-CD1 4.06Å
620	D	91.7	Very high	92.6	Very high	144 Å²	144	43.7 Å²	43.7	77%	0.77	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-38.1	-176.5	-71	-11	0	0	0	112.7
621	L	93.3	Very high	92.6	Very high	15 Å²	15	40.9 Å²	40.9	8%	0.079	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-5	-178.6	-57	179.3	0	0	0	113.6	T618 F619 N623 E624 F625 K660 L661	T618-L621 WeakPolarHBondContact OG1-CB 3.32Å; T618-L621 WeakPolarHBondContact OG1-CG 3.09Å; F619-L621 VanDerWaalsContact C-N 3.33Å; F619-L621 PolarHBondContact O-N 2.94Å; L621-N623 VanDerWaalsContact C-N 3.29Å; L621-N623 PolarHBondContact O-N 2.75Å; L621-E624 WeakPolarHBondContact CD2-OE1 3.48Å; L621-E624 PolarHBondContact O-N 2.86Å; L621-F625 HydrophobicContact CB-CD2 3.67Å; L621-F625 HydrophobicContact CB-CE2 3.47Å; L621-F625 VanDerWaalsContact CB-CE2 3.47Å; L621-F625 HydrophobicContact CD1-CE2 3.93Å; L621-F625 HydrophobicContact CD1-CZ 4.39Å; L621-F625 HydrophobicContact CG-CE2 4.36Å; L621-F625 WeakPolarHBondContact O-CD2 3.46Å; L621-F625 PolarHBondContact O-N 3.41Å; L621-K660 HydrophobicContact CD1-CB 3.81Å; L621-K660 HydrophobicContact CD2-CB 4.04Å; L621-K660 HydrophobicContact CD2-CD 3.57Å; L621-K660 HydrophobicContact CD2-CG 4.5Å; L621-L661 HydrophobicContact CD1-CD2 3.75Å; L621-L661 HydrophobicContact CD1-CG 4.09Å
622	Y	92.8	Very high	92.6	Very high	13 Å²	13	37.1 Å²	37.1	5%	0.051	20%	0.197	C	C	.	.	H	α-helix	trans	-49.2	-48.7	-176.5	179.4	-93.2	0	0	0	112.2	F619 E624 F625 I626 L701 P703 E716 Q720	F619-Y622 VanDerWaalsContact O-CB 3.25Å; F619-Y622 WeakPolarHBondContact O-CB 3.32Å; F619-Y622 PolarHBondContact O-N 3.46Å; Y622-E624 PolarHBondContact O-N 2.76Å; Y622-F625 PolarHBondContact O-N 3.05Å; Y622-I626 HydrophobicContact CD1-CG1 3.99Å; Y622-I626 HydrophobicContact CD2-CG1 4.43Å; Y622-I626 HydrophobicContact CE1-CD1 4.36Å; Y622-I626 HydrophobicContact CE1-CG1 3.63Å; Y622-I626 HydrophobicContact CE2-CD1 4.18Å; Y622-I626 HydrophobicContact CE2-CG1 4.1Å; Y622-I626 HydrophobicContact CG-CG1 4.38Å; Y622-I626 VanDerWaalsContact O-CG1 3.29Å; Y622-I626 WeakPolarHBondContact O-CG1 3.46Å; Y622-I626 PolarHBondContact O-N 3.43Å; Y622-L701 HydrophobicContact CD2-CB 4.24Å; Y622-L701 HydrophobicContact CD2-CD2 3.81Å; Y622-L701 HydrophobicContact CE2-CB 4.11Å; Y622-L701 HydrophobicContact CE2-CD2 4.42Å; Y622-P703 HydrophobicContact CE1-CB 4.16Å; Y622-P703 HydrophobicContact CE2-CB 4.31Å; Y622-E716 WeakPolarHBondContact CE1-OE2 3.22Å; Y622-E716 PolarHBondContact OH-OE2 2.77Å; Y622-Q720 PolarHBondContact OH-NE2 2.71Å
623	N	91.6	Very high	92.6	Very high	127 Å²	127	38.6 Å²	38.6	68%	0.679	20%	0.204	S	C	*	.	H	α-helix	trans	-66.4	-34.3	-178.1	-66.3	-51.2	0	0	0	113.1	L621 G627	L621-N623 VanDerWaalsContact C-N 3.29Å; L621-N623 PolarHBondContact O-N 2.75Å; N623-G627 PolarHBondContact O-N 3.22Å
624	E	94.9	Very high	92.5	Very high	78 Å²	78	41 Å²	41	36%	0.364	21%	0.209	S	C	.	.	H	α-helix	trans	-71.4	-40.4	176.2	-62.1	-170.8	-103.9	0	0	110.9	L621 Y622 G627 L628 L657 K660	L621-E624 WeakPolarHBondContact CD2-OE1 3.48Å; L621-E624 PolarHBondContact O-N 2.86Å; Y622-E624 PolarHBondContact O-N 2.76Å; E624-G627 PolarHBondContact O-N 3.48Å; E624-L628 PolarHBondContact O-N 3.19Å; E624-L657 HydrophobicContact CB-CD1 3.68Å; E624-L657 HydrophobicContact CB-CD2 3.95Å; E624-L657 HydrophobicContact CB-CG 4.49Å; E624-L657 HydrophobicContact CG-CD2 4.46Å; E624-L657 WeakPolarHBondContact OE2-CD2 3.49Å; E624-K660 IonicContact OE1-NZ 3.25Å; E624-K660 PolarHBondContact OE1-NZ 3.16Å; E624-K660 IonicContact OE2-NZ 3.65Å; E624-K660 PolarHBondContact OE2-NZ 3.06Å
625	F	95.5	Very high	92.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-46	175.2	-76.4	-55.5	0	0	0	112.7	L617 L621 Y622 G627 L628 G629 L654 L657 L658 L701 L723	L617-F625 HydrophobicContact CB-CD2 3.99Å; L617-F625 HydrophobicContact CB-CE2 3.95Å; L617-F625 HydrophobicContact CD2-CD2 4.37Å; L617-F625 HydrophobicContact CD2-CE1 4.14Å; L617-F625 HydrophobicContact CD2-CE2 3.82Å; L617-F625 HydrophobicContact CD2-CZ 3.7Å; L617-F625 HydrophobicContact CG-CE2 4.47Å; L617-F625 WeakPolarHBondContact O-CD2 3.47Å; L617-F625 WeakPolarHBondContact O-CE2 3.46Å; L621-F625 HydrophobicContact CB-CD2 3.67Å; L621-F625 HydrophobicContact CB-CE2 3.47Å; L621-F625 VanDerWaalsContact CB-CE2 3.47Å; L621-F625 HydrophobicContact CD1-CE2 3.93Å; L621-F625 HydrophobicContact CD1-CZ 4.39Å; L621-F625 HydrophobicContact CG-CE2 4.36Å; L621-F625 WeakPolarHBondContact O-CD2 3.46Å; L621-F625 PolarHBondContact O-N 3.41Å; Y622-F625 PolarHBondContact O-N 3.05Å; F625-G627 PolarHBondContact O-N 2.92Å; F625-L628 PolarHBondContact O-N 3.45Å; F625-L628 VanDerWaalsContact O-N 3.13Å; F625-G629 PolarHBondContact O-N 3.45Å; F625-L654 HydrophobicContact CD1-CD1 4.32Å; F625-L654 HydrophobicContact CE1-CD1 3.99Å; F625-L657 HydrophobicContact CD1-CD1 3.94Å; F625-L657 HydrophobicContact CE1-CB 3.81Å; F625-L657 HydrophobicContact CE1-CD1 4.07Å; F625-L657 HydrophobicContact CG-CD1 4.5Å; F625-L657 HydrophobicContact CZ-CB 4.06Å; F625-L658 HydrophobicContact CE1-CD2 4.15Å; F625-L658 HydrophobicContact CZ-CD2 4.12Å; F625-L701 HydrophobicContact CB-CD2 4.07Å; F625-L701 HydrophobicContact CD2-CD2 4.33Å; F625-L723 HydrophobicContact CB-CD2 3.64Å; F625-L723 HydrophobicContact CD1-CD2 3.87Å; F625-L723 HydrophobicContact CG-CD2 4.1Å
626	I	94.1	Very high	91.6	Very high	7 Å²	7	44 Å²	44	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-35	172.4	-64	-62.9	0	0	0	111.1	Y622 G629 K630 E716 Y719 Q720	Y622-I626 HydrophobicContact CD1-CG1 3.99Å; Y622-I626 HydrophobicContact CD2-CG1 4.43Å; Y622-I626 HydrophobicContact CE1-CD1 4.36Å; Y622-I626 HydrophobicContact CE1-CG1 3.63Å; Y622-I626 HydrophobicContact CE2-CD1 4.18Å; Y622-I626 HydrophobicContact CE2-CG1 4.1Å; Y622-I626 HydrophobicContact CG-CG1 4.38Å; Y622-I626 VanDerWaalsContact O-CG1 3.29Å; Y622-I626 WeakPolarHBondContact O-CG1 3.46Å; Y622-I626 PolarHBondContact O-N 3.43Å; I626-G629 PolarHBondContact O-N 2.83Å; I626-K630 WeakPolarHBondContact O-CG 3.25Å; I626-K630 PolarHBondContact O-N 3.21Å; I626-E716 HydrophobicContact CG2-CG 4.31Å; I626-Y719 HydrophobicContact CG2-CD2 4.06Å; I626-Q720 HydrophobicContact CD1-CG 3.52Å
627	G	92.9	Very high	90.9	Very high	30 Å²	30	49 Å²	49	31%	0.309	26%	0.256	S	S	.	.	H	α-helix	trans	-57.8	-45.9	171.7	0	0	0	0	0	113	N623 E624 F625 I631	N623-G627 PolarHBondContact O-N 3.22Å; E624-G627 PolarHBondContact O-N 3.48Å; F625-G627 PolarHBondContact O-N 2.92Å; G627-I631 WeakPolarHBondContact O-CG1 3.42Å; G627-I631 PolarHBondContact O-N 3.31Å
628	L	93.9	Very high	89.9	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-39.3	173.1	-65.1	-171.2	0	0	0	112.5	E624 F625 K630 I631 I632 K653 L654 L657 L723	E624-L628 PolarHBondContact O-N 3.19Å; F625-L628 PolarHBondContact O-N 3.45Å; F625-L628 VanDerWaalsContact O-N 3.13Å; L628-K630 VanDerWaalsContact C-N 3.26Å; L628-K630 PolarHBondContact O-N 3.05Å; L628-I631 HydrophobicContact CD2-CD1 4.32Å; L628-I631 PolarHBondContact O-N 3.22Å; L628-I631 VanDerWaalsContact O-N 3.08Å; L628-I632 VanDerWaalsContact O-CG1 3.3Å; L628-I632 WeakPolarHBondContact O-CG1 3.29Å; L628-I632 PolarHBondContact O-N 3.41Å; L628-K653 HydrophobicContact CD1-CB 4.48Å; L628-K653 HydrophobicContact CD2-CB 4.03Å; L628-K653 HydrophobicContact CD2-CD 4.46Å; L628-L654 HydrophobicContact CD1-CB 3.95Å; L628-L654 HydrophobicContact CD1-CD1 3.97Å; L628-L657 HydrophobicContact CD1-CD1 3.54Å; L628-L657 HydrophobicContact CD1-CG 4.21Å; L628-L657 HydrophobicContact CG-CD1 3.94Å; L628-L723 HydrophobicContact CB-CD1 4.37Å
629	G	93.5	Very high	87.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57	-37.4	176.5	0	0	0	0	0	113.4	F625 I626 Q633	F625-G629 PolarHBondContact O-N 3.45Å; I626-G629 PolarHBondContact O-N 2.83Å; G629-Q633 WeakPolarHBondContact O-CB 3.39Å; G629-Q633 PolarHBondContact O-N 3.1Å
630	K	92.4	Very high	86.6	Confident	89 Å²	89	61.4 Å²	61.4	39%	0.387	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-45.1	172.3	-72.7	170.8	178	178.7	0	112.7	I626 L628 Q633 H634 Y719	I626-K630 WeakPolarHBondContact O-CG 3.25Å; I626-K630 PolarHBondContact O-N 3.21Å; L628-K630 VanDerWaalsContact C-N 3.26Å; L628-K630 PolarHBondContact O-N 3.05Å; K630-Q633 PolarHBondContact O-N 2.88Å; K630-H634 PolarHBondContact O-N 3.27Å; K630-Y719 HydrophobicContact CB-CD1 4.35Å; K630-Y719 HydrophobicContact CB-CE1 4.37Å; K630-Y719 HydrophobicContact CD-CD2 4.32Å; K630-Y719 HydrophobicContact CD-CE2 4.14Å; K630-Y719 HydrophobicContact CG-CD1 3.71Å; K630-Y719 HydrophobicContact CG-CD2 3.65Å; K630-Y719 HydrophobicContact CG-CE1 3.66Å; K630-Y719 HydrophobicContact CG-CE2 3.63Å; K630-Y719 HydrophobicContact CG-CG 3.73Å
631	I	92	Very high	85.1	Confident	69 Å²	69	59 Å²	59	35%	0.354	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-42.3	179	-60.6	169.3	0	0	0	110.4	G627 L628 H634 L635 I650	G627-I631 WeakPolarHBondContact O-CG1 3.42Å; G627-I631 PolarHBondContact O-N 3.31Å; L628-I631 HydrophobicContact CD2-CD1 4.32Å; L628-I631 PolarHBondContact O-N 3.22Å; L628-I631 VanDerWaalsContact O-N 3.08Å; I631-H634 PolarHBondContact O-N 3.01Å; I631-L635 PolarHBondContact O-N 3.11Å; I631-I650 HydrophobicContact CG2-CD1 3.83Å; I631-I650 HydrophobicContact CG2-CG1 4.14Å
632	I	91	Very high	83.8	Confident	9 Å²	9	61 Å²	61	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-45.2	175.5	-67.6	161.4	0	0	0	110.8	L628 L635 S636 I650 M722 L723 F726	L628-I632 VanDerWaalsContact O-CG1 3.3Å; L628-I632 WeakPolarHBondContact O-CG1 3.29Å; L628-I632 PolarHBondContact O-N 3.41Å; I632-L635 PolarHBondContact O-N 3.32Å; I632-S636 PolarHBondContact O-N 2.98Å; I632-S636 VanDerWaalsContact O-N 3.13Å; I632-I650 HydrophobicContact CD1-CG2 4.15Å; I632-I650 HydrophobicContact CG1-CD1 4.03Å; I632-I650 HydrophobicContact CG1-CG2 3.87Å; I632-M722 HydrophobicContact CG2-CB 4.12Å; I632-M722 HydrophobicContact CG2-CE 4.25Å; I632-L723 HydrophobicContact CD1-CD1 3.79Å; I632-F726 HydrophobicContact CD1-CB 3.83Å; I632-F726 HydrophobicContact CD1-CD1 4.09Å; I632-F726 HydrophobicContact CD1-CD2 4.18Å; I632-F726 HydrophobicContact CD1-CG 3.79Å; I632-F726 HydrophobicContact CG1-CB 4.46Å; I632-F726 HydrophobicContact CG1-CD2 4Å; I632-F726 HydrophobicContact CG1-CE2 4.35Å; I632-F726 HydrophobicContact CG1-CG 4.13Å; I632-F726 HydrophobicContact CG2-CB 4.12Å; I632-F726 HydrophobicContact CG2-CD2 3.9Å; I632-F726 HydrophobicContact CG2-CG 4.31Å
633	Q	89.3	Confident	82.8	Confident	36 Å²	36	65.5 Å²	65.5	17%	0.168	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-47.4	177.8	-177.3	169	-29.9	0	0	111.5	G629 K630 L635 S636 E637 S718 Y719 M722	G629-Q633 WeakPolarHBondContact O-CB 3.39Å; G629-Q633 PolarHBondContact O-N 3.1Å; K630-Q633 PolarHBondContact O-N 2.88Å; Q633-L635 VanDerWaalsContact C-N 3.33Å; Q633-L635 PolarHBondContact O-N 3.27Å; Q633-S636 CarbonylContact O-C 3.53Å; Q633-S636 WeakPolarHBondContact O-CA 3.39Å; Q633-S636 WeakPolarHBondContact O-CB 3.25Å; Q633-S636 PolarHBondContact O-N 3.07Å; Q633-E637 HydrophobicContact CG-CG 4.38Å; Q633-E637 VanDerWaalsContact CG-OE1 3.26Å; Q633-E637 WeakPolarHBondContact CG-OE1 3.5Å; Q633-E637 PolarHBondContact NE2-OE1 3.46Å; Q633-E637 WeakPolarHBondContact O-CG 3.37Å; Q633-E637 PolarHBondContact O-N 3.47Å; Q633-S718 PolarHBondContact OE1-OG 2.76Å; Q633-Y719 HydrophobicContact CB-CD1 4.24Å; Q633-Y719 HydrophobicContact CB-CE1 4.34Å; Q633-Y719 VanDerWaalsContact OE1-CD1 3.27Å; Q633-Y719 VanDerWaalsContact OE1-CE1 3.22Å; Q633-M722 HydrophobicContact CB-CG 4.28Å
634	H	86.1	Confident	82.2	Confident	122 Å²	122	63.1 Å²	63.1	57%	0.565	34%	0.341	S	S	*	.	H	α-helix	trans	-63.1	-32.1	177	-74.1	-35.3	0	0	0	114.2	K630 I631 S636 E637 K638	K630-H634 PolarHBondContact O-N 3.27Å; I631-H634 PolarHBondContact O-N 3.01Å; H634-S636 VanDerWaalsContact C-N 3.29Å; H634-E637 IonicContact CE1-OE2 2.58Å; H634-E637 IonicContact CG-OE2 2.92Å; H634-E637 IonicContact ND1-OE2 3.69Å; H634-E637 PolarHBondContact ND1-OE2 3.33Å; H634-E637 PolarHBondContact O-N 2.86Å; H634-K638 PolarHBondContact O-N 3.42Å
635	L	84.3	Confident	81.5	Confident	30 Å²	30	65 Å²	65	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-68.8	-28.2	170.5	-69.5	-159.4	0	0	0	112.8	I631 I632 Q633 E646 I650	I631-L635 PolarHBondContact O-N 3.11Å; I632-L635 PolarHBondContact O-N 3.32Å; Q633-L635 VanDerWaalsContact C-N 3.33Å; Q633-L635 PolarHBondContact O-N 3.27Å; L635-E646 HydrophobicContact CD1-CB 3.83Å; L635-E646 HydrophobicContact CD2-CB 4.48Å; L635-I650 HydrophobicContact CD1-CD1 3.44Å; L635-I650 VanDerWaalsContact CD1-CD1 3.44Å; L635-I650 HydrophobicContact CD1-CG1 4.47Å; L635-I650 HydrophobicContact CG-CD1 4.09Å
636	S	79.3	Confident	81	Confident	85 Å²	85	67.9 Å²	67.9	59%	0.594	37%	0.367	S	S	*	.	H	α-helix	trans	-81.8	-18.3	177.4	-170	0	0	0	0	113.8	I632 Q633 H634	I632-S636 PolarHBondContact O-N 2.98Å; I632-S636 VanDerWaalsContact O-N 3.13Å; Q633-S636 CarbonylContact O-C 3.53Å; Q633-S636 WeakPolarHBondContact O-CA 3.39Å; Q633-S636 WeakPolarHBondContact O-CB 3.25Å; Q633-S636 PolarHBondContact O-N 3.07Å; H634-S636 VanDerWaalsContact C-N 3.29Å
637	E	79.9	Confident	80.7	Confident	105 Å²	105	69.1 Å²	69.1	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-89.3	-20.7	178.5	-70.5	163.2	163.5	0	0	112.4	Q633 H634 E639	Q633-E637 HydrophobicContact CG-CG 4.38Å; Q633-E637 VanDerWaalsContact CG-OE1 3.26Å; Q633-E637 WeakPolarHBondContact CG-OE1 3.5Å; Q633-E637 PolarHBondContact NE2-OE1 3.46Å; Q633-E637 WeakPolarHBondContact O-CG 3.37Å; Q633-E637 PolarHBondContact O-N 3.47Å; H634-E637 IonicContact CE1-OE2 2.58Å; H634-E637 IonicContact CG-OE2 2.92Å; H634-E637 IonicContact ND1-OE2 3.69Å; H634-E637 PolarHBondContact ND1-OE2 3.33Å; H634-E637 PolarHBondContact O-N 2.86Å; E637-E639 PolarHBondContact O-N 2.86Å
638	K	75.4	Confident	80.5	Confident	89 Å²	89	70.7 Å²	70.7	39%	0.387	37%	0.374	S	S	.	.			trans	-69.8	117	178.5	-172	176.7	176	-176	0	110.5	H634 T640 E646	H634-K638 PolarHBondContact O-N 3.42Å; K638-T640 PolarHBondContact O-N 3.08Å; K638-E646 IonicContact NZ-OE1 3.52Å; K638-E646 PolarHBondContact NZ-OE1 2.72Å; K638-E646 IonicContact NZ-OE2 2.66Å; K638-E646 PolarHBondContact NZ-OE2 3.02Å
639	E	51.2	Low	80.3	Confident	138 Å²	138	73.4 Å²	73.4	65%	0.645	39%	0.389	S	S	*	.	S	Bend	trans	-65.9	-22.5	-175.9	-67	-165.3	137.3	0	0	114.6	R33 E637	R33-E639 WeakPolarHBondContact CD-OE1 3.42Å; R33-E639 IonicContact CZ-OE1 2.76Å; R33-E639 IonicContact CZ-OE2 2.69Å; R33-E639 IonicContact NE-OE1 3.99Å; R33-E639 IonicContact NE-OE2 2.82Å; R33-E639 IonicContact NH1-OE1 3.83Å; R33-E639 PolarHBondContact NH1-OE1 3.25Å; R33-E639 IonicContact NH1-OE2 2.72Å; R33-E639 PolarHBondContact NH1-OE2 3.23Å; R33-E639 IonicContact NH2-OE1 2.77Å; R33-E639 IonicContact NH2-OE2 3.2Å; R33-E639 PolarHBondContact NH2-OE2 3.44Å; E637-E639 PolarHBondContact O-N 2.86Å
640	T	63.2	Low	80.3	Confident	90 Å²	90	73.5 Å²	73.5	55%	0.552	39%	0.389	S	S	*	.	S	Bend	trans	-74.3	129	170.5	-50.9	0	0	0	0	109.1	K638	K638-T640 PolarHBondContact O-N 3.08Å
641	S	59.9	Low	80.3	Confident	94 Å²	94	69.5 Å²	69.5	66%	0.657	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-47.9	125.3	174.5	53.8	0	0	0	0	110.9	E643	S641-E643 PolarHBondContact O-N 3.41Å
642	P	66.3	Low	80.4	Confident	58 Å²	58	71.5 Å²	71.5	38%	0.377	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-59.1	129.8	-172.3	21.1	-32.9	0	0	0	111	I647	P642-I647 HydrophobicContact CB-CD1 4.24Å; P642-I647 HydrophobicContact CB-CG1 4.22Å; P642-I647 HydrophobicContact CG-CD1 4.11Å
643	E	73.3	Confident	80.5	Confident	106 Å²	106	75 Å²	75	50%	0.495	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-60.8	136.1	-179.6	-75.8	-67.9	157.4	0	0	109.4	S641 N645 E646 I647	S641-E643 PolarHBondContact O-N 3.41Å; E643-N645 PolarHBondContact O-N 2.94Å; E643-E646 HydrophobicContact CB-CG 4.05Å; E643-E646 WeakPolarHBondContact O-CB 3.46Å; E643-E646 PolarHBondContact O-N 2.8Å; E643-I647 PolarHBondContact O-N 3.04Å
644	P	77	Confident	80.7	Confident	77 Å²	77	73.3 Å²	73.3	50%	0.5	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-25.4	-175.9	23.3	-33.5	0	0	0	112.5	L648	P644-L648 WeakPolarHBondContact O-CB 3.35Å; P644-L648 VanDerWaalsContact O-CG 3.24Å; P644-L648 WeakPolarHBondContact O-CG 3.38Å; P644-L648 PolarHBondContact O-N 3.5Å; P644-L648 VanDerWaalsContact O-N 3.07Å
645	N	80.7	Confident	81.1	Confident	118 Å²	118	69.9 Å²	69.9	63%	0.631	37%	0.371	S	S	*	.	H	α-helix	trans	-69.6	-35.8	174.4	-62.9	-28.5	0	0	0	113	E643 L648 D649	E643-N645 PolarHBondContact O-N 2.94Å; N645-L648 PolarHBondContact O-N 3.04Å; N645-D649 PolarHBondContact O-N 2.77Å
646	E	84.7	Confident	81.6	Confident	60 Å²	60	75.9 Å²	75.9	28%	0.28	40%	0.396	S	S	.	.	H	α-helix	trans	-67.4	-41.8	176.8	-65.8	179	160.9	0	0	110.4	L635 K638 E643 D649 I650	L635-E646 HydrophobicContact CD1-CB 3.83Å; L635-E646 HydrophobicContact CD2-CB 4.48Å; K638-E646 IonicContact NZ-OE1 3.52Å; K638-E646 PolarHBondContact NZ-OE1 2.72Å; K638-E646 IonicContact NZ-OE2 2.66Å; K638-E646 PolarHBondContact NZ-OE2 3.02Å; E643-E646 HydrophobicContact CB-CG 4.05Å; E643-E646 WeakPolarHBondContact O-CB 3.46Å; E643-E646 PolarHBondContact O-N 2.8Å; E646-D649 PolarHBondContact O-N 2.81Å; E646-I650 PolarHBondContact O-N 3.19Å; E646-I650 VanDerWaalsContact O-N 3.17Å
647	I	87.8	Confident	82.3	Confident	33 Å²	33	72.5 Å²	72.5	17%	0.169	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-43.6	175.2	-56.9	176.4	0	0	0	110.9	P642 E643 I650 I651 F726	P642-I647 HydrophobicContact CB-CD1 4.24Å; P642-I647 HydrophobicContact CB-CG1 4.22Å; P642-I647 HydrophobicContact CG-CD1 4.11Å; E643-I647 PolarHBondContact O-N 3.04Å; I647-I650 PolarHBondContact O-N 3Å; I647-I651 HydrophobicContact CG2-CD1 3.97Å; I647-I651 WeakPolarHBondContact O-CG1 3.39Å; I647-I651 PolarHBondContact O-N 3.36Å; I647-F726 HydrophobicContact CG2-CE2 4.32Å; I647-F726 HydrophobicContact CG2-CZ 4.13Å
648	L	89.1	Confident	83	Confident	64 Å²	64	67.6 Å²	67.6	34%	0.335	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-38.9	178.6	-74.6	169.5	0	0	0	112.4	P644 N645 I651 H652	P644-L648 WeakPolarHBondContact O-CB 3.35Å; P644-L648 VanDerWaalsContact O-CG 3.24Å; P644-L648 WeakPolarHBondContact O-CG 3.38Å; P644-L648 PolarHBondContact O-N 3.5Å; P644-L648 VanDerWaalsContact O-N 3.07Å; N645-L648 PolarHBondContact O-N 3.04Å; L648-I651 PolarHBondContact O-N 3.3Å; L648-H652 PolarHBondContact O-N 3.25Å; L648-H652 PolarHBondContact O-ND1 2.75Å
649	D	91.1	Very high	83.9	Confident	70 Å²	70	71.3 Å²	71.3	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-61.9	-42.2	173.7	173	54.4	0	0	0	112.2	N645 E646 I651 H652 K653	N645-D649 PolarHBondContact O-N 2.77Å; E646-D649 PolarHBondContact O-N 2.81Å; D649-I651 PolarHBondContact O-N 2.94Å; D649-H652 PolarHBondContact O-N 3.01Å; D649-K653 WeakPolarHBondContact O-CB 3.5Å; D649-K653 VanDerWaalsContact O-CG 3.3Å; D649-K653 WeakPolarHBondContact O-CG 3.34Å; D649-K653 PolarHBondContact O-N 2.95Å; D649-K653 WeakPolarHBondContact OD1-CE 3.49Å; D649-K653 IonicContact OD1-NZ 3.14Å; D649-K653 PolarHBondContact OD1-NZ 3.32Å; D649-K653 VanDerWaalsContact OD2-CE 3.28Å; D649-K653 WeakPolarHBondContact OD2-CE 3.47Å; D649-K653 IonicContact OD2-NZ 3.72Å; D649-K653 PolarHBondContact OD2-NZ 3.01Å
650	I	91.9	Very high	85.9	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-61.8	-43.5	172.3	-63.3	178.1	0	0	0	111.2	I631 I632 L635 E646 I647 H652 K653 L654 F726	I631-I650 HydrophobicContact CG2-CD1 3.83Å; I631-I650 HydrophobicContact CG2-CG1 4.14Å; I632-I650 HydrophobicContact CD1-CG2 4.15Å; I632-I650 HydrophobicContact CG1-CD1 4.03Å; I632-I650 HydrophobicContact CG1-CG2 3.87Å; L635-I650 HydrophobicContact CD1-CD1 3.44Å; L635-I650 VanDerWaalsContact CD1-CD1 3.44Å; L635-I650 HydrophobicContact CD1-CG1 4.47Å; L635-I650 HydrophobicContact CG-CD1 4.09Å; E646-I650 PolarHBondContact O-N 3.19Å; E646-I650 VanDerWaalsContact O-N 3.17Å; I647-I650 PolarHBondContact O-N 3Å; I650-H652 PolarHBondContact O-N 3.42Å; I650-K653 PolarHBondContact O-N 3.09Å; I650-L654 VanDerWaalsContact O-CB 3.23Å; I650-L654 WeakPolarHBondContact O-CB 3.4Å; I650-L654 PolarHBondContact O-N 3.23Å; I650-F726 HydrophobicContact CB-CE1 4.32Å; I650-F726 HydrophobicContact CB-CZ 3.83Å; I650-F726 HydrophobicContact CG2-CD1 4.29Å; I650-F726 HydrophobicContact CG2-CE1 3.54Å; I650-F726 HydrophobicContact CG2-CE2 4.14Å; I650-F726 HydrophobicContact CG2-CZ 3.44Å; I650-F726 VanDerWaalsContact CG2-CZ 3.44Å
651	I	93.3	Very high	87.4	Confident	4 Å²	4	66 Å²	66	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-46.4	177.3	-70.4	165.9	0	0	0	110.8	I647 L648 D649 K653 L654 Q655 F726 H730 R733 I734	I647-I651 HydrophobicContact CG2-CD1 3.97Å; I647-I651 WeakPolarHBondContact O-CG1 3.39Å; I647-I651 PolarHBondContact O-N 3.36Å; L648-I651 PolarHBondContact O-N 3.3Å; D649-I651 PolarHBondContact O-N 2.94Å; I651-K653 PolarHBondContact O-N 3.43Å; I651-L654 PolarHBondContact O-N 3.31Å; I651-Q655 HydrophobicContact CG2-CG 4.49Å; I651-Q655 WeakPolarHBondContact O-CB 3.2Å; I651-Q655 VanDerWaalsContact O-CG 3.32Å; I651-Q655 WeakPolarHBondContact O-CG 3.44Å; I651-Q655 PolarHBondContact O-N 3.09Å; I651-F726 HydrophobicContact CG1-CE1 3.9Å; I651-F726 HydrophobicContact CG1-CZ 4.03Å; I651-H730 HydrophobicContact CD1-CB 4.26Å; I651-R733 HydrophobicContact CD1-CB 3.98Å; I651-R733 HydrophobicContact CG2-CB 4.36Å; I651-I734 HydrophobicContact CG1-CG1 4.23Å; I651-I734 HydrophobicContact CG2-CG1 4.12Å
652	H	92.9	Very high	88.9	Confident	111 Å²	111	64.2 Å²	64.2	51%	0.514	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-40.3	177.3	-65.4	126.7	0	0	0	112.7	L648 D649 I650 K656	L648-H652 PolarHBondContact O-N 3.25Å; L648-H652 PolarHBondContact O-ND1 2.75Å; D649-H652 PolarHBondContact O-N 3.01Å; I650-H652 PolarHBondContact O-N 3.42Å; H652-K656 WeakPolarHBondContact O-CB 3.23Å; H652-K656 PolarHBondContact O-N 3.07Å
653	K	93.4	Very high	90	Very high	83 Å²	83	65.2 Å²	65.2	36%	0.361	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-45	174.7	-75.3	166.7	174.3	168.5	0	111.5	L628 D649 I650 I651 K656 L657	L628-K653 HydrophobicContact CD1-CB 4.48Å; L628-K653 HydrophobicContact CD2-CB 4.03Å; L628-K653 HydrophobicContact CD2-CD 4.46Å; D649-K653 WeakPolarHBondContact O-CB 3.5Å; D649-K653 VanDerWaalsContact O-CG 3.3Å; D649-K653 WeakPolarHBondContact O-CG 3.34Å; D649-K653 PolarHBondContact O-N 2.95Å; D649-K653 WeakPolarHBondContact OD1-CE 3.49Å; D649-K653 IonicContact OD1-NZ 3.14Å; D649-K653 PolarHBondContact OD1-NZ 3.32Å; D649-K653 VanDerWaalsContact OD2-CE 3.28Å; D649-K653 WeakPolarHBondContact OD2-CE 3.47Å; D649-K653 IonicContact OD2-NZ 3.72Å; D649-K653 PolarHBondContact OD2-NZ 3.01Å; I650-K653 PolarHBondContact O-N 3.09Å; I651-K653 PolarHBondContact O-N 3.43Å; K653-K656 WeakPolarHBondContact O-CB 3.45Å; K653-K656 PolarHBondContact O-N 3.29Å; K653-L657 PolarHBondContact O-N 2.99Å
654	L	94.8	Very high	90.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-46.7	178.3	-177	53	0	0	0	111.2	F625 L628 I650 I651 K656 L657 L658 L723 F726 L727 I734	F625-L654 HydrophobicContact CD1-CD1 4.32Å; F625-L654 HydrophobicContact CE1-CD1 3.99Å; L628-L654 HydrophobicContact CD1-CB 3.95Å; L628-L654 HydrophobicContact CD1-CD1 3.97Å; I650-L654 VanDerWaalsContact O-CB 3.23Å; I650-L654 WeakPolarHBondContact O-CB 3.4Å; I650-L654 PolarHBondContact O-N 3.23Å; I651-L654 PolarHBondContact O-N 3.31Å; L654-K656 VanDerWaalsContact C-N 3.25Å; L654-K656 PolarHBondContact O-N 3.5Å; L654-L657 PolarHBondContact O-N 2.91Å; L654-L658 HydrophobicContact CD1-CD1 4.32Å; L654-L658 HydrophobicContact CD1-CG 4.19Å; L654-L658 HydrophobicContact CG-CD1 4.11Å; L654-L658 HydrophobicContact CG-CG 4.44Å; L654-L658 VanDerWaalsContact O-CG 3.29Å; L654-L658 WeakPolarHBondContact O-CG 3.41Å; L654-L658 PolarHBondContact O-N 3.45Å; L654-L723 HydrophobicContact CD1-CD1 4.06Å; L654-L723 HydrophobicContact CD2-CD1 4.44Å; L654-F726 HydrophobicContact CD2-CD1 3.91Å; L654-F726 HydrophobicContact CD2-CE1 4.17Å; L654-L727 HydrophobicContact CD1-CD2 4.36Å; L654-L727 HydrophobicContact CD2-CD2 3.86Å; L654-L727 HydrophobicContact CD2-CG 4.15Å; L654-L727 HydrophobicContact CG-CD2 4.32Å; L654-I734 HydrophobicContact CD2-CD1 3.66Å; L654-I734 HydrophobicContact CD2-CG1 4.26Å; L654-I734 HydrophobicContact CD2-CG2 4.47Å; L654-I734 HydrophobicContact CG-CG2 4.43Å
655	Q	94.7	Very high	91.6	Very high	50 Å²	50	59.1 Å²	59.1	23%	0.234	29%	0.291	C	S	.	.	H	α-helix	trans	-55.4	-38.5	171.3	-77.5	177.6	-26.4	0	0	112.9	I651 K659 R733 I734	I651-Q655 HydrophobicContact CG2-CG 4.49Å; I651-Q655 WeakPolarHBondContact O-CB 3.2Å; I651-Q655 VanDerWaalsContact O-CG 3.32Å; I651-Q655 WeakPolarHBondContact O-CG 3.44Å; I651-Q655 PolarHBondContact O-N 3.09Å; Q655-K659 WeakPolarHBondContact O-CB 3.28Å; Q655-K659 VanDerWaalsContact O-CG 3.28Å; Q655-K659 WeakPolarHBondContact O-CG 3.46Å; Q655-K659 PolarHBondContact O-N 2.96Å; Q655-K659 VanDerWaalsContact O-N 3.13Å; Q655-R733 PolarHBondContact NE2-O 3.48Å; Q655-I734 HydrophobicContact CG-CG2 4.47Å; Q655-I734 VanDerWaalsContact CG-O 3.31Å; Q655-I734 WeakPolarHBondContact CG-O 3.34Å; Q655-I734 PolarHBondContact NE2-O 2.8Å
656	K	94.4	Very high	92.2	Very high	156 Å²	156	56.1 Å²	56.1	68%	0.678	27%	0.271	S	S	*	.	H	α-helix	trans	-69	-33.3	176.7	-172.1	-179.7	178.4	-176.2	0	112.7	H652 K653 L654	H652-K656 WeakPolarHBondContact O-CB 3.23Å; H652-K656 PolarHBondContact O-N 3.07Å; K653-K656 WeakPolarHBondContact O-CB 3.45Å; K653-K656 PolarHBondContact O-N 3.29Å; L654-K656 VanDerWaalsContact C-N 3.25Å; L654-K656 PolarHBondContact O-N 3.5Å
657	L	94.3	Very high	92.6	Very high	15 Å²	15	54.2 Å²	54.2	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-73.8	-44.3	172.4	-64.6	-167.5	0	0	0	112.2	E624 F625 L628 K653 L654 K659 K660	E624-L657 HydrophobicContact CB-CD1 3.68Å; E624-L657 HydrophobicContact CB-CD2 3.95Å; E624-L657 HydrophobicContact CB-CG 4.49Å; E624-L657 HydrophobicContact CG-CD2 4.46Å; E624-L657 WeakPolarHBondContact OE2-CD2 3.49Å; F625-L657 HydrophobicContact CD1-CD1 3.94Å; F625-L657 HydrophobicContact CE1-CB 3.81Å; F625-L657 HydrophobicContact CE1-CD1 4.07Å; F625-L657 HydrophobicContact CG-CD1 4.5Å; F625-L657 HydrophobicContact CZ-CB 4.06Å; L628-L657 HydrophobicContact CD1-CD1 3.54Å; L628-L657 HydrophobicContact CD1-CG 4.21Å; L628-L657 HydrophobicContact CG-CD1 3.94Å; K653-L657 PolarHBondContact O-N 2.99Å; L654-L657 PolarHBondContact O-N 2.91Å; L657-K659 PolarHBondContact O-N 3.22Å; L657-K660 HydrophobicContact CD2-CD 4.33Å; L657-K660 VanDerWaalsContact O-CB 3.24Å; L657-K660 WeakPolarHBondContact O-CB 3.2Å; L657-K660 PolarHBondContact O-N 3.22Å
658	L	94.6	Very high	93	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-34.7	179.8	-67.7	174.1	0	0	0	111.8	L617 F625 L654 K660 L661 Y666 L669 L727 I734 F735	L617-L658 HydrophobicContact CD2-CD2 4.28Å; F625-L658 HydrophobicContact CE1-CD2 4.15Å; F625-L658 HydrophobicContact CZ-CD2 4.12Å; L654-L658 HydrophobicContact CD1-CD1 4.32Å; L654-L658 HydrophobicContact CD1-CG 4.19Å; L654-L658 HydrophobicContact CG-CD1 4.11Å; L654-L658 HydrophobicContact CG-CG 4.44Å; L654-L658 VanDerWaalsContact O-CG 3.29Å; L654-L658 WeakPolarHBondContact O-CG 3.41Å; L654-L658 PolarHBondContact O-N 3.45Å; L658-K660 PolarHBondContact O-N 2.86Å; L658-K660 VanDerWaalsContact O-N 3.17Å; L658-L661 HydrophobicContact CD2-CD1 3.78Å; L658-L661 WeakPolarHBondContact O-CB 3.5Å; L658-L661 PolarHBondContact O-N 3.06Å; L658-L661 VanDerWaalsContact O-N 3.07Å; L658-Y666 HydrophobicContact CB-CD2 4.06Å; L658-Y666 HydrophobicContact CB-CE2 3.93Å; L658-L669 HydrophobicContact CD2-CD2 3.47Å; L658-L669 VanDerWaalsContact CD2-CD2 3.47Å; L658-L727 HydrophobicContact CD1-CD2 4.18Å; L658-I734 HydrophobicContact CD1-CG2 3.43Å; L658-I734 VanDerWaalsContact CD1-CG2 3.43Å; L658-F735 HydrophobicContact CD1-CE1 3.97Å; L658-F735 HydrophobicContact CD1-CZ 3.89Å
659	K	92.8	Very high	93.3	Very high	167 Å²	167	49.6 Å²	49.6	73%	0.726	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-4.1	172	-73.7	171.8	-178.6	176.6	0	115.2	Q655 L657	Q655-K659 WeakPolarHBondContact O-CB 3.28Å; Q655-K659 VanDerWaalsContact O-CG 3.28Å; Q655-K659 WeakPolarHBondContact O-CG 3.46Å; Q655-K659 PolarHBondContact O-N 2.96Å; Q655-K659 VanDerWaalsContact O-N 3.13Å; L657-K659 PolarHBondContact O-N 3.22Å
660	K	94.7	Very high	93.5	Very high	104 Å²	104	47.4 Å²	47.4	45%	0.452	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-16.7	169.1	-60.9	177.2	169.3	-177.8	0	113.1	L621 E624 L657 L658	L621-K660 HydrophobicContact CD1-CB 3.81Å; L621-K660 HydrophobicContact CD2-CB 4.04Å; L621-K660 HydrophobicContact CD2-CD 3.57Å; L621-K660 HydrophobicContact CD2-CG 4.5Å; E624-K660 IonicContact OE1-NZ 3.25Å; E624-K660 PolarHBondContact OE1-NZ 3.16Å; E624-K660 IonicContact OE2-NZ 3.65Å; E624-K660 PolarHBondContact OE2-NZ 3.06Å; L657-K660 HydrophobicContact CD2-CD 4.33Å; L657-K660 VanDerWaalsContact O-CB 3.24Å; L657-K660 WeakPolarHBondContact O-CB 3.2Å; L657-K660 PolarHBondContact O-N 3.22Å; L658-K660 PolarHBondContact O-N 2.86Å; L658-K660 VanDerWaalsContact O-N 3.17Å
661	L	93.3	Very high	93.7	Very high	13 Å²	13	49.7 Å²	49.7	7%	0.068	24%	0.236	C	C	.	.	S	Bend	trans	-68.6	146.2	178.6	-66.8	166.7	0	0	0	110.3	L617 T618 L621 L658 L669	L617-L661 HydrophobicContact CD2-CD1 4.19Å; T618-L661 HydrophobicContact CG2-CD2 3.82Å; L621-L661 HydrophobicContact CD1-CD2 3.75Å; L621-L661 HydrophobicContact CD1-CG 4.09Å; L658-L661 HydrophobicContact CD2-CD1 3.78Å; L658-L661 WeakPolarHBondContact O-CB 3.5Å; L658-L661 PolarHBondContact O-N 3.06Å; L658-L661 VanDerWaalsContact O-N 3.07Å; L661-L669 HydrophobicContact CD1-CD2 3.95Å
662	P	92.1	Very high	93.9	Very high	56 Å²	56	49.5 Å²	49.5	36%	0.364	24%	0.235	S	C	.	.			trans	-59.9	146.2	169	-17.4	28.5	0	0	0	110.9	H664 Y665 Y666	P662-H664 VanDerWaalsContact C-N 3.3Å; P662-H664 PolarHBondContact O-N 2.77Å; P662-H664 VanDerWaalsContact O-N 3.11Å; P662-Y665 HydrophobicContact CB-CD2 3.98Å; P662-Y665 HydrophobicContact CG-CD2 3.91Å; P662-Y665 WeakPolarHBondContact O-CA 3.3Å; P662-Y665 WeakPolarHBondContact O-CB 3.36Å; P662-Y665 PolarHBondContact O-N 2.92Å; P662-Y666 PolarHBondContact O-N 3.4Å
663	S	89.5	Confident	94.1	Very high	78 Å²	78	44.2 Å²	44.2	55%	0.545	21%	0.211	S	C	.	.	H	α-helix	trans	-50.8	-45.3	-168.6	-153.3	0	0	0	0	113.9	Y666 S667	S663-Y666 WeakPolarHBondContact O-CB 3.38Å; S663-Y666 PolarHBondContact O-N 3.02Å; S663-S667 PolarHBondContact O-N 3.32Å; S663-S667 PolarHBondContact O-OG 3.22Å; S663-S667 VanDerWaalsContact O-OG 3.11Å
664	H	89.9	Confident	94.3	Very high	52 Å²	52	41.2 Å²	41.2	24%	0.241	20%	0.2	C	C	.	.	H	α-helix	trans	-69.9	-31	179.6	41.3	-93.4	0	0	0	113.9	S536 L539 P662 T668	S536-H664 PolarHBondContact OG-NE2 3.48Å; L539-H664 HydrophobicContact CD1-CB 3.46Å; L539-H664 VanDerWaalsContact CD1-CB 3.46Å; P662-H664 VanDerWaalsContact C-N 3.3Å; P662-H664 PolarHBondContact O-N 2.77Å; P662-H664 VanDerWaalsContact O-N 3.11Å; H664-T668 WeakPolarHBondContact O-CB 3.47Å; H664-T668 PolarHBondContact O-N 3.22Å; H664-T668 VanDerWaalsContact O-N 3.09Å; H664-T668 PolarHBondContact O-OG1 2.89Å
665	Y	93.7	Very high	94.4	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-67.8	-43.3	170.3	-79.3	-96.3	0	0	0	110.3	D534 L535 E614 L616 T618 P662 L669	D534-Y665 PolarHBondContact OD2-OH 2.94Å; L535-Y665 HydrophobicContact CB-CE1 4.24Å; L535-Y665 HydrophobicContact CB-CE2 3.82Å; L535-Y665 HydrophobicContact CD2-CD1 3.78Å; L535-Y665 HydrophobicContact CD2-CD2 3.84Å; L535-Y665 HydrophobicContact CD2-CE1 3.91Å; L535-Y665 HydrophobicContact CD2-CE2 3.98Å; L535-Y665 HydrophobicContact CD2-CG 3.71Å; L535-Y665 HydrophobicContact CG-CE2 4.43Å; E614-Y665 HydrophobicContact CG-CE1 4.1Å; L616-Y665 HydrophobicContact CD1-CD1 3.99Å; T618-Y665 HydrophobicContact CG2-CD1 4.48Å; P662-Y665 HydrophobicContact CB-CD2 3.98Å; P662-Y665 HydrophobicContact CG-CD2 3.91Å; P662-Y665 WeakPolarHBondContact O-CA 3.3Å; P662-Y665 WeakPolarHBondContact O-CB 3.36Å; P662-Y665 PolarHBondContact O-N 2.92Å; Y665-L669 VanDerWaalsContact O-CB 3.28Å; Y665-L669 WeakPolarHBondContact O-CB 3.25Å; Y665-L669 PolarHBondContact O-N 3.31Å
666	Y	94.1	Very high	94.5	Very high	56 Å²	56	38.8 Å²	38.8	22%	0.22	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-52.7	175.8	176.8	-88.3	0	0	0	112.4	L658 P662 S663 T668 L669 Q670 F735	L658-Y666 HydrophobicContact CB-CD2 4.06Å; L658-Y666 HydrophobicContact CB-CE2 3.93Å; P662-Y666 PolarHBondContact O-N 3.4Å; S663-Y666 WeakPolarHBondContact O-CB 3.38Å; S663-Y666 PolarHBondContact O-N 3.02Å; Y666-T668 PolarHBondContact O-N 2.92Å; Y666-L669 WeakPolarHBondContact O-CB 3.44Å; Y666-L669 PolarHBondContact O-N 3.19Å; Y666-L669 VanDerWaalsContact O-N 3.16Å; Y666-Q670 PolarHBondContact O-N 3.1Å; Y666-Q670 PolarHBondContact OH-OE1 2.84Å; Y666-Q670 VanDerWaalsContact OH-OE1 3.11Å; Y666-F735 HydrophobicContact CE2-CD1 4.17Å; Y666-F735 HydrophobicContact CE2-CE1 4.1Å; Y666-F735 AromaticContact CZ-CD1 3.9Å
667	S	92.5	Very high	94.7	Very high	19 Å²	19	32.5 Å²	32.5	13%	0.133	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-38.1	-178	-56.2	0	0	0	0	112.1	E545 S663 Q670 Y671	E545-S667 VanDerWaalsContact OE2-CB 3.28Å; E545-S667 WeakPolarHBondContact OE2-CB 3.3Å; E545-S667 PolarHBondContact OE2-OG 2.74Å; S663-S667 PolarHBondContact O-N 3.32Å; S663-S667 PolarHBondContact O-OG 3.22Å; S663-S667 VanDerWaalsContact O-OG 3.11Å; S667-Q670 PolarHBondContact O-N 3.36Å; S667-Y671 WeakPolarHBondContact O-CB 3.41Å; S667-Y671 PolarHBondContact O-N 2.84Å
668	T	95.1	Very high	94.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-38.1	173.2	-62.2	0	0	0	0	112.1	E545 P547 V550 F609 L616 H664 Y666 L672	E545-T668 PolarHBondContact O-OG1 3.5Å; P547-T668 VanDerWaalsContact CD-OG1 3.29Å; P547-T668 WeakPolarHBondContact CD-OG1 3.35Å; V550-T668 HydrophobicContact CG2-CG2 4.39Å; F609-T668 HydrophobicContact CE1-CG2 3.76Å; F609-T668 HydrophobicContact CZ-CG2 4.11Å; L616-T668 HydrophobicContact CD1-CG2 3.87Å; L616-T668 HydrophobicContact CD2-CG2 4.42Å; H664-T668 WeakPolarHBondContact O-CB 3.47Å; H664-T668 PolarHBondContact O-N 3.22Å; H664-T668 VanDerWaalsContact O-N 3.09Å; H664-T668 PolarHBondContact O-OG1 2.89Å; Y666-T668 PolarHBondContact O-N 2.92Å; T668-L672 WeakPolarHBondContact O-CB 3.37Å; T668-L672 PolarHBondContact O-N 3.45Å; T668-L672 VanDerWaalsContact O-N 3.09Å
669	L	96	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.1	-49.1	174.6	178	73.6	0	0	0	111.7	L616 L617 L658 L661 Y665 Y666 Y671 L672 I673 L700 F735	L616-L669 HydrophobicContact CD2-CB 3.97Å; L616-L669 HydrophobicContact CD2-CD1 3.87Å; L616-L669 HydrophobicContact CG-CB 4.24Å; L616-L669 HydrophobicContact CG-CD1 4.42Å; L617-L669 HydrophobicContact CD2-CD1 4.2Å; L617-L669 HydrophobicContact CD2-CD2 3.57Å; L617-L669 HydrophobicContact CG-CD1 4.43Å; L658-L669 HydrophobicContact CD2-CD2 3.47Å; L658-L669 VanDerWaalsContact CD2-CD2 3.47Å; L661-L669 HydrophobicContact CD1-CD2 3.95Å; Y665-L669 VanDerWaalsContact O-CB 3.28Å; Y665-L669 WeakPolarHBondContact O-CB 3.25Å; Y665-L669 PolarHBondContact O-N 3.31Å; Y666-L669 WeakPolarHBondContact O-CB 3.44Å; Y666-L669 PolarHBondContact O-N 3.19Å; Y666-L669 VanDerWaalsContact O-N 3.16Å; L669-Y671 VanDerWaalsContact C-N 3.33Å; L669-Y671 PolarHBondContact O-N 2.89Å; L669-L672 PolarHBondContact O-N 3.02Å; L669-L672 VanDerWaalsContact O-N 3.12Å; L669-I673 HydrophobicContact CD1-CD1 4.33Å; L669-I673 HydrophobicContact CD1-CG1 4.11Å; L669-I673 HydrophobicContact CG-CG1 4.27Å; L669-I673 WeakPolarHBondContact O-CG1 3.29Å; L669-I673 PolarHBondContact O-N 3.4Å; L669-L700 HydrophobicContact CD1-CD1 4.23Å; L669-F735 HydrophobicContact CD2-CZ 4.29Å; L669-F735 HydrophobicContact CG-CZ 4.36Å
670	Q	95.3	Very high	95	Very high	24 Å²	24	29 Å²	29	11%	0.112	15%	0.147	C	C	.	.	H	α-helix	trans	-54.3	-50.6	178.1	175.5	167.2	-33.6	0	0	110.9	Y666 S667 L672 I673 S674 F735 E738	Y666-Q670 PolarHBondContact O-N 3.1Å; Y666-Q670 PolarHBondContact OH-OE1 2.84Å; Y666-Q670 VanDerWaalsContact OH-OE1 3.11Å; S667-Q670 PolarHBondContact O-N 3.36Å; Q670-L672 VanDerWaalsContact C-N 3.33Å; Q670-L672 PolarHBondContact O-N 3.14Å; Q670-I673 PolarHBondContact O-N 3.35Å; Q670-S674 WeakPolarHBondContact O-CB 3.48Å; Q670-S674 PolarHBondContact O-N 3.38Å; Q670-F735 HydrophobicContact CB-CD1 3.57Å; Q670-F735 HydrophobicContact CB-CE1 3.78Å; Q670-F735 HydrophobicContact CB-CG 4.27Å; Q670-F735 HydrophobicContact CG-CB 4Å; Q670-F735 HydrophobicContact CG-CD1 3.63Å; Q670-F735 HydrophobicContact CG-CE1 4.33Å; Q670-F735 HydrophobicContact CG-CG 3.91Å; Q670-E738 PolarHBondContact NE2-OE1 2.86Å
671	Y	96.1	Very high	95.1	Very high	50 Å²	50	30.1 Å²	30.1	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-59.7	-40.5	177.1	-176.7	-91.5	0	0	0	112.6	V546 V550 R551 T554 N555 S667 L669 H675	V546-Y671 HydrophobicContact CG1-CD1 3.68Å; V546-Y671 HydrophobicContact CG1-CE1 4.21Å; V546-Y671 HydrophobicContact CG1-CG 3.96Å; V546-Y671 HydrophobicContact CG2-CG 4.23Å; V550-Y671 HydrophobicContact CG1-CD1 3.8Å; V550-Y671 HydrophobicContact CG1-CE1 3.94Å; R551-Y671 HydrophobicContact CG-CE1 4.07Å; T554-Y671 HydrophobicContact CG2-CE1 4.03Å; T554-Y671 VanDerWaalsContact OG1-CE1 3.22Å; T554-Y671 WeakPolarHBondContact OG1-CE1 3.32Å; T554-Y671 PolarHBondContact OG1-OH 3.23Å; N555-Y671 PolarHBondContact OD1-OH 3.24Å; N555-Y671 VanDerWaalsContact OD1-OH 3.07Å; S667-Y671 WeakPolarHBondContact O-CB 3.41Å; S667-Y671 PolarHBondContact O-N 2.84Å; L669-Y671 VanDerWaalsContact C-N 3.33Å; L669-Y671 PolarHBondContact O-N 2.89Å; Y671-H675 PolarHBondContact O-N 3.3Å; Y671-H675 VanDerWaalsContact O-N 3.08Å
672	L	97.4	Very high	95	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-44.9	175	179.3	64.5	0	0	0	112.5	L605 F609 L616 T668 L669 Q670 H675 L676 F696 L700	L605-L672 HydrophobicContact CD2-CD1 4.14Å; F609-L672 HydrophobicContact CD2-CD2 4.19Å; F609-L672 HydrophobicContact CE1-CD2 4.48Å; F609-L672 HydrophobicContact CE2-CD1 3.92Å; F609-L672 HydrophobicContact CE2-CD2 3.67Å; F609-L672 HydrophobicContact CE2-CG 4.33Å; F609-L672 HydrophobicContact CZ-CD1 4.39Å; F609-L672 HydrophobicContact CZ-CD2 3.84Å; F609-L672 HydrophobicContact CZ-CG 4.47Å; L616-L672 HydrophobicContact CD2-CD2 4.15Å; T668-L672 WeakPolarHBondContact O-CB 3.37Å; T668-L672 PolarHBondContact O-N 3.45Å; T668-L672 VanDerWaalsContact O-N 3.09Å; L669-L672 PolarHBondContact O-N 3.02Å; L669-L672 VanDerWaalsContact O-N 3.12Å; Q670-L672 VanDerWaalsContact C-N 3.33Å; Q670-L672 PolarHBondContact O-N 3.14Å; L672-H675 WeakPolarHBondContact O-CB 3.45Å; L672-H675 PolarHBondContact O-N 3.02Å; L672-L676 HydrophobicContact CD1-CD1 4.22Å; L672-L676 HydrophobicContact CD1-CG 4.26Å; L672-L676 HydrophobicContact CG-CD1 4.02Å; L672-L676 HydrophobicContact CG-CG 4.43Å; L672-L676 VanDerWaalsContact O-CG 3.3Å; L672-L676 WeakPolarHBondContact O-CG 3.33Å; L672-L676 PolarHBondContact O-N 2.96Å; L672-F696 HydrophobicContact CD1-CE1 4.19Å; L672-F696 HydrophobicContact CD2-CD1 4.25Å; L672-F696 HydrophobicContact CD2-CE1 4.26Å; L672-L700 HydrophobicContact CD2-CD1 3.8Å; L672-L700 HydrophobicContact CD2-CD2 3.66Å; L672-L700 HydrophobicContact CD2-CG 4.33Å
673	I	97.8	Very high	95	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-38.9	179.9	-60.4	-58.7	0	0	0	110.6	L669 Q670 H675 L676 Q677 L727 I728 H731 F735	L669-I673 HydrophobicContact CD1-CD1 4.33Å; L669-I673 HydrophobicContact CD1-CG1 4.11Å; L669-I673 HydrophobicContact CG-CG1 4.27Å; L669-I673 WeakPolarHBondContact O-CG1 3.29Å; L669-I673 PolarHBondContact O-N 3.4Å; Q670-I673 PolarHBondContact O-N 3.35Å; I673-H675 VanDerWaalsContact C-N 3.33Å; I673-H675 PolarHBondContact O-N 3.12Å; I673-L676 HydrophobicContact CD1-CD1 4.45Å; I673-L676 PolarHBondContact O-N 2.9Å; I673-L676 VanDerWaalsContact O-N 3.14Å; I673-Q677 WeakPolarHBondContact O-CB 3.4Å; I673-Q677 PolarHBondContact O-N 2.87Å; I673-L727 HydrophobicContact CD1-CB 4.03Å; I673-L727 HydrophobicContact CG1-CB 4.37Å; I673-L727 HydrophobicContact CG2-CB 4.34Å; I673-L727 VanDerWaalsContact CG2-O 3.3Å; I673-L727 WeakPolarHBondContact CG2-O 3.47Å; I673-I728 HydrophobicContact CD1-CG1 4.37Å; I673-I728 HydrophobicContact CG2-CG1 4.26Å; I673-H731 HydrophobicContact CG2-CB 4.18Å; I673-F735 HydrophobicContact CB-CE2 4.07Å; I673-F735 HydrophobicContact CG1-CE2 4.19Å; I673-F735 HydrophobicContact CG1-CZ 4.27Å; I673-F735 HydrophobicContact CG2-CE2 4.03Å
674	S	96.6	Very high	95.2	Very high	20 Å²	20	40.5 Å²	40.5	14%	0.14	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-39.4	171.7	176.8	0	0	0	0	112.9	Q670 R678	Q670-S674 WeakPolarHBondContact O-CB 3.48Å; Q670-S674 PolarHBondContact O-N 3.38Å; S674-R678 WeakPolarHBondContact O-CG 3.47Å; S674-R678 PolarHBondContact O-N 3.44Å; S674-R678 PolarHBondContact O-NE 3.14Å; S674-R678 VanDerWaalsContact O-NE 3.08Å
675	H	97.2	Very high	95.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-46.6	171.6	174.5	76.8	0	0	0	111.7	T554 E558 Y568 Y671 L672 I673 Q677 R678 V679	T554-H675 WeakPolarHBondContact CB-ND1 3.15Å; T554-H675 HydrophobicContact CG2-CB 3.86Å; T554-H675 VanDerWaalsContact CG2-CG 3.49Å; E558-H675 IonicContact OE1-CE1 2.74Å; E558-H675 IonicContact OE1-CG 2.96Å; E558-H675 IonicContact OE1-ND1 2.7Å; E558-H675 PolarHBondContact OE1-ND1 3.14Å; Y568-H675 AromaticContact CE2-NE2 3.43Å; Y568-H675 WeakPolarHBondContact CE2-NE2 3.36Å; Y568-H675 AromaticContact CZ-NE2 3.51Å; Y568-H675 PolarHBondContact OH-CD2 3.36Å; Y568-H675 VanDerWaalsContact OH-CD2 3.28Å; Y568-H675 PolarHBondContact OH-NE2 3.17Å; Y671-H675 PolarHBondContact O-N 3.3Å; Y671-H675 VanDerWaalsContact O-N 3.08Å; L672-H675 WeakPolarHBondContact O-CB 3.45Å; L672-H675 PolarHBondContact O-N 3.02Å; I673-H675 VanDerWaalsContact C-N 3.33Å; I673-H675 PolarHBondContact O-N 3.12Å; H675-Q677 PolarHBondContact O-N 3.12Å; H675-R678 PolarHBondContact O-N 3.27Å; H675-V679 WeakPolarHBondContact O-CG2 3.46Å; H675-V679 PolarHBondContact O-N 2.84Å
676	L	97.8	Very high	95.4	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-32.2	-177.9	-64.8	175.3	0	0	0	112.8	Y568 L672 I673 V679 S680 L692 F696 I728	Y568-L676 HydrophobicContact CD2-CD2 4.27Å; Y568-L676 HydrophobicContact CE2-CD2 4Å; L672-L676 HydrophobicContact CD1-CD1 4.22Å; L672-L676 HydrophobicContact CD1-CG 4.26Å; L672-L676 HydrophobicContact CG-CD1 4.02Å; L672-L676 HydrophobicContact CG-CG 4.43Å; L672-L676 VanDerWaalsContact O-CG 3.3Å; L672-L676 WeakPolarHBondContact O-CG 3.33Å; L672-L676 PolarHBondContact O-N 2.96Å; I673-L676 HydrophobicContact CD1-CD1 4.45Å; I673-L676 PolarHBondContact O-N 2.9Å; I673-L676 VanDerWaalsContact O-N 3.14Å; L676-V679 PolarHBondContact O-N 3.34Å; L676-S680 WeakPolarHBondContact O-CB 3.21Å; L676-S680 PolarHBondContact O-N 3.12Å; L676-L692 HydrophobicContact CB-CD1 4.3Å; L676-L692 HydrophobicContact CD2-CD1 4.49Å; L676-L692 HydrophobicContact CD2-CD2 4.14Å; L676-L692 VanDerWaalsContact O-CD1 3.3Å; L676-L692 WeakPolarHBondContact O-CD1 3.36Å; L676-F696 HydrophobicContact CD1-CB 4.37Å; L676-F696 HydrophobicContact CD1-CD1 4.2Å; L676-F696 HydrophobicContact CD1-CD2 3.81Å; L676-F696 HydrophobicContact CD1-CE1 4.46Å; L676-F696 HydrophobicContact CD1-CE2 4.09Å; L676-F696 HydrophobicContact CD1-CG 3.86Å; L676-F696 HydrophobicContact CD1-CZ 4.4Å; L676-F696 HydrophobicContact CD2-CD2 3.87Å; L676-F696 HydrophobicContact CD2-CE2 3.43Å; L676-F696 VanDerWaalsContact CD2-CE2 3.43Å; L676-F696 HydrophobicContact CD2-CZ 3.9Å; L676-F696 HydrophobicContact CG-CE2 4.42Å; L676-I728 HydrophobicContact CB-CD1 3.84Å; L676-I728 HydrophobicContact CB-CG1 3.94Å; L676-I728 HydrophobicContact CD1-CD1 4.18Å
677	Q	97.2	Very high	95.5	Very high	24 Å²	24	41.5 Å²	41.5	11%	0.112	19%	0.191	C	C	.	.	H	α-helix	trans	-57.8	-55.4	168.9	-179.9	-173.1	16.8	0	0	110.8	I673 H675 V679 S680 E681 I728 H731 D732	I673-Q677 WeakPolarHBondContact O-CB 3.4Å; I673-Q677 PolarHBondContact O-N 2.87Å; H675-Q677 PolarHBondContact O-N 3.12Å; Q677-V679 PolarHBondContact O-N 2.91Å; Q677-S680 WeakPolarHBondContact O-CA 3.48Å; Q677-S680 WeakPolarHBondContact O-CB 3.32Å; Q677-S680 PolarHBondContact O-N 3.33Å; Q677-S680 PolarHBondContact O-OG 2.98Å; Q677-E681 WeakPolarHBondContact O-CG 3.26Å; Q677-E681 PolarHBondContact O-N 3.15Å; Q677-I728 HydrophobicContact CB-CG2 4.5Å; Q677-H731 VanDerWaalsContact OE1-CG 3.22Å; Q677-H731 PolarHBondContact OE1-ND1 3.39Å; Q677-D732 PolarHBondContact NE2-OD1 3.02Å; Q677-D732 PolarHBondContact NE2-OD2 3.45Å; Q677-D732 PolarHBondContact OE1-OD1 3.04Å
678	R	96.4	Very high	95.7	Very high	82 Å²	82	42.9 Å²	42.9	31%	0.309	20%	0.201	S	C	.	.	H	α-helix	trans	-65.1	-25.4	-178.6	-68.4	178.3	-70	132.3	6.9	113.4	E558 S674 H675	E558-R678 IonicContact OE1-CZ 2.59Å; E558-R678 IonicContact OE1-NH1 3.12Å; E558-R678 PolarHBondContact OE1-NH1 3.24Å; E558-R678 IonicContact OE1-NH2 3.84Å; E558-R678 PolarHBondContact OE1-NH2 2.95Å; E558-R678 IonicContact OE2-CZ 2.62Å; E558-R678 IonicContact OE2-NH1 3.37Å; E558-R678 PolarHBondContact OE2-NH1 3.03Å; E558-R678 IonicContact OE2-NH2 3.4Å; E558-R678 PolarHBondContact OE2-NH2 2.86Å; S674-R678 WeakPolarHBondContact O-CG 3.47Å; S674-R678 PolarHBondContact O-N 3.44Å; S674-R678 PolarHBondContact O-NE 3.14Å; S674-R678 VanDerWaalsContact O-NE 3.08Å; H675-R678 PolarHBondContact O-N 3.27Å
679	V	97.1	Very high	95.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-70.1	-44.5	166	172	0	0	0	0	111.2	L562 V567 Y568 H675 L676 Q677 E681 N682 N685 M687 L692	L562-V679 HydrophobicContact CD2-CG2 3.75Å; V567-V679 HydrophobicContact CG1-CG1 4.01Å; Y568-V679 HydrophobicContact CD2-CG1 4.33Å; Y568-V679 HydrophobicContact CE2-CG2 4.21Å; H675-V679 WeakPolarHBondContact O-CG2 3.46Å; H675-V679 PolarHBondContact O-N 2.84Å; L676-V679 PolarHBondContact O-N 3.34Å; Q677-V679 PolarHBondContact O-N 2.91Å; V679-E681 VanDerWaalsContact C-N 3.29Å; V679-E681 PolarHBondContact O-N 3.36Å; V679-N682 PolarHBondContact O-N 3.35Å; V679-N685 PolarHBondContact O-ND2 2.98Å; V679-M687 HydrophobicContact CG1-CB 4.29Å; V679-L692 HydrophobicContact CB-CD1 4.43Å; V679-L692 HydrophobicContact CG1-CD1 4.17Å; V679-L692 HydrophobicContact CG1-CD2 4.25Å
680	S	96.4	Very high	95.8	Very high	27 Å²	27	46.3 Å²	46.3	19%	0.189	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-24	-177.6	79	0	0	0	0	114.9	L676 Q677 N682 M687	L676-S680 WeakPolarHBondContact O-CB 3.21Å; L676-S680 PolarHBondContact O-N 3.12Å; Q677-S680 WeakPolarHBondContact O-CA 3.48Å; Q677-S680 WeakPolarHBondContact O-CB 3.32Å; Q677-S680 PolarHBondContact O-N 3.33Å; Q677-S680 PolarHBondContact O-OG 2.98Å; S680-N682 VanDerWaalsContact C-N 3.31Å; S680-M687 WeakPolarHBondContact CA-O 3.41Å
681	E	95	Very high	95.8	Very high	129 Å²	129	48.2 Å²	48.2	60%	0.603	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.9	174.7	-71.9	168.4	171.5	0	0	112.9	Q677 V679 Y683	Q677-E681 WeakPolarHBondContact O-CG 3.26Å; Q677-E681 PolarHBondContact O-N 3.15Å; V679-E681 VanDerWaalsContact C-N 3.29Å; V679-E681 PolarHBondContact O-N 3.36Å; E681-Y683 PolarHBondContact O-N 3.37Å
682	N	92.6	Very high	95.9	Very high	47 Å²	47	45.9 Å²	45.9	25%	0.251	23%	0.226	S	C	.	.			trans	-87.4	96.1	-178	-169.9	-40.9	0	0	0	111.7	L562 V679 S680 D684 N685	L562-N682 HydrophobicContact CB-CB 4.46Å; L562-N682 WeakPolarHBondContact O-CB 3.34Å; L562-N682 PolarHBondContact O-ND2 2.9Å; V679-N682 PolarHBondContact O-N 3.35Å; S680-N682 VanDerWaalsContact C-N 3.31Å; N682-D684 PolarHBondContact O-N 3.49Å; N682-D684 VanDerWaalsContact O-N 3.15Å; N682-D684 WeakPolarHBondContact OD1-CB 3.2Å; N682-D684 PolarHBondContact OD1-N 3.45Å; N682-N685 PolarHBondContact O-N 3.25Å; N682-N685 PolarHBondContact O-ND2 3.09Å; N682-N685 VanDerWaalsContact O-ND2 3.14Å; N682-N685 PolarHBondContact O-OD1 3.45Å; N682-N685 VanDerWaalsContact O-OD1 3.13Å
683	Y	91.7	Very high	95.9	Very high	211 Å²	211	45.9 Å²	45.9	83%	0.827	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-59	-28.5	-174.6	-153.5	-90.5	0	0	0	114.6	E681 N685 K686	E681-Y683 PolarHBondContact O-N 3.37Å; Y683-N685 PolarHBondContact O-N 3.47Å; Y683-K686 PolarHBondContact O-N 3.07Å
684	D	93.1	Very high	95.7	Very high	107 Å²	107	50.7 Å²	50.7	57%	0.572	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-63.1	-29.9	-177.5	-76.1	-30.4	0	0	0	112.6	Q565 N682 K686	Q565-D684 WeakPolarHBondContact CG-O 3.41Å; N682-D684 PolarHBondContact O-N 3.49Å; N682-D684 VanDerWaalsContact O-N 3.15Å; N682-D684 WeakPolarHBondContact OD1-CB 3.2Å; N682-D684 PolarHBondContact OD1-N 3.45Å; D684-K686 VanDerWaalsContact C-N 3.33Å; D684-K686 PolarHBondContact O-N 3.39Å
685	N	94.1	Very high	95.7	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-78.6	-13.5	-179.1	72.5	37.7	0	0	0	114.1	L562 V564 Q565 G566 V567 V679 N682 Y683 M687	L562-N685 VanDerWaalsContact O-CB 3.31Å; L562-N685 WeakPolarHBondContact O-CB 3.37Å; L562-N685 PolarHBondContact O-ND2 3.12Å; V564-N685 VanDerWaalsContact O-CB 3.31Å; V564-N685 WeakPolarHBondContact O-CB 3.36Å; Q565-N685 WeakPolarHBondContact CA-O 3.31Å; G566-N685 PolarHBondContact N-O 3Å; V567-N685 HydrophobicContact CG1-CB 4.47Å; V679-N685 PolarHBondContact O-ND2 2.98Å; N682-N685 PolarHBondContact O-N 3.25Å; N682-N685 PolarHBondContact O-ND2 3.09Å; N682-N685 VanDerWaalsContact O-ND2 3.14Å; N682-N685 PolarHBondContact O-OD1 3.45Å; N682-N685 VanDerWaalsContact O-OD1 3.13Å; Y683-N685 PolarHBondContact O-N 3.47Å; N685-M687 PolarHBondContact O-N 3.15Å; N685-M687 WeakPolarHBondContact OD1-CA 3.39Å; N685-M687 VanDerWaalsContact OD1-CB 3.25Å; N685-M687 WeakPolarHBondContact OD1-CB 3.29Å; N685-M687 PolarHBondContact OD1-N 3.39Å
686	K	94.3	Very high	95.7	Very high	127 Å²	127	51.1 Å²	51.1	55%	0.552	25%	0.253	S	S	*	.			trans	60.5	22.8	179.8	-54.3	170.6	-179.7	170.9	0	115.1	Q565 Y683 D684 N691	Q565-K686 VanDerWaalsContact CD-NZ 3.3Å; Q565-K686 HydrophobicContact CG-CD 4.12Å; Q565-K686 HydrophobicContact CG-CG 4.43Å; Y683-K686 PolarHBondContact O-N 3.07Å; D684-K686 VanDerWaalsContact C-N 3.33Å; D684-K686 PolarHBondContact O-N 3.39Å; K686-N691 PolarHBondContact O-ND2 3.12Å
687	M	96.2	Very high	95.6	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	25%	0.253	C	S	.	.			trans	-103.7	73.3	177.7	-63.8	-58.2	-56.2	0	0	111.3	V567 R569 V679 S680 N685 N691 L692 V695	V567-M687 HydrophobicContact CG1-CG 4.13Å; R569-M687 HydrophobicContact CB-CE 3.97Å; R569-M687 HydrophobicContact CB-SD 3.66Å; V679-M687 HydrophobicContact CG1-CB 4.29Å; S680-M687 WeakPolarHBondContact CA-O 3.41Å; N685-M687 PolarHBondContact O-N 3.15Å; N685-M687 WeakPolarHBondContact OD1-CA 3.39Å; N685-M687 VanDerWaalsContact OD1-CB 3.25Å; N685-M687 WeakPolarHBondContact OD1-CB 3.29Å; N685-M687 PolarHBondContact OD1-N 3.39Å; M687-N691 HydrophobicContact CE-CB 3.84Å; M687-N691 VanDerWaalsContact CE-O 3.3Å; M687-N691 WeakPolarHBondContact CE-O 3.24Å; M687-N691 HydrophobicContact SD-CB 4.32Å; M687-L692 HydrophobicContact CB-CD2 3.93Å; M687-L692 HydrophobicContact CB-CG 4.07Å; M687-L692 HydrophobicContact CE-CD2 3.63Å; M687-L692 HydrophobicContact CE-CG 4.16Å; M687-L692 HydrophobicContact CG-CD2 4.45Å; M687-V695 HydrophobicContact CE-CG2 4.44Å
688	S	96.6	Very high	95.4	Very high	49 Å²	49	52.7 Å²	52.7	34%	0.343	27%	0.265	S	S	.	.			trans	-56.4	163.8	170	59	0	0	0	0	112.7	S690 N691 L692	S688-S690 VanDerWaalsContact C-N 3.25Å; S688-S690 PolarHBondContact O-N 3.2Å; S688-N691 PolarHBondContact O-N 2.94Å; S688-N691 PolarHBondContact OG-N 3.33Å; S688-L692 PolarHBondContact O-N 3.26Å
689	P	96.9	Very high	95.2	Very high	31 Å²	31	49.5 Å²	49.5	20%	0.201	25%	0.254	C	S	.	.	H	α-helix	trans	-49.7	-43.3	174.1	-30.2	38.7	0	0	0	113.1	L692 G693 E725 I728	P689-L692 PolarHBondContact O-N 2.97Å; P689-G693 PolarHBondContact O-N 2.94Å; P689-E725 HydrophobicContact CB-CG 3.99Å; P689-I728 HydrophobicContact CB-CB 4.27Å; P689-I728 HydrophobicContact CB-CG2 3.98Å; P689-I728 HydrophobicContact CG-CG2 4.08Å
690	S	95.4	Very high	95.2	Very high	41 Å²	41	49.5 Å²	49.5	29%	0.287	25%	0.254	S	S	.	.	H	α-helix	trans	-58.8	-47.6	172.2	-143.7	0	0	0	0	114.1	S688 L692 G693 I694 E725	S688-S690 VanDerWaalsContact C-N 3.25Å; S688-S690 PolarHBondContact O-N 3.2Å; S690-L692 PolarHBondContact O-N 2.95Å; S690-G693 PolarHBondContact O-N 2.91Å; S690-G693 VanDerWaalsContact O-N 3.15Å; S690-I694 WeakPolarHBondContact O-CG1 3.25Å; S690-I694 PolarHBondContact O-N 3.37Å; S690-E725 VanDerWaalsContact CA-OE1 3.31Å; S690-E725 WeakPolarHBondContact CA-OE1 3.34Å; S690-E725 WeakPolarHBondContact CA-OE2 3.45Å; S690-E725 WeakPolarHBondContact CB-OE1 3.48Å; S690-E725 WeakPolarHBondContact CB-OE2 3.42Å; S690-E725 VanDerWaalsContact N-CD 3.27Å; S690-E725 PolarHBondContact N-OE1 2.99Å; S690-E725 PolarHBondContact OG-OE2 3.45Å
691	N	96.8	Very high	95	Very high	64 Å²	64	48.2 Å²	48.2	34%	0.342	25%	0.245	S	C	.	.	H	α-helix	trans	-64.2	-28.7	178.7	-76.3	-13.5	0	0	0	112.2	K686 M687 S688 V695	K686-N691 PolarHBondContact O-ND2 3.12Å; M687-N691 HydrophobicContact CE-CB 3.84Å; M687-N691 VanDerWaalsContact CE-O 3.3Å; M687-N691 WeakPolarHBondContact CE-O 3.24Å; M687-N691 HydrophobicContact SD-CB 4.32Å; S688-N691 PolarHBondContact O-N 2.94Å; S688-N691 PolarHBondContact OG-N 3.33Å; N691-V695 WeakPolarHBondContact O-CG2 3.49Å
692	L	97.5	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-79.8	-39.2	172.6	-65.6	169.7	0	0	0	111.6	Y568 L676 V679 M687 S688 P689 S690 I694 V695 F696 I728	Y568-L692 HydrophobicContact CD2-CD2 3.96Å; Y568-L692 HydrophobicContact CG-CD2 4.31Å; L676-L692 HydrophobicContact CB-CD1 4.3Å; L676-L692 HydrophobicContact CD2-CD1 4.49Å; L676-L692 HydrophobicContact CD2-CD2 4.14Å; L676-L692 VanDerWaalsContact O-CD1 3.3Å; L676-L692 WeakPolarHBondContact O-CD1 3.36Å; V679-L692 HydrophobicContact CB-CD1 4.43Å; V679-L692 HydrophobicContact CG1-CD1 4.17Å; V679-L692 HydrophobicContact CG1-CD2 4.25Å; M687-L692 HydrophobicContact CB-CD2 3.93Å; M687-L692 HydrophobicContact CB-CG 4.07Å; M687-L692 HydrophobicContact CE-CD2 3.63Å; M687-L692 HydrophobicContact CE-CG 4.16Å; M687-L692 HydrophobicContact CG-CD2 4.45Å; S688-L692 PolarHBondContact O-N 3.26Å; P689-L692 PolarHBondContact O-N 2.97Å; S690-L692 PolarHBondContact O-N 2.95Å; L692-I694 PolarHBondContact O-N 3.48Å; L692-V695 PolarHBondContact O-N 2.95Å; L692-F696 PolarHBondContact O-N 3.39Å; L692-I728 HydrophobicContact CB-CD1 3.73Å; L692-I728 HydrophobicContact CD1-CD1 4.34Å
693	G	96.8	Very high	94	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-46.1	174.5	0	0	0	0	0	112.5	P689 S690 V695 F696 G697	P689-G693 PolarHBondContact O-N 2.94Å; S690-G693 PolarHBondContact O-N 2.91Å; S690-G693 VanDerWaalsContact O-N 3.15Å; G693-V695 PolarHBondContact O-N 2.87Å; G693-F696 PolarHBondContact O-N 2.61Å; G693-G697 WeakPolarHBondContact O-CA 3.21Å; G693-G697 PolarHBondContact O-N 2.97Å
694	I	94.8	Very high	93	Very high	101 Å²	101	41 Å²	41	52%	0.518	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-30.8	175.3	-66.4	164.3	0	0	0	112.5	S690 L692	S690-I694 WeakPolarHBondContact O-CG1 3.25Å; S690-I694 PolarHBondContact O-N 3.37Å; L692-I694 PolarHBondContact O-N 3.48Å
695	V	95.9	Very high	91.5	Very high	29 Å²	29	40.7 Å²	40.7	18%	0.176	23%	0.227	C	C	.	.	H	α-helix	trans	-85.3	-40.5	179.5	174.3	0	0	0	0	111.8	K606 M687 N691 L692 G693 T699	K606-V695 HydrophobicContact CD-CG1 3.6Å; K606-V695 HydrophobicContact CG-CG1 4.39Å; M687-V695 HydrophobicContact CE-CG2 4.44Å; N691-V695 WeakPolarHBondContact O-CG2 3.49Å; L692-V695 PolarHBondContact O-N 2.95Å; G693-V695 PolarHBondContact O-N 2.87Å; V695-T699 PolarHBondContact O-OG1 3.19Å
696	F	97.3	Very high	89.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-95.8	-25.3	-171.8	-82.4	-84.6	0	0	0	114.5	Y568 K606 L672 L676 L692 G693 T699 L700 V724	Y568-F696 AromaticContact CD1-CE2 3.6Å; Y568-F696 HydrophobicContact CD1-CE2 3.6Å; Y568-F696 AromaticContact CD1-CZ 3.68Å; Y568-F696 HydrophobicContact CD1-CZ 3.68Å; Y568-F696 HydrophobicContact CD2-CE2 4.35Å; Y568-F696 AromaticContact CE1-CE2 3.92Å; Y568-F696 HydrophobicContact CE1-CE2 3.92Å; Y568-F696 AromaticContact CE1-CZ 3.58Å; Y568-F696 HydrophobicContact CE1-CZ 3.58Å; Y568-F696 AromaticContact CG-CE2 3.85Å; Y568-F696 HydrophobicContact CG-CE2 3.85Å; Y568-F696 HydrophobicContact CG-CZ 4.37Å; K606-F696 HydrophobicContact CG-CE1 4.4Å; K606-F696 HydrophobicContact CG-CZ 4.11Å; L672-F696 HydrophobicContact CD1-CE1 4.19Å; L672-F696 HydrophobicContact CD2-CD1 4.25Å; L672-F696 HydrophobicContact CD2-CE1 4.26Å; L676-F696 HydrophobicContact CD1-CB 4.37Å; L676-F696 HydrophobicContact CD1-CD1 4.2Å; L676-F696 HydrophobicContact CD1-CD2 3.81Å; L676-F696 HydrophobicContact CD1-CE1 4.46Å; L676-F696 HydrophobicContact CD1-CE2 4.09Å; L676-F696 HydrophobicContact CD1-CG 3.86Å; L676-F696 HydrophobicContact CD1-CZ 4.4Å; L676-F696 HydrophobicContact CD2-CD2 3.87Å; L676-F696 HydrophobicContact CD2-CE2 3.43Å; L676-F696 VanDerWaalsContact CD2-CE2 3.43Å; L676-F696 HydrophobicContact CD2-CZ 3.9Å; L676-F696 HydrophobicContact CG-CE2 4.42Å; L692-F696 PolarHBondContact O-N 3.39Å; G693-F696 PolarHBondContact O-N 2.61Å; F696-T699 HydrophobicContact CD1-CG2 4.41Å; F696-T699 CarbonylContact O-C 3.58Å; F696-T699 WeakPolarHBondContact O-CA 3.39Å; F696-T699 WeakPolarHBondContact O-CB 3.43Å; F696-T699 PolarHBondContact O-N 3.46Å; F696-L700 HydrophobicContact CB-CD1 4.22Å; F696-L700 HydrophobicContact CB-CG 4.37Å; F696-L700 HydrophobicContact CD1-CD1 4.34Å; F696-L700 HydrophobicContact CD1-CD2 4.35Å; F696-L700 HydrophobicContact CD1-CG 4.22Å; F696-L700 WeakPolarHBondContact O-CB 3.45Å; F696-L700 WeakPolarHBondContact O-CG 3.44Å; F696-L700 PolarHBondContact O-N 2.83Å; F696-V724 HydrophobicContact CB-CG1 3.87Å
697	G	95.6	Very high	87.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-46.4	-66	173.5	0	0	0	0	0	113.1	G693 T699 L700 L701	G693-G697 WeakPolarHBondContact O-CA 3.21Å; G693-G697 PolarHBondContact O-N 2.97Å; G697-T699 PolarHBondContact O-N 3.22Å; G697-T699 VanDerWaalsContact O-N 3.15Å; G697-L700 PolarHBondContact O-N 3.39Å; G697-L701 PolarHBondContact O-N 3.26Å
698	P	92.3	Very high	84.6	Confident	57 Å²	57	51.6 Å²	51.6	37%	0.37	30%	0.304	S	S	.	.	H	α-helix	trans	-73.8	1.3	177.2	31.1	-37.1	0	0	0	114.5	L701	P698-L701 CarbonylContact C-O 3.58Å
699	T	93.8	Very high	82.3	Confident	15 Å²	15	57 Å²	57	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-94.2	-37.4	172.5	-59.9	0	0	0	0	111	F609 V695 F696 G697 R702	F609-T699 HydrophobicContact CB-CG2 3.85Å; V695-T699 PolarHBondContact O-OG1 3.19Å; F696-T699 HydrophobicContact CD1-CG2 4.41Å; F696-T699 CarbonylContact O-C 3.58Å; F696-T699 WeakPolarHBondContact O-CA 3.39Å; F696-T699 WeakPolarHBondContact O-CB 3.43Å; F696-T699 PolarHBondContact O-N 3.46Å; G697-T699 PolarHBondContact O-N 3.22Å; G697-T699 VanDerWaalsContact O-N 3.15Å; T699-R702 PolarHBondContact O-NH1 2.84Å
700	L	96.1	Very high	80.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-96.8	-23.3	-176.5	-58	-177.3	0	0	0	113.4	F609 P615 L616 L617 L669 L672 F696 G697 V724	F609-L700 HydrophobicContact CB-CD2 4.16Å; F609-L700 HydrophobicContact CD1-CD2 4.3Å; F609-L700 HydrophobicContact CD2-CD2 4.41Å; F609-L700 HydrophobicContact CG-CD2 4.05Å; P615-L700 WeakPolarHBondContact CB-O 3.44Å; L616-L700 HydrophobicContact CB-CD2 4.03Å; L616-L700 HydrophobicContact CD2-CD2 3.84Å; L616-L700 PolarHBondContact N-O 2.98Å; L617-L700 HydrophobicContact CD1-CB 4.17Å; L617-L700 PolarHBondContact N-O 3.4Å; L669-L700 HydrophobicContact CD1-CD1 4.23Å; L672-L700 HydrophobicContact CD2-CD1 3.8Å; L672-L700 HydrophobicContact CD2-CD2 3.66Å; L672-L700 HydrophobicContact CD2-CG 4.33Å; F696-L700 HydrophobicContact CB-CD1 4.22Å; F696-L700 HydrophobicContact CB-CG 4.37Å; F696-L700 HydrophobicContact CD1-CD1 4.34Å; F696-L700 HydrophobicContact CD1-CD2 4.35Å; F696-L700 HydrophobicContact CD1-CG 4.22Å; F696-L700 WeakPolarHBondContact O-CB 3.45Å; F696-L700 WeakPolarHBondContact O-CG 3.44Å; F696-L700 PolarHBondContact O-N 2.83Å; G697-L700 PolarHBondContact O-N 3.39Å; L700-V724 HydrophobicContact CD1-CG2 4.48Å
701	L	92.3	Very high	78.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.351	C	S	.	.			trans	-115.4	134.3	171.5	-75	155.2	0	0	0	109.5	L617 Y622 F625 G697 P698 Q720 L723	L617-L701 HydrophobicContact CB-CD2 3.63Å; L617-L701 HydrophobicContact CB-CG 4Å; L617-L701 HydrophobicContact CD1-CD1 3.91Å; L617-L701 HydrophobicContact CD1-CD2 4.16Å; L617-L701 HydrophobicContact CD1-CG 3.73Å; L617-L701 HydrophobicContact CG-CG 4.49Å; Y622-L701 HydrophobicContact CD2-CB 4.24Å; Y622-L701 HydrophobicContact CD2-CD2 3.81Å; Y622-L701 HydrophobicContact CE2-CB 4.11Å; Y622-L701 HydrophobicContact CE2-CD2 4.42Å; F625-L701 HydrophobicContact CB-CD2 4.07Å; F625-L701 HydrophobicContact CD2-CD2 4.33Å; G697-L701 PolarHBondContact O-N 3.26Å; P698-L701 CarbonylContact C-O 3.58Å; L701-Q720 HydrophobicContact CB-CG 3.9Å; L701-Q720 HydrophobicContact CD1-CB 4.26Å; L701-Q720 HydrophobicContact CD1-CG 3.94Å; L701-L723 HydrophobicContact CD1-CD2 3.93Å
702	R	87.1	Confident	76.4	Confident	40 Å²	40	65 Å²	65	15%	0.151	36%	0.362	C	S	.	.			trans	-140.5	128.3	174.9	-64.2	-170.9	-74.9	-84.7	16.7	108.7	F609 K610 L612 P615 F619 T699	F609-R702 PolarHBondContact O-NH1 3.43Å; F609-R702 PolarHBondContact O-NH2 3.34Å; K610-R702 VanDerWaalsContact O-CZ 3.32Å; K610-R702 PolarHBondContact O-NH2 3.38Å; L612-R702 PolarHBondContact O-NH2 2.89Å; P615-R702 HydrophobicContact CB-CB 4.24Å; P615-R702 HydrophobicContact CB-CG 4.34Å; P615-R702 HydrophobicContact CG-CB 4.32Å; F619-R702 WeakPolarHBondContact CD1-O 3.27Å; F619-R702 HydrophobicContact CE1-CB 4.31Å; F619-R702 WeakPolarHBondContact CE1-O 3.42Å; T699-R702 PolarHBondContact O-NH1 2.84Å
703	P	79.9	Confident	74.7	Confident	62 Å²	62	66.4 Å²	66.4	40%	0.403	37%	0.374	S	S	.	.			trans	-66.9	140.8	172.1	27.7	-33.5	0	0	0	110.1	Y622 V705	Y622-P703 HydrophobicContact CE1-CB 4.16Å; Y622-P703 HydrophobicContact CE2-CB 4.31Å; P703-V705 PolarHBondContact O-N 3.24Å
704	L	70.6	Confident	73.2	Confident	134 Å²	134	70.8 Å²	70.8	70%	0.702	40%	0.397	S	S	*	.	S	Bend	trans	-62.7	-26.8	-177.9	-177.6	61.9	0	0	0	113.1	F619	F619-L704 HydrophobicContact CB-CD1 4.45Å; F619-L704 HydrophobicContact CD1-CB 3.83Å; F619-L704 HydrophobicContact CD1-CD1 3.96Å; F619-L704 HydrophobicContact CD1-CG 4.49Å; F619-L704 HydrophobicContact CD2-CD1 3.87Å; F619-L704 HydrophobicContact CE1-CB 4.24Å; F619-L704 HydrophobicContact CE1-CD1 4.07Å; F619-L704 HydrophobicContact CE2-CD1 3.97Å; F619-L704 HydrophobicContact CG-CB 4.29Å; F619-L704 HydrophobicContact CG-CD1 3.85Å; F619-L704 HydrophobicContact CZ-CD1 4.06Å
705	V	62.1	Low	72	Confident	100 Å²	100	70.2 Å²	70.2	61%	0.606	39%	0.394	S	S	*	.	S	Bend	trans	-106.5	122.8	173.4	-177	0	0	0	0	109	P703 T707	P703-V705 PolarHBondContact O-N 3.24Å; V705-T707 PolarHBondContact O-N 3.45Å
706	S	50.3	Low	71.3	Confident	115 Å²	115	71 Å²	71	80%	0.804	40%	0.396	S	S	*	.			trans	-74.2	73.9	172.5	63.6	0	0	0	0	110.7	D708	S706-D708 PolarHBondContact O-N 3.38Å
707	T	44.7	Very low	70.7	Confident	91 Å²	91	73.8 Å²	73.8	56%	0.558	41%	0.413	S	S	*	.			trans	-66.2	123.7	176.9	-55.5	0	0	0	0	109.9	V705 M709	V705-T707 PolarHBondContact O-N 3.45Å; T707-M709 PolarHBondContact O-N 3.39Å
708	D	43.5	Very low	70.5	Confident	155 Å²	155	75.5 Å²	75.5	83%	0.829	43%	0.425	S	S	*	.			trans	-55.3	139.3	174.6	-78	-52.8	0	0	0	110.7	S706 S710	S706-D708 PolarHBondContact O-N 3.38Å; D708-S710 PolarHBondContact O-N 2.97Å
709	M	48.6	Very low	70.5	Confident	163 Å²	163	74.4 Å²	74.4	80%	0.803	41%	0.414	S	S	*	.	S	Bend	trans	-57.3	95.1	-153.3	-163.8	140.4	69.3	0	0	114.7	T707 L714	T707-M709 PolarHBondContact O-N 3.39Å; M709-L714 HydrophobicContact CG-CD2 4.26Å; M709-L714 HydrophobicContact SD-CD2 4.28Å
710	S	54.5	Low	70.5	Confident	41 Å²	41	74.1 Å²	74.1	29%	0.287	41%	0.411	S	S	.	.			trans	-90.7	163.2	177.9	73.9	0	0	0	0	111.7	D708 I712 A713 L714	D708-S710 PolarHBondContact O-N 2.97Å; S710-I712 PolarHBondContact O-N 3.17Å; S710-I712 PolarHBondContact OG-N 3.44Å; S710-A713 PolarHBondContact O-N 3.29Å; S710-A713 VanDerWaalsContact O-N 3.09Å; S710-A713 PolarHBondContact OG-N 2.97Å; S710-L714 PolarHBondContact O-N 3.17Å
711	M	53.1	Low	70.5	Confident	150 Å²	150	74.8 Å²	74.8	74%	0.739	42%	0.416	S	S	*	.	H	α-helix	trans	-57.3	-31.7	172.3	-69	-67.5	-71	0	0	112.3	L714 L715	M711-L714 PolarHBondContact O-N 3.37Å; M711-L714 HydrophobicContact SD-CD1 4.32Å; M711-L715 PolarHBondContact O-N 3.47Å
712	I	58.1	Low	70.6	Confident	112 Å²	112	76.6 Å²	76.6	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-67.5	-41.8	177	-57.5	173.7	0	0	0	110.4	S710 L714 L715 E716	S710-I712 PolarHBondContact O-N 3.17Å; S710-I712 PolarHBondContact OG-N 3.44Å; I712-L714 VanDerWaalsContact C-N 3.28Å; I712-L714 PolarHBondContact O-N 2.94Å; I712-L715 PolarHBondContact O-N 2.86Å; I712-E716 PolarHBondContact O-N 3.33Å
713	A	61.8	Low	71	Confident	29 Å²	29	74.7 Å²	74.7	24%	0.24	42%	0.418	C	S	.	.	H	α-helix	trans	-64.6	-30.7	177.2	0	0	0	0	0	113	S710 T717	S710-A713 PolarHBondContact O-N 3.29Å; S710-A713 VanDerWaalsContact O-N 3.09Å; S710-A713 PolarHBondContact OG-N 2.97Å; A713-T717 PolarHBondContact O-N 3.1Å; A713-T717 VanDerWaalsContact O-N 3.07Å; A713-T717 PolarHBondContact O-OG1 2.84Å
714	L	64.3	Low	71.9	Confident	93 Å²	93	71.8 Å²	71.8	49%	0.487	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-42.7	173.4	-64.6	175.6	0	0	0	111.8	M709 S710 M711 I712 T717 S718	M709-L714 HydrophobicContact CG-CD2 4.26Å; M709-L714 HydrophobicContact SD-CD2 4.28Å; S710-L714 PolarHBondContact O-N 3.17Å; M711-L714 PolarHBondContact O-N 3.37Å; M711-L714 HydrophobicContact SD-CD1 4.32Å; I712-L714 VanDerWaalsContact C-N 3.28Å; I712-L714 PolarHBondContact O-N 2.94Å; L714-T717 WeakPolarHBondContact O-CB 3.47Å; L714-T717 PolarHBondContact O-N 3.3Å; L714-S718 PolarHBondContact O-N 2.93Å
715	L	70.5	Confident	73.1	Confident	88 Å²	88	67.6 Å²	67.6	46%	0.461	38%	0.376	S	S	.	.	H	α-helix	trans	-67.5	-39.5	174.3	-68.1	169.8	0	0	0	112	M711 I712 T717 S718 Y719	M711-L715 PolarHBondContact O-N 3.47Å; I712-L715 PolarHBondContact O-N 2.86Å; L715-T717 PolarHBondContact O-N 2.88Å; L715-S718 PolarHBondContact O-N 2.92Å; L715-S718 PolarHBondContact O-OG 3.05Å; L715-Y719 HydrophobicContact CB-CE2 4.04Å; L715-Y719 WeakPolarHBondContact O-CD2 3.47Å; L715-Y719 WeakPolarHBondContact O-CE2 3.49Å; L715-Y719 PolarHBondContact O-N 2.9Å; L715-Y719 VanDerWaalsContact O-N 3.1Å
716	E	80.3	Confident	74.8	Confident	47 Å²	47	63.8 Å²	63.8	22%	0.22	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-33.1	172.4	-74.9	-176.7	-152.5	0	0	112.3	Y622 I626 I712 S718 Y719 Q720	Y622-E716 WeakPolarHBondContact CE1-OE2 3.22Å; Y622-E716 PolarHBondContact OH-OE2 2.77Å; I626-E716 HydrophobicContact CG2-CG 4.31Å; I712-E716 PolarHBondContact O-N 3.33Å; E716-S718 VanDerWaalsContact C-N 3.34Å; E716-S718 PolarHBondContact O-N 3.4Å; E716-Y719 PolarHBondContact O-N 3.37Å; E716-Q720 WeakPolarHBondContact O-CG 3.48Å; E716-Q720 PolarHBondContact O-N 2.89Å
717	T	85.9	Confident	77	Confident	57 Å²	57	58.3 Å²	58.3	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-66.7	-32.1	174.4	-52.1	0	0	0	0	112.3	A713 L714 L715 S721	A713-T717 PolarHBondContact O-N 3.1Å; A713-T717 VanDerWaalsContact O-N 3.07Å; A713-T717 PolarHBondContact O-OG1 2.84Å; L714-T717 WeakPolarHBondContact O-CB 3.47Å; L714-T717 PolarHBondContact O-N 3.3Å; L715-T717 PolarHBondContact O-N 2.88Å; T717-S721 WeakPolarHBondContact O-CB 3.48Å; T717-S721 PolarHBondContact O-N 2.71Å; T717-S721 VanDerWaalsContact O-N 3.14Å; T717-S721 PolarHBondContact O-OG 3.13Å
718	S	90.7	Very high	79.5	Confident	36 Å²	36	54.1 Å²	54.1	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-70.8	-44.5	172.1	72.1	0	0	0	0	111.4	Q633 L714 L715 E716 Q720 S721 M722	Q633-S718 PolarHBondContact OE1-OG 2.76Å; L714-S718 PolarHBondContact O-N 2.93Å; L715-S718 PolarHBondContact O-N 2.92Å; L715-S718 PolarHBondContact O-OG 3.05Å; E716-S718 VanDerWaalsContact C-N 3.34Å; E716-S718 PolarHBondContact O-N 3.4Å; S718-Q720 VanDerWaalsContact C-N 3.33Å; S718-Q720 PolarHBondContact O-N 3.48Å; S718-S721 WeakPolarHBondContact O-CB 3.27Å; S718-S721 PolarHBondContact O-N 3.5Å; S718-M722 WeakPolarHBondContact O-CG 3.42Å; S718-M722 PolarHBondContact O-N 3.05Å
719	Y	93.2	Very high	81.9	Confident	35 Å²	35	49.3 Å²	49.3	14%	0.137	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-39.6	176.7	-53.6	-42.2	0	0	0	112.5	I626 K630 Q633 L715 E716 S721 L723	I626-Y719 HydrophobicContact CG2-CD2 4.06Å; K630-Y719 HydrophobicContact CB-CD1 4.35Å; K630-Y719 HydrophobicContact CB-CE1 4.37Å; K630-Y719 HydrophobicContact CD-CD2 4.32Å; K630-Y719 HydrophobicContact CD-CE2 4.14Å; K630-Y719 HydrophobicContact CG-CD1 3.71Å; K630-Y719 HydrophobicContact CG-CD2 3.65Å; K630-Y719 HydrophobicContact CG-CE1 3.66Å; K630-Y719 HydrophobicContact CG-CE2 3.63Å; K630-Y719 HydrophobicContact CG-CG 3.73Å; Q633-Y719 HydrophobicContact CB-CD1 4.24Å; Q633-Y719 HydrophobicContact CB-CE1 4.34Å; Q633-Y719 VanDerWaalsContact OE1-CD1 3.27Å; Q633-Y719 VanDerWaalsContact OE1-CE1 3.22Å; L715-Y719 HydrophobicContact CB-CE2 4.04Å; L715-Y719 WeakPolarHBondContact O-CD2 3.47Å; L715-Y719 WeakPolarHBondContact O-CE2 3.49Å; L715-Y719 PolarHBondContact O-N 2.9Å; L715-Y719 VanDerWaalsContact O-N 3.1Å; E716-Y719 PolarHBondContact O-N 3.37Å; Y719-S721 VanDerWaalsContact C-N 3.35Å; Y719-L723 WeakPolarHBondContact O-CB 3.4Å; Y719-L723 PolarHBondContact O-N 3.02Å; Y719-L723 VanDerWaalsContact O-N 3.07Å
720	Q	93.9	Very high	84.1	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-42.5	171.8	-70	166.9	12.1	0	0	112.1	Y622 I626 L701 E716 S718 V724	Y622-Q720 PolarHBondContact OH-NE2 2.71Å; I626-Q720 HydrophobicContact CD1-CG 3.52Å; L701-Q720 HydrophobicContact CB-CG 3.9Å; L701-Q720 HydrophobicContact CD1-CB 4.26Å; L701-Q720 HydrophobicContact CD1-CG 3.94Å; E716-Q720 WeakPolarHBondContact O-CG 3.48Å; E716-Q720 PolarHBondContact O-N 2.89Å; S718-Q720 VanDerWaalsContact C-N 3.33Å; S718-Q720 PolarHBondContact O-N 3.48Å; Q720-V724 PolarHBondContact O-N 2.9Å
721	S	94.8	Very high	86	Confident	14 Å²	14	42.4 Å²	42.4	10%	0.098	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-46.6	-178.4	-57	0	0	0	0	111.5	T717 S718 Y719 L723 V724 E725	T717-S721 WeakPolarHBondContact O-CB 3.48Å; T717-S721 PolarHBondContact O-N 2.71Å; T717-S721 VanDerWaalsContact O-N 3.14Å; T717-S721 PolarHBondContact O-OG 3.13Å; S718-S721 WeakPolarHBondContact O-CB 3.27Å; S718-S721 PolarHBondContact O-N 3.5Å; Y719-S721 VanDerWaalsContact C-N 3.35Å; S721-L723 VanDerWaalsContact C-N 3.35Å; S721-L723 PolarHBondContact O-N 3.29Å; S721-V724 PolarHBondContact O-N 3.21Å; S721-E725 WeakPolarHBondContact O-CB 3.42Å; S721-E725 PolarHBondContact O-N 3.48Å
722	M	94.6	Very high	87.9	Confident	38 Å²	38	39 Å²	39	19%	0.187	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-38.8	177.5	-67.7	-57	-61.4	0	0	112.3	I632 Q633 S718 E725 F726	I632-M722 HydrophobicContact CG2-CB 4.12Å; I632-M722 HydrophobicContact CG2-CE 4.25Å; Q633-M722 HydrophobicContact CB-CG 4.28Å; S718-M722 WeakPolarHBondContact O-CG 3.42Å; S718-M722 PolarHBondContact O-N 3.05Å; M722-E725 PolarHBondContact O-N 2.87Å; M722-F726 WeakPolarHBondContact O-CB 3.41Å; M722-F726 PolarHBondContact O-N 2.97Å
723	L	96.7	Very high	89.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-42.8	176.5	177	64.8	0	0	0	112.3	F625 L628 I632 L654 L701 Y719 S721 F726 L727	F625-L723 HydrophobicContact CB-CD2 3.64Å; F625-L723 HydrophobicContact CD1-CD2 3.87Å; F625-L723 HydrophobicContact CG-CD2 4.1Å; L628-L723 HydrophobicContact CB-CD1 4.37Å; I632-L723 HydrophobicContact CD1-CD1 3.79Å; L654-L723 HydrophobicContact CD1-CD1 4.06Å; L654-L723 HydrophobicContact CD2-CD1 4.44Å; L701-L723 HydrophobicContact CD1-CD2 3.93Å; Y719-L723 WeakPolarHBondContact O-CB 3.4Å; Y719-L723 PolarHBondContact O-N 3.02Å; Y719-L723 VanDerWaalsContact O-N 3.07Å; S721-L723 VanDerWaalsContact C-N 3.35Å; S721-L723 PolarHBondContact O-N 3.29Å; L723-F726 PolarHBondContact O-N 3.46Å; L723-L727 HydrophobicContact CG-CD1 4.3Å; L723-L727 WeakPolarHBondContact O-CG 3.49Å; L723-L727 PolarHBondContact O-N 3.38Å
724	V	97.3	Very high	91	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-72.3	-35.1	177.9	175.8	0	0	0	0	111.6	F696 L700 Q720 S721 L727 I728	F696-V724 HydrophobicContact CB-CG1 3.87Å; L700-V724 HydrophobicContact CD1-CG2 4.48Å; Q720-V724 PolarHBondContact O-N 2.9Å; S721-V724 PolarHBondContact O-N 3.21Å; V724-L727 PolarHBondContact O-N 2.79Å; V724-I728 HydrophobicContact CG1-CD1 4.03Å; V724-I728 WeakPolarHBondContact O-CD1 3.37Å; V724-I728 VanDerWaalsContact O-CG1 3.28Å; V724-I728 WeakPolarHBondContact O-CG1 3.33Å; V724-I728 PolarHBondContact O-N 2.98Å; V724-I728 VanDerWaalsContact O-N 3.08Å
725	E	96.9	Very high	92.2	Very high	47 Å²	47	36.2 Å²	36.2	22%	0.22	19%	0.185	C	C	.	.	H	α-helix	trans	-58.2	-47	168.7	167.3	154.7	-141.1	0	0	111.8	P689 S690 S721 M722 I728 A729	P689-E725 HydrophobicContact CB-CG 3.99Å; S690-E725 VanDerWaalsContact CA-OE1 3.31Å; S690-E725 WeakPolarHBondContact CA-OE1 3.34Å; S690-E725 WeakPolarHBondContact CA-OE2 3.45Å; S690-E725 WeakPolarHBondContact CB-OE1 3.48Å; S690-E725 WeakPolarHBondContact CB-OE2 3.42Å; S690-E725 VanDerWaalsContact N-CD 3.27Å; S690-E725 PolarHBondContact N-OE1 2.99Å; S690-E725 PolarHBondContact OG-OE2 3.45Å; S721-E725 WeakPolarHBondContact O-CB 3.42Å; S721-E725 PolarHBondContact O-N 3.48Å; M722-E725 PolarHBondContact O-N 2.87Å; E725-I728 PolarHBondContact O-N 3.39Å; E725-A729 WeakPolarHBondContact O-CB 3.38Å; E725-A729 PolarHBondContact O-N 3.38Å
726	F	96.2	Very high	92.7	Very high	20 Å²	20	33.3 Å²	33.3	9%	0.088	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-39.1	178.5	-169	-85.1	0	0	0	112.6	I632 I647 I650 I651 L654 M722 L723 I728 A729 H730 I734	I632-F726 HydrophobicContact CD1-CB 3.83Å; I632-F726 HydrophobicContact CD1-CD1 4.09Å; I632-F726 HydrophobicContact CD1-CD2 4.18Å; I632-F726 HydrophobicContact CD1-CG 3.79Å; I632-F726 HydrophobicContact CG1-CB 4.46Å; I632-F726 HydrophobicContact CG1-CD2 4Å; I632-F726 HydrophobicContact CG1-CE2 4.35Å; I632-F726 HydrophobicContact CG1-CG 4.13Å; I632-F726 HydrophobicContact CG2-CB 4.12Å; I632-F726 HydrophobicContact CG2-CD2 3.9Å; I632-F726 HydrophobicContact CG2-CG 4.31Å; I647-F726 HydrophobicContact CG2-CE2 4.32Å; I647-F726 HydrophobicContact CG2-CZ 4.13Å; I650-F726 HydrophobicContact CB-CE1 4.32Å; I650-F726 HydrophobicContact CB-CZ 3.83Å; I650-F726 HydrophobicContact CG2-CD1 4.29Å; I650-F726 HydrophobicContact CG2-CE1 3.54Å; I650-F726 HydrophobicContact CG2-CE2 4.14Å; I650-F726 HydrophobicContact CG2-CZ 3.44Å; I650-F726 VanDerWaalsContact CG2-CZ 3.44Å; I651-F726 HydrophobicContact CG1-CE1 3.9Å; I651-F726 HydrophobicContact CG1-CZ 4.03Å; L654-F726 HydrophobicContact CD2-CD1 3.91Å; L654-F726 HydrophobicContact CD2-CE1 4.17Å; M722-F726 WeakPolarHBondContact O-CB 3.41Å; M722-F726 PolarHBondContact O-N 2.97Å; L723-F726 PolarHBondContact O-N 3.46Å; F726-I728 VanDerWaalsContact C-N 3.32Å; F726-I728 PolarHBondContact O-N 3.15Å; F726-A729 PolarHBondContact O-N 3.18Å; F726-H730 AromaticContact CD2-CD2 3.73Å; F726-H730 AromaticContact CE1-CD2 3.75Å; F726-H730 AromaticContact CE2-CD2 3.46Å; F726-H730 VanDerWaalsContact CE2-CD2 3.46Å; F726-H730 WeakPolarHBondContact CE2-CD2 3.45Å; F726-H730 AromaticContact CE2-NE2 3.76Å; F726-H730 AromaticContact CZ-CD2 3.47Å; F726-H730 VanDerWaalsContact CZ-CD2 3.47Å; F726-H730 WeakPolarHBondContact CZ-CD2 3.35Å; F726-H730 PolarHBondContact O-N 3.16Å; F726-H730 VanDerWaalsContact O-N 3.08Å; F726-I734 HydrophobicContact CD1-CD1 4.2Å; F726-I734 HydrophobicContact CE1-CD1 4.33Å
727	L	96.9	Very high	92	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-43.9	172.6	-82.8	162.2	0	0	0	111.8	L654 L658 I673 L723 V724 H731 I734 F735	L654-L727 HydrophobicContact CD1-CD2 4.36Å; L654-L727 HydrophobicContact CD2-CD2 3.86Å; L654-L727 HydrophobicContact CD2-CG 4.15Å; L654-L727 HydrophobicContact CG-CD2 4.32Å; L658-L727 HydrophobicContact CD1-CD2 4.18Å; I673-L727 HydrophobicContact CD1-CB 4.03Å; I673-L727 HydrophobicContact CG1-CB 4.37Å; I673-L727 HydrophobicContact CG2-CB 4.34Å; I673-L727 VanDerWaalsContact CG2-O 3.3Å; I673-L727 WeakPolarHBondContact CG2-O 3.47Å; L723-L727 HydrophobicContact CG-CD1 4.3Å; L723-L727 WeakPolarHBondContact O-CG 3.49Å; L723-L727 PolarHBondContact O-N 3.38Å; V724-L727 PolarHBondContact O-N 2.79Å; L727-H731 WeakPolarHBondContact O-CA 3.42Å; L727-H731 PolarHBondContact O-N 2.84Å; L727-H731 VanDerWaalsContact O-N 3.15Å; L727-I734 HydrophobicContact CD2-CD1 4.33Å; L727-I734 HydrophobicContact CD2-CG2 4.31Å; L727-F735 HydrophobicContact CD2-CE2 3.96Å; L727-F735 HydrophobicContact CD2-CZ 4Å
728	I	97.1	Very high	90.1	Very high	2 Å²	2	41 Å²	41	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-70.2	-49.8	178	-64.9	164.2	0	0	0	110.7	I673 L676 Q677 P689 L692 V724 E725 F726 H730 H731	I673-I728 HydrophobicContact CD1-CG1 4.37Å; I673-I728 HydrophobicContact CG2-CG1 4.26Å; L676-I728 HydrophobicContact CB-CD1 3.84Å; L676-I728 HydrophobicContact CB-CG1 3.94Å; L676-I728 HydrophobicContact CD1-CD1 4.18Å; Q677-I728 HydrophobicContact CB-CG2 4.5Å; P689-I728 HydrophobicContact CB-CB 4.27Å; P689-I728 HydrophobicContact CB-CG2 3.98Å; P689-I728 HydrophobicContact CG-CG2 4.08Å; L692-I728 HydrophobicContact CB-CD1 3.73Å; L692-I728 HydrophobicContact CD1-CD1 4.34Å; V724-I728 HydrophobicContact CG1-CD1 4.03Å; V724-I728 WeakPolarHBondContact O-CD1 3.37Å; V724-I728 VanDerWaalsContact O-CG1 3.28Å; V724-I728 WeakPolarHBondContact O-CG1 3.33Å; V724-I728 PolarHBondContact O-N 2.98Å; V724-I728 VanDerWaalsContact O-N 3.08Å; E725-I728 PolarHBondContact O-N 3.39Å; F726-I728 VanDerWaalsContact C-N 3.32Å; F726-I728 PolarHBondContact O-N 3.15Å; I728-H730 PolarHBondContact O-N 3.2Å; I728-H731 PolarHBondContact O-N 3.13Å
729	A	95.1	Very high	87.5	Confident	55 Å²	55	47.5 Å²	47.5	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-18.8	-174.9	0	0	0	0	0	114.3	E725 F726	E725-A729 WeakPolarHBondContact O-CB 3.38Å; E725-A729 PolarHBondContact O-N 3.38Å; F726-A729 PolarHBondContact O-N 3.18Å
730	H	94.1	Very high	84.6	Confident	49 Å²	49	51.1 Å²	51.1	23%	0.227	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	20.7	-179.8	-61.9	-35.3	0	0	0	113.9	I651 F726 I728 D732 R733 I734	I651-H730 HydrophobicContact CD1-CB 4.26Å; F726-H730 AromaticContact CD2-CD2 3.73Å; F726-H730 AromaticContact CE1-CD2 3.75Å; F726-H730 AromaticContact CE2-CD2 3.46Å; F726-H730 VanDerWaalsContact CE2-CD2 3.46Å; F726-H730 WeakPolarHBondContact CE2-CD2 3.45Å; F726-H730 AromaticContact CE2-NE2 3.76Å; F726-H730 AromaticContact CZ-CD2 3.47Å; F726-H730 VanDerWaalsContact CZ-CD2 3.47Å; F726-H730 WeakPolarHBondContact CZ-CD2 3.35Å; F726-H730 PolarHBondContact O-N 3.16Å; F726-H730 VanDerWaalsContact O-N 3.08Å; I728-H730 PolarHBondContact O-N 3.2Å; H730-D732 VanDerWaalsContact C-N 3.35Å; H730-D732 PolarHBondContact O-N 3.1Å; H730-R733 PolarHBondContact O-N 3.18Å; H730-I734 HydrophobicContact CB-CD1 3.76Å; H730-I734 HydrophobicContact CB-CG1 4.21Å; H730-I734 WeakPolarHBondContact O-CG1 3.44Å; H730-I734 PolarHBondContact O-N 3.29Å
731	H	94.2	Very high	81.8	Confident	9 Å²	9	56.9 Å²	56.9	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-39.8	-58.1	-179.9	168.2	-91.4	0	0	0	113.2	I673 Q677 L727 I728 R733 I734 F735	I673-H731 HydrophobicContact CG2-CB 4.18Å; Q677-H731 VanDerWaalsContact OE1-CG 3.22Å; Q677-H731 PolarHBondContact OE1-ND1 3.39Å; L727-H731 WeakPolarHBondContact O-CA 3.42Å; L727-H731 PolarHBondContact O-N 2.84Å; L727-H731 VanDerWaalsContact O-N 3.15Å; I728-H731 PolarHBondContact O-N 3.13Å; H731-R733 PolarHBondContact O-N 3.16Å; H731-R733 VanDerWaalsContact O-N 3.07Å; H731-I734 PolarHBondContact O-N 3.44Å; H731-F735 AromaticContact CD2-CD2 3.59Å; H731-F735 PolarHBondContact O-N 2.97Å
732	D	92.5	Very high	78.9	Confident	79 Å²	79	63 Å²	63	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-22	-173.4	-46.9	-21	0	0	0	113.7	Q677 H730 G736 I737	Q677-D732 PolarHBondContact NE2-OD1 3.02Å; Q677-D732 PolarHBondContact NE2-OD2 3.45Å; Q677-D732 PolarHBondContact OE1-OD1 3.04Å; H730-D732 VanDerWaalsContact C-N 3.35Å; H730-D732 PolarHBondContact O-N 3.1Å; D732-G736 CarbonylContact O-C 3.54Å; D732-G736 VanDerWaalsContact O-C 3.26Å; D732-G736 WeakPolarHBondContact O-CA 3.39Å; D732-G736 PolarHBondContact O-N 3.26Å; D732-I737 HydrophobicContact CB-CG1 4.32Å
733	R	91.9	Very high	75.9	Confident	148 Å²	148	67.6 Å²	67.6	56%	0.558	37%	0.366	S	S	*	.	H	α-helix	trans	-92.3	-28.6	175.7	-63.6	-174.6	178.2	-168.8	-0.2	112.6	I651 Q655 H730 H731	I651-R733 HydrophobicContact CD1-CB 3.98Å; I651-R733 HydrophobicContact CG2-CB 4.36Å; Q655-R733 PolarHBondContact NE2-O 3.48Å; H730-R733 PolarHBondContact O-N 3.18Å; H731-R733 PolarHBondContact O-N 3.16Å; H731-R733 VanDerWaalsContact O-N 3.07Å
734	I	92.9	Very high	73.3	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	40%	0.4	C	S	.	.	H	α-helix	trans	-82.1	-54.9	-178.4	-66.5	163.5	0	0	0	110	I651 L654 Q655 L658 F726 L727 H730 H731	I651-I734 HydrophobicContact CG1-CG1 4.23Å; I651-I734 HydrophobicContact CG2-CG1 4.12Å; L654-I734 HydrophobicContact CD2-CD1 3.66Å; L654-I734 HydrophobicContact CD2-CG1 4.26Å; L654-I734 HydrophobicContact CD2-CG2 4.47Å; L654-I734 HydrophobicContact CG-CG2 4.43Å; Q655-I734 HydrophobicContact CG-CG2 4.47Å; Q655-I734 VanDerWaalsContact CG-O 3.31Å; Q655-I734 WeakPolarHBondContact CG-O 3.34Å; Q655-I734 PolarHBondContact NE2-O 2.8Å; L658-I734 HydrophobicContact CD1-CG2 3.43Å; L658-I734 VanDerWaalsContact CD1-CG2 3.43Å; F726-I734 HydrophobicContact CD1-CD1 4.2Å; F726-I734 HydrophobicContact CE1-CD1 4.33Å; L727-I734 HydrophobicContact CD2-CD1 4.33Å; L727-I734 HydrophobicContact CD2-CG2 4.31Å; H730-I734 HydrophobicContact CB-CD1 3.76Å; H730-I734 HydrophobicContact CB-CG1 4.21Å; H730-I734 WeakPolarHBondContact O-CG1 3.44Å; H730-I734 PolarHBondContact O-N 3.29Å; H731-I734 PolarHBondContact O-N 3.44Å
735	F	90.1	Very high	70.9	Confident	23 Å²	23	78.2 Å²	78.2	10%	0.101	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-22.6	-178.1	-61.2	-82.1	0	0	0	112.8	L658 Y666 L669 Q670 I673 L727 H731	L658-F735 HydrophobicContact CD1-CE1 3.97Å; L658-F735 HydrophobicContact CD1-CZ 3.89Å; Y666-F735 HydrophobicContact CE2-CD1 4.17Å; Y666-F735 HydrophobicContact CE2-CE1 4.1Å; Y666-F735 AromaticContact CZ-CD1 3.9Å; L669-F735 HydrophobicContact CD2-CZ 4.29Å; L669-F735 HydrophobicContact CG-CZ 4.36Å; Q670-F735 HydrophobicContact CB-CD1 3.57Å; Q670-F735 HydrophobicContact CB-CE1 3.78Å; Q670-F735 HydrophobicContact CB-CG 4.27Å; Q670-F735 HydrophobicContact CG-CB 4Å; Q670-F735 HydrophobicContact CG-CD1 3.63Å; Q670-F735 HydrophobicContact CG-CE1 4.33Å; Q670-F735 HydrophobicContact CG-CG 3.91Å; I673-F735 HydrophobicContact CB-CE2 4.07Å; I673-F735 HydrophobicContact CG1-CE2 4.19Å; I673-F735 HydrophobicContact CG1-CZ 4.27Å; I673-F735 HydrophobicContact CG2-CE2 4.03Å; L727-F735 HydrophobicContact CD2-CE2 3.96Å; L727-F735 HydrophobicContact CD2-CZ 4Å; H731-F735 AromaticContact CD2-CD2 3.59Å; H731-F735 PolarHBondContact O-N 2.97Å
736	G	81	Confident	68.5	Low	27 Å²	27	81.8 Å²	81.8	28%	0.278	46%	0.463	S	S	.	.			trans	98.1	169.5	-174.6	0	0	0	0	0	112.5	D732 E738	D732-G736 CarbonylContact O-C 3.54Å; D732-G736 VanDerWaalsContact O-C 3.26Å; D732-G736 WeakPolarHBondContact O-CA 3.39Å; D732-G736 PolarHBondContact O-N 3.26Å; G736-E738 PolarHBondContact O-N 3.43Å
737	I	65.5	Low	66	Low	141 Å²	141	86.7 Å²	86.7	72%	0.723	50%	0.497	S	S	*	.			trans	-82.3	102	173	-57.9	172.8	0	0	0	108.1	D732 Q739	D732-I737 HydrophobicContact CB-CG1 4.32Å; I737-Q739 PolarHBondContact O-N 3.48Å
738	E	46.5	Very low	63.3	Low	125 Å²	125	90.5 Å²	90.5	58%	0.584	53%	0.528	S	S	*	.			trans	-65.4	115.5	164.2	-72.8	-164.8	149.6	0	0	109.6	Q670 G736 S740	Q670-E738 PolarHBondContact NE2-OE1 2.86Å; G736-E738 PolarHBondContact O-N 3.43Å; E738-S740 PolarHBondContact O-N 2.73Å; E738-S740 VanDerWaalsContact O-N 3.14Å
739	Q	35.8	Very low	60.6	Low	171 Å²	171	96.9 Å²	96.9	80%	0.799	57%	0.569	S	S	*	*			trans	-68.7	110.1	168.5	-67.7	-176.5	-1.2	0	0	108.4	I737 T741	I737-Q739 PolarHBondContact O-N 3.48Å; Q739-T741 PolarHBondContact O-N 3.2Å
740	S	32.8	Very low	58	Low	111 Å²	111	100.9 Å²	100.9	78%	0.776	59%	0.589	S	S	*	*			trans	-61.7	103.7	176.5	-169.6	0	0	0	0	110.5	E738 N742	E738-S740 PolarHBondContact O-N 2.73Å; E738-S740 VanDerWaalsContact O-N 3.14Å; S740-N742 PolarHBondContact O-N 3.12Å
741	T	34	Very low	55.3	Low	129 Å²	129	102.9 Å²	102.9	79%	0.791	61%	0.614	S	S	*	*			trans	-78.4	65	-176.9	38.8	0	0	0	0	111.7	Q739	Q739-T741 PolarHBondContact O-N 3.2Å
742	N	35.2	Very low	52.7	Low	144 Å²	144	108.5 Å²	108.5	77%	0.77	65%	0.651	S	S	*	*			trans	-145.8	42.8	176.5	-101.3	-45.3	0	0	0	115.5	S740	S740-N742 PolarHBondContact O-N 3.12Å
743	T	31.4	Very low	50.2	Low	133 Å²	133	112.6 Å²	112.6	82%	0.816	67%	0.672	S	S	*	*			trans	-148	116.7	153.6	-38	0	0	0	0	111.5
744	P	41.8	Very low	47.6	Very low	110 Å²	110	111.1 Å²	111.1	71%	0.714	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-70.3	147.3	166.7	-14.8	29.9	0	0	0	110.9
745	P	47.5	Very low	44.4	Very low	115 Å²	115	119.4 Å²	119.4	75%	0.747	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-62.5	146.8	165.8	28.7	-34.2	0	0	0	110.2
746	P	45.6	Very low	41.5	Very low	122 Å²	122	124.3 Å²	124.3	79%	0.792	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65.1	139.4	-177.1	26.5	-34.3	0	0	0	111.5
747	P	44	Very low	40.1	Very low	123 Å²	123	128.4 Å²	128.4	80%	0.799	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70	148.2	-178.8	29	-35.1	0	0	0	112.1
748	A	40.3	Very low	39.5	Very low	79 Å²	79	126.8 Å²	126.8	65%	0.653	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.4	138.3	177.5	0	0	0	0	0	112	T750	A748-T750 PolarHBondContact O-N 2.99Å; A748-T750 VanDerWaalsContact O-N 3.09Å; A748-T750 PolarHBondContact O-OG1 3.13Å
749	P	40.7	Very low	38.5	Very low	136 Å²	136	132.3 Å²	132.3	88%	0.883	79%	0.788	S	S	*	*			trans	-64.5	112.4	-179.4	-20.3	32.3	0	0	0	111.9
750	T	40.8	Very low	38.2	Very low	140 Å²	140	128.5 Å²	128.5	86%	0.859	79%	0.785	S	S	*	*			trans	-109.2	81.4	-177.6	-54.1	0	0	0	0	110.8	A748	A748-T750 PolarHBondContact O-N 2.99Å; A748-T750 VanDerWaalsContact O-N 3.09Å; A748-T750 PolarHBondContact O-OG1 3.13Å
751	A	36.9	Very low	38	Very low	91 Å²	91	128.6 Å²	128.6	75%	0.752	79%	0.786	S	S	*	*			trans	-149.6	141.6	165.3	0	0	0	0	0	109.5
752	P	38.7	Very low	37.5	Very low	127 Å²	127	128.1 Å²	128.1	83%	0.825	79%	0.787	S	S	*	*			trans	-85.4	153.8	-165.7	32.6	-35.9	0	0	0	115.1
753	L	40.5	Very low	38.1	Very low	164 Å²	164	126.3 Å²	126.3	86%	0.859	78%	0.783	S	S	*	*			trans	-68.1	152.5	170.4	-64.9	168.2	0	0	0	112.2
754	P	36.6	Very low	38.4	Very low	117 Å²	117	127 Å²	127	76%	0.76	78%	0.781	S	S	*	*				-138.9	161.5	111	40.9	-30.3	0	0	0	111.9
755	E	27	Very low	38	Very low	180 Å²	180	128.4 Å²	128.4	84%	0.841	78%	0.782	S	S	*	*			cis	-129.1	-164.3	4.6	-68.4	-171.4	137.3	0	0	111.7
756	T	29.1	Very low	37.2	Very low	125 Å²	125	126 Å²	126	77%	0.767	78%	0.778	S	S	*	*			trans	-134	-178.9	175.8	60.1	0	0	0	0	109.3
757	P	51.2	Low	36.5	Very low	114 Å²	114	125.6 Å²	125.6	74%	0.74	77%	0.773	S	S	*	*				-118	-135.1	-60.6	37.9	-20.1	0	0	0	107.4
758	P	52.6	Low	36.1	Very low	107 Å²	107	127 Å²	127	70%	0.695	77%	0.774	S	S	*	*			cis	-133.1	162.5	-27.8	37.1	-20.7	0	0	0	115.9
759	R	26.3	Very low	35.7	Very low	241 Å²	241	128.1 Å²	128.1	91%	0.909	78%	0.783	S	S	*	*				-178.9	147	119.9	-105.5	175.6	171	159.9	-1.1	115.2
760	A	29	Very low	35.1	Very low	90 Å²	90	128.7 Å²	128.7	74%	0.744	78%	0.779	S	S	*	*			trans	15.4	146	143.9	0	0	0	0	0	121.4
761	S	28	Very low	34.8	Very low	114 Å²	114	128.7 Å²	128.7	80%	0.797	77%	0.773	S	S	*	*			cis	-168.7	152.8	0.1	39.5	0	0	0	0	114.8
762	C	24.8	Very low	34.4	Very low	119 Å²	119	132 Å²	132	80%	0.804	77%	0.773	S	S	*	*			trans	-23.7	174.4	153.1	-68	0	0	0	0	121
763	P	47.5	Very low	34	Very low	105 Å²	105	132.4 Å²	132.4	68%	0.682	77%	0.767	S	S	*	*			cis	-152.6	-166.6	-28.5	41	-19.9	0	0	0	117.7
764	L	38.3	Very low	33.3	Very low	149 Å²	149	130.4 Å²	130.4	78%	0.78	76%	0.758	S	S	*	*			trans	74	145.4	157.4	-60.1	172.2	0	0	0	118.6
765	D	32.1	Very low	32.8	Very low	139 Å²	139	130.6 Å²	130.6	74%	0.743	76%	0.757	S	S	*	*			cis	-148.3	-165.8	0.4	-129.9	-38.2	0	0	0	109.1
766	G	31.6	Very low	32.8	Very low	64 Å²	64	127.6 Å²	127.6	66%	0.66	76%	0.755	S	S	*	*			cis	143.4	155.6	4.9	0	0	0	0	0	111
767	V	31	Very low	32.8	Very low	114 Å²	114	126.5 Å²	126.5	69%	0.691	75%	0.753	S	S	*	*			cis	-159.3	129.4	-7.6	-175.6	0	0	0	0	111.2
768	N	34.2	Very low	31.6	Very low	153 Å²	153	129.2 Å²	129.2	82%	0.818	75%	0.753	S	S	*	*			trans	49.7	145.5	154	-57.9	-9.5	0	0	0	127.5
769	A	31.9	Very low	30.4	Very low	102 Å²	102	131.7 Å²	131.7	84%	0.843	76%	0.756	S	S	*	*			trans	74.1	163.2	139.7	0	0	0	0	0	122
770	D	30	Very low	30.5	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	75%	0.754	S	S	*	*			cis	-173.5	175	-38.8	-163.5	7.4	0	0	0	109.2
771	L	33	Very low	31.1	Very low	140 Å²	140	132.2 Å²	132.2	73%	0.733	75%	0.752	S	S	*	*			trans	82	111	162.3	-60.5	171.2	0	0	0	122.1
772	E	29.5	Very low	31	Very low	160 Å²	160	134.6 Å²	134.6	75%	0.748	75%	0.751	S	S	*	*				63.7	137	116.6	-64.3	-72.3	100.4	0	0	125.4
773	L	29.1	Very low	31.2	Very low	136 Å²	136	134.2 Å²	134.2	71%	0.712	75%	0.75	S	S	*	*			trans	92.4	117.8	138.5	-121.4	73.9	0	0	0	124.9
774	D	26.6	Very low	30.5	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	75%	0.752	S	S	*	*			trans	64.2	111.2	133.9	-81.1	0.6	0	0	0	126.7
775	T	25.9	Very low	30.2	Very low	120 Å²	120	136.5 Å²	136.5	74%	0.736	75%	0.751	S	S	*	*				86.1	145.1	120.4	67.7	0	0	0	0	123.6
776	S	26.9	Very low	30.1	Very low	117 Å²	117	134.3 Å²	134.3	82%	0.818	75%	0.746	S	S	*	*			trans	84	131.5	143.8	-147.3	0	0	0	0	120.3
777	S	28.9	Very low	30	Very low	102 Å²	102	142.6 Å²	142.6	71%	0.713	76%	0.758	S	S	*	*			trans	-78.1	153.6	-176.4	48.3	0	0	0	0	114.4
778	K	27.5	Very low	30	Very low	171 Å²	171	143.4 Å²	143.4	74%	0.743	76%	0.763	S	S	*	*				-170.7	129.8	115.4	-106.5	173.8	174	-89.9	0	115
779	E	25.8	Very low	29.6	Very low	160 Å²	160	144.1 Å²	144.1	75%	0.748	77%	0.765	S	S	*	*			trans	56	155.9	137.8	-67.8	173.5	117.6	0	0	123.7
780	R	29.2	Very low	29.6	Very low	232 Å²	232	147.1 Å²	147.1	88%	0.875	76%	0.759	S	S	*	*			trans	-87.4	173.8	-174.4	-118.7	-179.5	176.1	153.8	-2.7	110.9
781	P	41.1	Very low	29.7	Very low	109 Å²	109	149.9 Å²	149.9	71%	0.708	76%	0.758	S	S	*	*			cis	-152.7	163.4	48.6	41.4	-19.1	0	0	0	121.1
782	Q	27	Very low	29.5	Very low	164 Å²	164	148.8 Å²	148.8	77%	0.766	75%	0.753	S	S	*	*			trans	44.9	121.2	140.4	-67.2	174.2	-31.5	0	0	124.4
783	S	28.8	Very low	29.6	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	76%	0.755	S	S	*	*				-165.4	142.5	126	42.1	0	0	0	0	107
784	L	31.8	Very low	29.6	Very low	140 Å²	140	146 Å²	146	73%	0.733	76%	0.763	S	S	*	*			cis	70.8	122.7	27	-66	176.8	0	0	0	114
785	E	31.7	Very low	29.8	Very low	161 Å²	161	149.8 Å²	149.8	75%	0.752	78%	0.777	S	S	*	*			cis	-166.2	169.6	3.6	-155.2	-175.9	146.6	0	0	112.6
786	S	31.3	Very low	29.9	Very low	93 Å²	93	147.9 Å²	147.9	65%	0.65	78%	0.781	S	S	*	*			trans	82.3	155.8	149.8	85.9	0	0	0	0	118.1
787	R	28.3	Very low	30.1	Very low	238 Å²	238	153.3 Å²	153.3	90%	0.898	79%	0.785	S	S	*	*			cis	-136.5	168.3	16.8	-73.3	-173.3	170.9	-178.8	-4	115.2
788	V	30.8	Very low	30.1	Very low	131 Å²	131	155.9 Å²	155.9	79%	0.794	79%	0.789	S	S	*	*			trans	-108.6	143.2	-179.2	172.3	0	0	0	0	112.7
789	I	27.1	Very low	30.1	Very low	169 Å²	169	152.3 Å²	152.3	87%	0.867	79%	0.786	S	S	*	*			trans	-144.6	159.4	157	-49	179.5	0	0	0	107.9
790	K	32.1	Very low	30.2	Very low	164 Å²	164	152.2 Å²	152.2	71%	0.713	79%	0.79	S	S	*	*				-173.5	154.8	-77.5	-174.6	173.9	-176.1	172.7	0	108.5
791	R	30.5	Very low	30	Very low	205 Å²	205	150.3 Å²	150.3	77%	0.774	79%	0.789	S	S	*	*			trans	86.7	154.4	169.4	-55.9	-164	132.9	111.2	0.1	118.3
792	D	28.6	Very low	29.6	Very low	118 Å²	118	150.4 Å²	150.4	63%	0.631	79%	0.792	S	S	*	*			cis	-162.2	152.2	-26	-95.5	-20.2	0	0	0	109.4
793	S	31.6	Very low	29.7	Very low	112 Å²	112	148 Å²	148	78%	0.783	79%	0.793	S	S	*	*			trans	49	122.3	149.6	-56.1	0	0	0	0	123.8
794	S	30.3	Very low	29.7	Very low	126 Å²	126	148 Å²	148	88%	0.881	79%	0.793	S	S	*	*				-172.1	172	110.7	31.9	0	0	0	0	111.9
795	E	30.2	Very low	29.5	Very low	202 Å²	202	149.1 Å²	149.1	94%	0.944	80%	0.8	S	S	*	*			trans	-104.6	156.5	-156.4	-61.2	162.7	113.2	0	0	115.2
796	G	27.8	Very low	29.6	Very low	80 Å²	80	150.9 Å²	150.9	83%	0.825	81%	0.808	S	S	*	*			trans	-170.2	119.4	167.3	0	0	0	0	0	111.6
797	Y	32.3	Very low	29.5	Very low	230 Å²	230	151 Å²	151	90%	0.902	82%	0.815	S	S	*	*			trans	-132.4	93.2	-169.3	-160.6	-77.8	0	0	0	111.7
798	I	29	Very low	29.5	Very low	157 Å²	157	146.5 Å²	146.5	81%	0.805	81%	0.813	S	S	*	*			trans	-141.3	97.2	175	-58.5	-178.9	0	0	0	106
799	S	27.7	Very low	29.5	Very low	95 Å²	95	147.2 Å²	147.2	66%	0.664	81%	0.813	S	S	*	*				73.9	63.8	87.2	-178.3	0	0	0	0	114.3	K801	S799-K801 PolarHBondContact O-N 3.26Å; S799-K801 VanDerWaalsContact O-N 3.13Å
800	D	26.2	Very low	29.5	Very low	159 Å²	159	148.2 Å²	148.2	85%	0.85	81%	0.814	S	S	*	*			trans	-67.7	104.4	169.1	-77.6	-56.8	0	0	0	112.5
801	K	26.2	Very low	29.4	Very low	192 Å²	192	148.5 Å²	148.5	84%	0.835	82%	0.822	S	S	*	*			trans	-112.7	84.9	155.4	-82.4	-168.5	174.5	-175.1	0	109.6	S799 S803	S799-K801 PolarHBondContact O-N 3.26Å; S799-K801 VanDerWaalsContact O-N 3.13Å; K801-S803 PolarHBondContact O-N 3.04Å
802	S	32.5	Very low	29.2	Very low	111 Å²	111	142 Å²	142	78%	0.776	82%	0.819	S	S	*	*			trans	-71.7	109.4	153	-70.9	0	0	0	0	106.9
803	S	28.2	Very low	29.6	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	82%	0.822	S	S	*	*				74.1	55.5	52.1	-159.9	0	0	0	0	112.6	K801	K801-S803 PolarHBondContact O-N 3.04Å
804	S	30.2	Very low	29.4	Very low	112 Å²	112	145 Å²	145	78%	0.783	83%	0.826	S	S	*	*			trans	-110.3	99.6	164	42.5	0	0	0	0	109.4
805	N	27.4	Very low	29.3	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	82%	0.82	S	S	*	*			trans	-106.2	92.6	172.2	-98.1	7.3	0	0	0	110.1
806	E	32.9	Very low	29.1	Very low	198 Å²	198	138.6 Å²	138.6	93%	0.925	81%	0.809	S	S	*	*			trans	-111.6	126.3	141.7	-74.4	-155	131.4	0	0	107.3
807	A	28.7	Very low	29	Very low	96 Å²	96	143.4 Å²	143.4	79%	0.793	81%	0.81	S	S	*	*			trans	-96.5	122.7	-168.2	0	0	0	0	0	111.9
808	V	30.2	Very low	28.8	Very low	143 Å²	143	137.5 Å²	137.5	87%	0.867	80%	0.802	S	S	*	*			trans	-132.8	107.9	156	-177.8	0	0	0	0	107.5	Q810	V808-Q810 PolarHBondContact O-N 3.3Å
809	D	29.3	Very low	28.7	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	80%	0.803	S	S	*	*			trans	-61	128.9	168.7	-72	-59.5	0	0	0	109.9
810	Q	28.4	Very low	28.5	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.883	81%	0.814	S	S	*	*				-158.1	148	98.3	-69.3	-142.1	10.5	0	0	110.2	V808	V808-Q810 PolarHBondContact O-N 3.3Å
811	L	29.5	Very low	28.6	Very low	171 Å²	171	137.7 Å²	137.7	90%	0.895	82%	0.816	S	S	*	*			trans	-84.5	143.5	-171.3	-69.4	166.6	0	0	0	113.4
812	G	26.4	Very low	28.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	82%	0.815	S	S	*	*			trans	-76	163.8	158.7	0	0	0	0	0	112
813	P	37.7	Very low	28.3	Very low	106 Å²	106	137.2 Å²	137.2	69%	0.688	82%	0.823	S	S	*	*			trans	-109.7	176.4	-157.8	42	-36.2	0	0	0	115.5
814	E	27.1	Very low	28.3	Very low	186 Å²	186	141.3 Å²	141.3	87%	0.869	83%	0.827	S	S	*	*			trans	70.5	137.6	156.4	-75.4	157.7	-119.5	0	0	117.7
815	A	26.9	Very low	28.1	Very low	93 Å²	93	139.7 Å²	139.7	77%	0.769	82%	0.82	S	S	*	*			cis	-150.4	-178.4	-6.5	0	0	0	0	0	108.3
816	S	25.9	Very low	28.1	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	82%	0.815	S	S	*	*			cis	-157.7	177.6	15.2	52.9	0	0	0	0	111.7
817	E	26.3	Very low	27.8	Very low	180 Å²	180	133.6 Å²	133.6	84%	0.841	81%	0.807	S	S	*	*			trans	78.4	137.7	173.6	-53.8	-162	146.8	0	0	117.5
818	S	28.3	Very low	27.8	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	81%	0.809	S	S	*	*			cis	-160.8	147	-24.5	-112.8	0	0	0	0	111.1
819	A	25.8	Very low	27.6	Very low	99 Å²	99	135.3 Å²	135.3	82%	0.818	81%	0.807	S	S	*	*			trans	51	100.4	164.1	0	0	0	0	0	119.5
820	V	25	Very low	28.4	Very low	146 Å²	146	132.8 Å²	132.8	89%	0.885	80%	0.799	S	S	*	*			trans	-107.9	102.5	149.6	176.8	0	0	0	0	109.1
821	L	27.2	Very low	28.4	Very low	171 Å²	171	132.6 Å²	132.6	90%	0.895	80%	0.798	S	S	*	*			trans	-152.7	108.2	163.4	-87.4	-172.5	0	0	0	111.9
822	A	26.1	Very low	28.4	Very low	100 Å²	100	127.9 Å²	127.9	83%	0.826	79%	0.791	S	S	*	*			trans	-169.3	105.6	141.8	0	0	0	0	0	111.4
823	M	27.4	Very low	28.5	Very low	192 Å²	192	134.1 Å²	134.1	95%	0.946	80%	0.799	S	S	*	*			trans	-92.9	112.2	147	-85.8	-162.1	180	0	0	108.2
824	K	27.1	Very low	28.2	Very low	201 Å²	201	134 Å²	134	87%	0.874	81%	0.806	S	S	*	*			trans	-168	126.4	142.9	-114.3	171.6	-178	178.7	0	114.2
825	A	26.3	Very low	28.3	Very low	77 Å²	77	130.1 Å²	130.1	64%	0.636	81%	0.806	S	S	*	*				48.6	130.9	126.9	0	0	0	0	0	122.1
826	T	26.6	Very low	28.4	Very low	125 Å²	125	128.9 Å²	128.9	77%	0.767	80%	0.803	S	S	*	*			trans	67.6	109.2	136.1	52.9	0	0	0	0	121.6
827	S	27.8	Very low	28.7	Very low	109 Å²	109	132 Å²	132	76%	0.762	81%	0.81	S	S	*	*				84	166.3	125	77.1	0	0	0	0	121
828	S	28.6	Very low	28.8	Very low	118 Å²	118	127.7 Å²	127.7	83%	0.825	80%	0.799	S	S	*	*			trans	69.6	107.8	176.8	51.4	0	0	0	0	119.7
829	N	25.8	Very low	28.7	Very low	157 Å²	157	128 Å²	128	84%	0.84	80%	0.802	S	S	*	*			trans	-72.3	178.1	146.1	-136.7	7.6	0	0	0	108.7
830	P	46.2	Very low	28.8	Very low	93 Å²	93	128.4 Å²	128.4	60%	0.604	80%	0.798	S	S	*	*			cis	-141.9	-162.4	6.3	43.5	-23	0	0	0	115.7
831	Q	29.3	Very low	29	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.864	80%	0.797	S	S	*	*			trans	68.9	138.8	166.7	-70.9	170.7	-5.4	0	0	116.6
832	G	28.7	Very low	29	Very low	72 Å²	72	126 Å²	126	74%	0.742	79%	0.79	S	S	*	*			cis	176	174.1	-3.4	0	0	0	0	0	109.1
833	K	29.4	Very low	28.9	Very low	199 Å²	199	124.7 Å²	124.7	87%	0.865	79%	0.786	S	S	*	*			cis	-152.8	173.3	5.7	-63.2	176.2	178.6	173.3	0	110.1
834	A	29.4	Very low	29	Very low	102 Å²	102	122.4 Å²	122.4	84%	0.843	78%	0.783	S	S	*	*			trans	13.3	150.3	146.9	0	0	0	0	0	122.3
835	A	30.6	Very low	28.8	Very low	105 Å²	105	120.9 Å²	120.9	87%	0.868	78%	0.779	S	S	*	*			cis	-143.7	173.4	5.6	0	0	0	0	0	109.1
836	G	29.1	Very low	29.5	Very low	68 Å²	68	121 Å²	121	70%	0.701	77%	0.773	S	S	*	*			cis	149.1	144.2	11.8	0	0	0	0	0	105.8
837	I	30.9	Very low	29.6	Very low	167 Å²	167	123 Å²	123	86%	0.856	77%	0.773	S	S	*	*			cis	-179.7	155.8	44.5	-93.9	156.6	0	0	0	106.2
838	S	28.1	Very low	29.4	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	77%	0.772	S	S	*	*			cis	-169.4	158.1	-34.3	63.6	0	0	0	0	109.2
839	S	27.2	Very low	29.3	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	77%	0.768	S	S	*	*			trans	61.1	147.5	163	49.2	0	0	0	0	119.2
840	S	28.5	Very low	29.2	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	76%	0.761	S	S	*	*			cis	-153.9	134.2	-0.8	35	0	0	0	0	108.2
841	D	27.6	Very low	28.2	Very low	161 Å²	161	131 Å²	131	86%	0.861	76%	0.762	S	S	*	*				66.2	134.7	82.5	-151.9	36.6	0	0	0	113
842	S	27.9	Very low	28.2	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	76%	0.764	S	S	*	*			cis	-152.3	164.6	20.2	58.4	0	0	0	0	112.7
843	G	25.3	Very low	28	Very low	71 Å²	71	138.8 Å²	138.8	73%	0.732	77%	0.769	S	S	*	*			trans	172.5	35.5	178.4	0	0	0	0	0	121.6
844	T	28.4	Very low	28.6	Very low	144 Å²	144	134.7 Å²	134.7	88%	0.883	76%	0.763	S	S	*	*			trans	28.3	116.9	157.3	-7	0	0	0	0	122.5
845	Q	23.4	Very low	28.3	Very low	169 Å²	169	135.8 Å²	135.8	79%	0.79	76%	0.759	S	S	*	*			trans	-72.6	-168.8	150.6	-82.5	-86.3	-28.8	0	0	110.7
846	P	40.4	Very low	28	Very low	80 Å²	80	139 Å²	139	52%	0.519	75%	0.753	S	S	.	*			cis	-135.7	179.7	-0.5	30.6	-6.8	0	0	0	115.7
847	H	28.2	Very low	27.6	Very low	168 Å²	168	143.5 Å²	143.5	78%	0.778	76%	0.756	S	S	*	*				-178.3	158	110	-102.4	-76.3	0	0	0	115.5
848	Y	25.3	Very low	27.3	Very low	185 Å²	185	145 Å²	145	73%	0.725	76%	0.759	S	S	*	*			trans	-86.9	150.3	-165.1	-76.4	-106.5	0	0	0	115.3
849	R	25.8	Very low	27.1	Very low	198 Å²	198	151.5 Å²	151.5	75%	0.747	77%	0.769	S	S	*	*				7.7	142.5	124.5	-56	176.3	172.4	173.5	-3.3	116.3
850	F	24.1	Very low	27	Very low	158 Å²	158	154.8 Å²	154.8	69%	0.693	77%	0.77	S	S	*	*				-166.1	134.5	66.7	-108.1	-90.1	0	0	0	115.1
851	T	25.2	Very low	26.9	Very low	102 Å²	102	157.6 Å²	157.6	63%	0.626	77%	0.771	S	S	*	*			trans	41.8	144.1	140.6	58.2	0	0	0	0	126.3
852	R	28.1	Very low	26.8	Very low	238 Å²	238	157.4 Å²	157.4	90%	0.898	77%	0.77	S	S	*	*			trans	95.3	137	138.2	-82.6	163.5	-163.8	-81.8	1.9	119.9
853	Q	24.2	Very low	26.7	Very low	183 Å²	183	160.5 Å²	160.5	86%	0.855	78%	0.777	S	S	*	*			trans	-83.2	-177.2	173	-50.5	165.8	-38	0	0	110.6
854	P	43.7	Very low	26.7	Very low	114 Å²	114	160.3 Å²	160.3	74%	0.74	78%	0.776	S	S	*	*			cis	-125.5	-172	-25	22.1	0.9	0	0	0	111.5
855	V	22.5	Very low	26.6	Very low	124 Å²	124	160 Å²	160	75%	0.752	77%	0.774	S	S	*	*				162.6	133.3	128.1	156.5	0	0	0	0	114.1
856	K	23	Very low	26.7	Very low	173 Å²	173	161.2 Å²	161.2	75%	0.752	77%	0.771	S	S	*	*			trans	24.3	127.4	153.9	-60.3	172.1	-175.4	174.6	0	122.6
857	H	22.3	Very low	26	Very low	163 Å²	163	165.4 Å²	165.4	76%	0.755	78%	0.781	S	S	*	*			trans	39.5	124.7	138.1	-47.7	-57.4	0	0	0	121.9
858	H	24.1	Very low	25.8	Very low	199 Å²	199	162.4 Å²	162.4	92%	0.921	78%	0.779	S	S	*	*				-164.6	-174.9	101.6	-102.5	-38.2	0	0	0	113.2
859	R	24.7	Very low	26	Very low	225 Å²	225	160.3 Å²	160.3	85%	0.849	78%	0.781	S	S	*	*			trans	-144	108.9	-158.3	176.4	-161.1	-171.4	-179.3	4.6	112.8
860	F	24.6	Very low	26.7	Very low	183 Å²	183	157.1 Å²	157.1	80%	0.803	79%	0.785	S	S	*	*			trans	-141.1	118.4	160.2	-83.3	-88.8	0	0	0	106.4
861	Q	25.8	Very low	27	Very low	165 Å²	165	156.5 Å²	156.5	77%	0.771	79%	0.789	S	S	*	*				90.1	137.8	70.1	-85.1	-168.4	-16.5	0	0	113
862	N	26.6	Very low	27	Very low	157 Å²	157	157.9 Å²	157.9	84%	0.84	80%	0.802	S	S	*	*			trans	-88	157.7	-169.7	-53.8	-21.8	0	0	0	112.5
863	L	26.1	Very low	27	Very low	171 Å²	171	150.1 Å²	150.1	90%	0.895	79%	0.788	S	S	*	*				-154.3	142.4	126.2	-124.3	67.3	0	0	0	106.7
864	G	24.8	Very low	27.2	Very low	68 Å²	68	147.2 Å²	147.2	70%	0.701	78%	0.783	S	S	*	*				86.7	134.9	94.6	0	0	0	0	0	111.5
865	T	26	Very low	26.3	Very low	136 Å²	136	151.5 Å²	151.5	83%	0.834	79%	0.79	S	S	*	*			cis	-157.6	164.6	11.9	-64	0	0	0	0	111.5
866	R	25.4	Very low	26.7	Very low	195 Å²	195	154.2 Å²	154.2	74%	0.736	80%	0.795	S	S	*	*			trans	-52.3	155	179.1	-48.2	157.7	171.7	171	-10.3	116.3
867	F	24.9	Very low	27.7	Very low	168 Å²	168	151.9 Å²	151.9	74%	0.737	80%	0.798	S	S	*	*				144.9	136.2	106.6	-97.3	-52	0	0	0	117.5
868	S	23.6	Very low	28	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	79%	0.792	S	S	*	*			trans	79.7	138.9	141.7	-58.6	0	0	0	0	123.6
869	N	30.2	Very low	28.3	Very low	142 Å²	142	144.7 Å²	144.7	76%	0.759	79%	0.787	S	S	*	*			trans	-79.3	178.1	169.6	-60.6	-0.6	0	0	0	112.2
870	P	41.9	Very low	29.5	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	78%	0.778	S	S	*	*				-142.8	170.4	102.9	39.6	-26.8	0	0	0	116.3
871	D	28.6	Very low	29.8	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	78%	0.782	S	S	*	*			trans	-93.2	152.7	-177.2	-57.1	-86.5	0	0	0	116
872	C	25.9	Very low	30.1	Very low	132 Å²	132	142 Å²	142	89%	0.892	78%	0.784	S	S	*	*			trans	177.8	159.4	145.8	-104.8	0	0	0	0	112.3
873	A	28.5	Very low	30.2	Very low	74 Å²	74	138.4 Å²	138.4	61%	0.612	78%	0.775	S	S	*	*			cis	-177.3	144.5	-41	0	0	0	0	0	111.1
874	T	27.8	Very low	30.3	Very low	122 Å²	122	134.7 Å²	134.7	75%	0.748	76%	0.756	S	S	*	*			trans	57	119.4	151.7	56.3	0	0	0	0	123.7
875	K	26.3	Very low	30.4	Very low	204 Å²	204	141.5 Å²	141.5	89%	0.887	76%	0.762	S	S	*	*				170.4	155.6	106.8	-97.2	153.4	-175.1	172.8	0	115.7
876	Q	29.7	Very low	30.3	Very low	182 Å²	182	146.2 Å²	146.2	85%	0.85	77%	0.765	S	S	*	*			trans	-121.8	175.5	164.3	-64.3	-173.3	-14.1	0	0	109.7
877	P	44.7	Very low	30.5	Very low	124 Å²	124	141.9 Å²	141.9	81%	0.805	77%	0.765	S	S	*	*				-157.8	157.9	93.4	40.1	-20.1	0	0	0	120.2
878	A	28.3	Very low	30.7	Very low	77 Å²	77	138 Å²	138	64%	0.636	76%	0.764	S	S	*	*			trans	61.1	107.8	137.9	0	0	0	0	0	125.8
879	T	30.8	Very low	30.8	Very low	133 Å²	133	139.6 Å²	139.6	82%	0.816	76%	0.764	S	S	*	*				30.8	157.7	105.2	61.1	0	0	0	0	121.2
880	P	48.8	Very low	30.7	Very low	103 Å²	103	139.8 Å²	139.8	67%	0.669	77%	0.765	S	S	*	*			cis	-162.1	162.3	43.1	44	-20.4	0	0	0	124.3
881	K	31.8	Very low	30.1	Very low	203 Å²	203	138 Å²	138	88%	0.883	76%	0.756	S	S	*	*			trans	66.2	150.7	145.9	-71.2	163.9	-175.2	170.8	0	118.9
882	R	30.7	Very low	30.1	Very low	212 Å²	212	142.2 Å²	142.2	80%	0.8	76%	0.761	S	S	*	*			cis	-141.6	-166.2	8.9	-147.9	-170.5	170.8	148	3.9	107.9	N884	R882-N884 PolarHBondContact NE-OD1 3.28Å
883	A	28.7	Very low	30.2	Very low	81 Å²	81	140.6 Å²	140.6	67%	0.669	75%	0.751	S	S	*	*			cis	-165.5	-179.6	3.3	0	0	0	0	0	107.8
884	N	30	Very low	30.2	Very low	92 Å²	92	142.6 Å²	142.6	49%	0.492	76%	0.76	S	S	.	*			cis	-170.6	126.5	-22.6	-120.4	47.8	0	0	0	107.4	R882	R882-N884 PolarHBondContact NE-OD1 3.28Å
885	Y	25.9	Very low	30.3	Very low	211 Å²	211	142 Å²	142	83%	0.827	76%	0.761	S	S	*	*			trans	65.7	147.9	173.2	-60.2	-66.5	0	0	0	117.1
886	R	24.8	Very low	30.8	Very low	235 Å²	235	138.4 Å²	138.4	89%	0.887	76%	0.758	S	S	*	*			cis	-155.4	172.8	4.8	-115.1	176.4	-178.7	-168.6	1.9	106.5
887	S	29.5	Very low	30.8	Very low	105 Å²	105	137 Å²	137	73%	0.734	76%	0.757	S	S	*	*			cis	176.4	148.4	-35.7	-179.8	0	0	0	0	109.6
888	A	27.8	Very low	30.8	Very low	87 Å²	87	137 Å²	137	72%	0.719	76%	0.757	S	S	*	*			trans	68	163.4	174.7	0	0	0	0	0	117.5
889	N	27.1	Very low	30.6	Very low	138 Å²	138	137 Å²	137	74%	0.738	77%	0.765	S	S	*	*				-179.3	151.7	-52	-102.1	11.2	0	0	0	109.3
890	N	27.7	Very low	30.5	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	77%	0.765	S	S	*	*			trans	65.8	168	161.8	-60.5	0.5	0	0	0	117.7
891	S	28.8	Very low	29.4	Very low	93 Å²	93	141 Å²	141	65%	0.65	78%	0.778	S	S	*	*			cis	-176	160	-40.3	-83.7	0	0	0	0	109.9
892	R	28.6	Very low	29.2	Very low	233 Å²	233	141.9 Å²	141.9	88%	0.879	78%	0.776	S	S	*	*			trans	71.2	115.5	155.3	-75.9	174.2	175.9	-169.2	-3.5	120.5
893	S	28.7	Very low	28.9	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	78%	0.776	S	S	*	*				16.1	138.4	124.3	61	0	0	0	0	121.1
894	S	27	Very low	28.7	Very low	116 Å²	116	143.1 Å²	143.1	81%	0.811	78%	0.778	S	S	*	*				179.6	149.8	103.4	-88.3	0	0	0	0	113.3
895	S	30	Very low	28.4	Very low	110 Å²	110	147.6 Å²	147.6	77%	0.769	80%	0.796	S	S	*	*			trans	-76.3	167.7	160.2	-45.3	0	0	0	0	110.6
896	P	38.2	Very low	28.4	Very low	127 Å²	127	143.8 Å²	143.8	83%	0.825	79%	0.79	S	S	*	*				-151.1	150.4	92.5	39	-21.6	0	0	0	117.2
897	D	28.6	Very low	28.5	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	79%	0.788	S	S	*	*			trans	-85.7	172.2	148.7	-105.9	-46.5	0	0	0	109.1
898	P	44.5	Very low	28.2	Very low	124 Å²	124	144 Å²	144	81%	0.805	79%	0.794	S	S	*	*			cis	-137.4	-175	16	42.6	-25	0	0	0	115.6
899	G	25.1	Very low	28.2	Very low	77 Å²	77	143 Å²	143	79%	0.794	79%	0.792	S	S	*	*			trans	179	84.1	164.2	0	0	0	0	0	117.5
900	S	28.8	Very low	28.2	Very low	119 Å²	119	145.2 Å²	145.2	83%	0.832	80%	0.797	S	S	*	*			trans	-86.2	138.2	175.3	-55	0	0	0	0	113.5
901	Q	26.1	Very low	28.1	Very low	201 Å²	201	142.1 Å²	142.1	94%	0.939	79%	0.786	S	S	*	*				-170.9	165.9	128.3	-106.4	169.5	18.8	0	0	114.5
902	R	27.6	Very low	27.8	Very low	220 Å²	220	145.1 Å²	145.1	83%	0.83	80%	0.795	S	S	*	*			trans	-104.5	153.7	-176.4	-54.2	164.7	175.9	151.6	-5.4	110.3
903	F	22.6	Very low	27.8	Very low	181 Å²	181	139.2 Å²	139.2	79%	0.794	78%	0.78	S	S	*	*				-177.4	171.3	105.8	-113.7	-88.7	0	0	0	112.9
904	L	24.7	Very low	27.7	Very low	139 Å²	139	142.3 Å²	142.3	73%	0.728	79%	0.787	S	S	*	*			trans	-83.4	165.9	-179.5	-51.6	87.8	0	0	0	112.5
905	Q	25.5	Very low	27.8	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	78%	0.78	S	S	*	*				-174	168.1	102.7	-156.9	147.4	14.9	0	0	112.9
906	N	25.8	Very low	27.8	Very low	131 Å²	131	145.9 Å²	145.9	70%	0.701	78%	0.778	S	S	*	*			trans	-83.1	163.4	-172.3	-37	-42.4	0	0	0	114
907	L	25.1	Very low	28.4	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	77%	0.767	S	S	*	*				-167.2	168.8	115.4	-130.8	67.1	0	0	0	114.6
908	E	25.2	Very low	28.3	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	77%	0.769	S	S	*	*			trans	-98.9	170	-170.1	-61.7	143.6	93.4	0	0	115.4
909	G	26.3	Very low	27.5	Very low	65 Å²	65	150.3 Å²	150.3	67%	0.67	77%	0.77	S	S	*	*			trans	153.8	110.9	157.5	0	0	0	0	0	112.9
910	H	27	Very low	27.6	Very low	185 Å²	185	152.4 Å²	152.4	86%	0.856	77%	0.767	S	S	*	*				65.6	143.3	74.6	-88.6	58	0	0	0	115.2
911	C	25.7	Very low	27.4	Very low	80 Å²	80	152 Å²	152	54%	0.541	76%	0.76	S	S	.	*			cis	-172.3	174.7	-21.6	-146.2	0	0	0	0	109.3	I913	C911-I913 HydrophobicContact CB-CD1 4.23Å
912	D	22.8	Very low	27.4	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	75%	0.754	S	S	*	*			trans	168.2	125.9	150.4	-90.3	-20	0	0	0	109.1
913	I	29	Very low	27.3	Very low	109 Å²	109	144.5 Å²	144.5	56%	0.559	75%	0.753	S	S	*	*			cis	98.3	98.9	11.4	-52	176.2	0	0	0	117	C911 Q915	C911-I913 HydrophobicContact CB-CD1 4.23Å; I913-Q915 HydrophobicContact CG2-CG 4.15Å
914	I	25.6	Very low	27.7	Very low	163 Å²	163	139.4 Å²	139.4	84%	0.836	74%	0.744	S	S	*	*			trans	-147.6	111.9	142.5	-55.8	-174.1	0	0	0	105.3
915	Q	28.8	Very low	27.8	Very low	143 Å²	143	142 Å²	142	67%	0.668	75%	0.753	S	S	*	*				75.4	134.2	64.1	-71.4	-155.8	41.4	0	0	114.9	I913	I913-Q915 HydrophobicContact CG2-CG 4.15Å
916	Q	30.2	Very low	28	Very low	157 Å²	157	136.5 Å²	136.5	73%	0.734	75%	0.745	S	S	*	*			cis	-157.6	-154	-8.9	-140.5	-164.7	95.7	0	0	112.2
917	P	50.9	Low	28.1	Very low	90 Å²	90	137.2 Å²	137.2	58%	0.584	76%	0.755	S	S	*	*			trans	-130.2	-170	-132	46.6	-27.8	0	0	0	117.5
918	H	26.1	Very low	28.2	Very low	187 Å²	187	136 Å²	136	87%	0.866	75%	0.753	S	S	*	*			trans	-163.4	93.9	142.8	-108.7	-70.1	0	0	0	117.7
919	R	27.9	Very low	28.6	Very low	221 Å²	221	134.9 Å²	134.9	83%	0.834	75%	0.754	S	S	*	*			trans	25.4	130.4	137.5	-102.9	-167.5	169.4	-170.1	-2.7	126.5
920	V	27.1	Very low	29.2	Very low	121 Å²	121	137.7 Å²	137.7	73%	0.733	76%	0.757	S	S	*	*			trans	59.5	154.1	146.2	-93.6	0	0	0	0	121
921	T	25.6	Very low	29.6	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	75%	0.754	S	S	*	*			cis	-156.6	145.1	18.4	-18	0	0	0	0	114.2
922	T	26	Very low	30.5	Very low	132 Å²	132	137.1 Å²	137.1	81%	0.81	76%	0.761	S	S	*	*			trans	52.7	151.4	151.1	44.8	0	0	0	0	121.4
923	T	25.3	Very low	31.5	Very low	132 Å²	132	132 Å²	132	81%	0.81	74%	0.738	S	S	*	*			cis	-133.8	175	20.8	52.9	0	0	0	0	114.2
924	A	30.3	Very low	31.9	Very low	74 Å²	74	132.4 Å²	132.4	61%	0.612	75%	0.748	S	S	*	*			trans	-76.4	-178.6	164.1	0	0	0	0	0	111.4
925	E	27	Very low	32.4	Very low	193 Å²	193	134.1 Å²	134.1	90%	0.902	74%	0.744	S	S	*	*			cis	-164	162.8	14.5	-148.3	146.1	-92.6	0	0	108.9
926	G	29.8	Very low	33	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	73%	0.732	S	S	*	*			cis	160.9	19.3	-6.6	0	0	0	0	0	117.3
927	T	27.6	Very low	33.7	Very low	147 Å²	147	128.1 Å²	128.1	90%	0.902	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-95.2	151.8	-164.8	21.3	0	0	0	0	118.3
928	V	29	Very low	33.1	Very low	133 Å²	133	126.1 Å²	126.1	81%	0.806	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-77	145.9	-173.8	173.4	0	0	0	0	114
929	N	32.8	Very low	33.9	Very low	163 Å²	163	122.6 Å²	122.6	87%	0.872	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-73.6	139.6	170.5	-76.6	-42.7	0	0	0	112.9
930	V	38.1	Very low	34.5	Very low	124 Å²	124	121.8 Å²	121.8	75%	0.752	70%	0.695	S	S	*	*			trans	-117.9	143.9	173	178.9	0	0	0	0	108.9
931	P	37.1	Very low	34.9	Very low	122 Å²	122	122.9 Å²	122.9	79%	0.792	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-65.7	138.8	177.3	-19.1	32.4	0	0	0	112.3
932	L	44.3	Very low	35.8	Very low	131 Å²	131	124 Å²	124	69%	0.686	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-64.8	151.3	175	-67.9	171	0	0	0	111.9
933	S	43.9	Very low	36.5	Very low	50 Å²	50	121 Å²	121	35%	0.35	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-78.8	157.9	-179.2	78.6	0	0	0	0	112.3	R935 E936	S933-R935 PolarHBondContact O-N 2.95Å; S933-R935 PolarHBondContact OG-N 2.88Å; S933-E936 WeakPolarHBondContact CA-OE2 3.25Å; S933-E936 WeakPolarHBondContact CB-OE2 3.47Å; S933-E936 PolarHBondContact N-OE2 2.86Å; S933-E936 PolarHBondContact O-N 2.74Å; S933-E936 VanDerWaalsContact O-N 3.16Å; S933-E936 PolarHBondContact OG-OE2 2.98Å
934	P	36.6	Very low	37.3	Very low	118 Å²	118	119.8 Å²	119.8	77%	0.766	68%	0.682	S	S	*	*	H	α-helix	trans	-58.7	-16.5	177	-25.8	35.4	0	0	0	114.9
935	R	37.1	Very low	37.4	Very low	198 Å²	198	123 Å²	123	75%	0.747	69%	0.689	S	S	*	*	H	α-helix	trans	-81.4	-33.7	-179.5	-158.4	175.3	-169.3	180	2	112.5	S933 A938 Q939	S933-R935 PolarHBondContact O-N 2.95Å; S933-R935 PolarHBondContact OG-N 2.88Å; R935-A938 PolarHBondContact O-N 3.11Å; R935-Q939 PolarHBondContact O-N 3.41Å
936	E	41	Very low	37.6	Very low	91 Å²	91	119.2 Å²	119.2	43%	0.425	68%	0.684	S	S	.	*	H	α-helix	trans	-74.5	-38.8	179.1	-68.9	149	126.5	0	0	110.9	S933 A938 Q939 Y940	S933-E936 WeakPolarHBondContact CA-OE2 3.25Å; S933-E936 WeakPolarHBondContact CB-OE2 3.47Å; S933-E936 PolarHBondContact N-OE2 2.86Å; S933-E936 PolarHBondContact O-N 2.74Å; S933-E936 VanDerWaalsContact O-N 3.16Å; S933-E936 PolarHBondContact OG-OE2 2.98Å; E936-A938 VanDerWaalsContact C-N 3.26Å; E936-A938 PolarHBondContact O-N 3.4Å; E936-Q939 PolarHBondContact O-N 3.25Å; E936-Q939 VanDerWaalsContact O-N 3.16Å; E936-Y940 PolarHBondContact O-N 3.46Å; E936-Y940 VanDerWaalsContact O-N 3.15Å
937	V	44.5	Very low	37.5	Very low	83 Å²	83	122.5 Å²	122.5	50%	0.503	69%	0.69	S	S	.	*	H	α-helix	trans	-59.3	-38.2	172.1	-178	0	0	0	0	111.5	M941	V937-M941 WeakPolarHBondContact O-CG 3.37Å; V937-M941 PolarHBondContact O-N 3.04Å; V937-M941 VanDerWaalsContact O-N 3.12Å
938	A	38.9	Very low	37.7	Very low	48 Å²	48	120.2 Å²	120.2	40%	0.397	69%	0.686	S	S	.	*	H	α-helix	trans	-68.7	-30.5	177.7	0	0	0	0	0	113.3	R935 E936 L942	R935-A938 PolarHBondContact O-N 3.11Å; E936-A938 VanDerWaalsContact C-N 3.26Å; E936-A938 PolarHBondContact O-N 3.4Å; A938-L942 WeakPolarHBondContact O-CD1 3.49Å; A938-L942 VanDerWaalsContact O-CG 3.31Å; A938-L942 WeakPolarHBondContact O-CG 3.48Å
939	Q	41.8	Very low	37.7	Very low	114 Å²	114	120.7 Å²	120.7	53%	0.533	69%	0.689	S	S	.	*	H	α-helix	trans	-74.2	-41.7	176.2	-69.9	178.6	-103.3	0	0	111.5	R935 E936 M941 L942 G943	R935-Q939 PolarHBondContact O-N 3.41Å; E936-Q939 PolarHBondContact O-N 3.25Å; E936-Q939 VanDerWaalsContact O-N 3.16Å; Q939-M941 VanDerWaalsContact C-N 3.32Å; Q939-M941 PolarHBondContact O-N 3.49Å; Q939-L942 PolarHBondContact O-N 2.81Å; Q939-L942 VanDerWaalsContact O-N 3.16Å; Q939-G943 PolarHBondContact O-N 2.91Å
940	Y	39.9	Very low	37.5	Very low	203 Å²	203	118 Å²	118	80%	0.796	68%	0.683	S	S	*	*	H	α-helix	trans	-61.2	-39.7	175.4	-167.5	-100.9	0	0	0	112.3	E936 L942	E936-Y940 PolarHBondContact O-N 3.46Å; E936-Y940 VanDerWaalsContact O-N 3.15Å; Y940-L942 PolarHBondContact O-N 3.1Å
941	M	37.2	Very low	37.7	Very low	145 Å²	145	118.3 Å²	118.3	71%	0.714	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	176.6	-80	-60.3	-48.4	0	0	115.3	V937 Q939	V937-M941 WeakPolarHBondContact O-CG 3.37Å; V937-M941 PolarHBondContact O-N 3.04Å; V937-M941 VanDerWaalsContact O-N 3.12Å; Q939-M941 VanDerWaalsContact C-N 3.32Å; Q939-M941 PolarHBondContact O-N 3.49Å
942	L	44.8	Very low	37.2	Very low	134 Å²	134	116 Å²	116	70%	0.702	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	1.6	-176.6	-68.8	174.3	0	0	0	113.8	A938 Q939 Y940 V944	A938-L942 WeakPolarHBondContact O-CD1 3.49Å; A938-L942 VanDerWaalsContact O-CG 3.31Å; A938-L942 WeakPolarHBondContact O-CG 3.48Å; Q939-L942 PolarHBondContact O-N 2.81Å; Q939-L942 VanDerWaalsContact O-N 3.16Å; Y940-L942 PolarHBondContact O-N 3.1Å; L942-V944 VanDerWaalsContact C-N 3.28Å; L942-V944 HydrophobicContact CB-CG2 4.28Å; L942-V944 WeakPolarHBondContact O-CG2 3.23Å; L942-V944 PolarHBondContact O-N 3.32Å
943	G	39	Very low	36.5	Very low	68 Å²	68	114.8 Å²	114.8	70%	0.701	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.8	19	171.8	0	0	0	0	0	115.6	Q939 D945	Q939-G943 PolarHBondContact O-N 2.91Å; G943-D945 PolarHBondContact O-N 3.07Å
944	V	42.3	Very low	35.7	Very low	107 Å²	107	116.6 Å²	116.6	65%	0.648	71%	0.713	S	S	*	*			trans	-93.5	70.6	-175.8	-166.2	0	0	0	0	111.3	L942	L942-V944 VanDerWaalsContact C-N 3.28Å; L942-V944 HydrophobicContact CB-CG2 4.28Å; L942-V944 WeakPolarHBondContact O-CG2 3.23Å; L942-V944 PolarHBondContact O-N 3.32Å
945	D	31.8	Very low	35.3	Very low	141 Å²	141	118.1 Å²	118.1	75%	0.754	71%	0.714	S	S	*	*			trans	-91.1	120	167.3	-90	-39	0	0	0	110.8	G943	G943-D945 PolarHBondContact O-N 3.07Å
946	S	31.8	Very low	35	Very low	115 Å²	115	113.7 Å²	113.7	80%	0.804	71%	0.713	S	S	*	*			trans	-156.7	68.7	172.7	-79.1	0	0	0	0	110.7	A948	S946-A948 PolarHBondContact O-N 3.11Å
947	T	29	Very low	34.4	Very low	138 Å²	138	114.5 Å²	114.5	85%	0.847	73%	0.729	S	S	*	*			trans	-76.2	101.1	174.4	49	0	0	0	0	111.1
948	A	31.3	Very low	33.6	Very low	98 Å²	98	115 Å²	115	81%	0.81	74%	0.737	S	S	*	*			trans	-106.2	89.6	-179.5	0	0	0	0	0	112.9	S946	S946-A948 PolarHBondContact O-N 3.11Å
949	T	27.6	Very low	33.1	Very low	143 Å²	143	118.3 Å²	118.3	88%	0.877	75%	0.752	S	S	*	*			trans	-145	127.1	162.7	-37.8	0	0	0	0	111
950	S	29.5	Very low	32.4	Very low	107 Å²	107	118.3 Å²	118.3	75%	0.748	76%	0.76	S	S	*	*			trans	-101.5	171.2	170.5	62.3	0	0	0	0	111.4
951	P	41.5	Very low	31.7	Very low	130 Å²	130	115.6 Å²	115.6	84%	0.844	75%	0.754	S	S	*	*			trans	-137.6	130.9	150.7	35	-20.7	0	0	0	115.1
952	G	27.7	Very low	31.2	Very low	73 Å²	73	118.5 Å²	118.5	75%	0.753	76%	0.757	S	S	*	*			trans	109.1	109.3	130.6	0	0	0	0	0	120.3
953	A	28.9	Very low	30.3	Very low	107 Å²	107	116.8 Å²	116.8	88%	0.884	76%	0.756	S	S	*	*			trans	64.2	149.3	147.2	0	0	0	0	0	119.2
954	A	27.9	Very low	29.8	Very low	87 Å²	87	118.7 Å²	118.7	72%	0.719	76%	0.755	S	S	*	*			cis	-159.9	-169.7	-19.3	0	0	0	0	0	106.5
955	L	27.8	Very low	29.2	Very low	150 Å²	150	120.9 Å²	120.9	79%	0.785	76%	0.758	S	S	*	*			cis	-172.5	144.2	19.4	-148.2	159.7	0	0	0	108.5
956	S	30.3	Very low	29.1	Very low	105 Å²	105	121 Å²	121	73%	0.734	75%	0.754	S	S	*	*			trans	60	165.6	166	44	0	0	0	0	117.1
957	S	28.7	Very low	29	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	75%	0.748	S	S	*	*			cis	-173.5	159.7	-9.4	39.6	0	0	0	0	107.8
958	S	27.6	Very low	29.1	Very low	95 Å²	95	119.7 Å²	119.7	66%	0.664	74%	0.741	S	S	*	*			cis	-175	-172.3	-13.2	54.9	0	0	0	0	110.2
959	T	28	Very low	29.3	Very low	117 Å²	117	124.1 Å²	124.1	72%	0.718	74%	0.737	S	S	*	*			trans	67	104.8	149.2	37.5	0	0	0	0	122.7
960	T	27.4	Very low	29.3	Very low	113 Å²	113	127.1 Å²	127.1	69%	0.693	73%	0.732	S	S	*	*				80.9	127.3	125.1	-12.4	0	0	0	0	124.9
961	E	26.5	Very low	29.5	Very low	146 Å²	146	126.8 Å²	126.8	68%	0.682	73%	0.73	S	S	*	*			trans	75	135.3	138.8	-99.3	175.9	-117.4	0	0	125.8
962	R	25	Very low	29	Very low	207 Å²	207	131.5 Å²	131.5	78%	0.781	73%	0.731	S	S	*	*			trans	63	123.6	156.3	-69.1	174.7	-174.9	-179.3	1.7	117.7
963	S	26.7	Very low	29.2	Very low	97 Å²	97	131.7 Å²	131.7	68%	0.678	73%	0.725	S	S	*	*				64.9	142.4	74.7	92.9	0	0	0	0	113.4
964	T	28.5	Very low	29.2	Very low	109 Å²	109	133 Å²	133	67%	0.669	72%	0.717	S	S	*	*			cis	-165.2	174	33.6	-25.8	0	0	0	0	112.1
965	Q	29.6	Very low	29.3	Very low	152 Å²	152	136.5 Å²	136.5	71%	0.71	72%	0.719	S	S	*	*			trans	75.4	146.4	158.5	-68.1	166.3	-82.8	0	0	117.8
966	E	29	Very low	29.3	Very low	145 Å²	145	136.5 Å²	136.5	68%	0.678	72%	0.719	S	S	*	*			cis	-152.4	158.4	-0.2	-132.8	161.8	-147.6	0	0	116.4
967	T	30.2	Very low	29.2	Very low	110 Å²	110	136.8 Å²	136.8	68%	0.675	72%	0.716	S	S	*	*			trans	15.7	148.3	152.4	47.5	0	0	0	0	123.1
968	T	32.4	Very low	29.1	Very low	115 Å²	115	138.6 Å²	138.6	71%	0.706	72%	0.718	S	S	*	*			cis	-176.5	-173.6	-16.7	25.8	0	0	0	0	106.4
969	R	33.7	Very low	29.1	Very low	190 Å²	190	140.1 Å²	140.1	72%	0.717	72%	0.718	S	S	*	*			cis	-164.3	-175.4	2.3	-122.8	165.2	-162.2	-179.4	9.5	106.5
970	W	28	Very low	29.1	Very low	207 Å²	207	141.2 Å²	141.2	78%	0.784	72%	0.719	S	S	*	*			cis	-154.1	140.3	0.2	-136.2	-19	0	0	0	109.3
971	S	33.3	Very low	29	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	72%	0.718	S	S	*	*			trans	66.6	147.9	148.7	-63.1	0	0	0	0	121.2
972	R	31.8	Very low	29	Very low	229 Å²	229	138 Å²	138	86%	0.864	72%	0.723	S	S	*	*			cis	-175.7	146.6	-13.1	174.6	179.2	-175	171.7	3.2	110.7
973	A	31	Very low	29.1	Very low	78 Å²	78	131.8 Å²	131.8	65%	0.645	72%	0.723	S	S	*	*			trans	66.2	156.1	159.8	0	0	0	0	0	118.9
974	D	30.1	Very low	29.2	Very low	133 Å²	133	135.5 Å²	135.5	71%	0.711	73%	0.73	S	S	*	*			cis	-164.1	164.1	-29.1	-118.3	-59.5	0	0	0	112.2
975	H	30.3	Very low	29.2	Very low	162 Å²	162	136.5 Å²	136.5	75%	0.75	73%	0.732	S	S	*	*			trans	58.8	100.4	151.6	-74.5	38.9	0	0	0	123.1
976	N	27.9	Very low	29.2	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	73%	0.734	S	S	*	*				67.2	152.5	107.5	-149.5	9.1	0	0	0	124
977	V	28	Very low	29.2	Very low	111 Å²	111	137.2 Å²	137.2	67%	0.673	73%	0.728	S	S	*	*			trans	78.3	95.9	161.3	-162.8	0	0	0	0	121.6
978	N	26.6	Very low	29.1	Very low	147 Å²	147	140.5 Å²	140.5	79%	0.786	74%	0.736	S	S	*	*				44	161.7	107.4	-144.3	2.5	0	0	0	124
979	L	27.9	Very low	28.9	Very low	126 Å²	126	142.9 Å²	142.9	66%	0.66	74%	0.739	S	S	*	*			trans	90.9	128.2	164.2	-99.7	76	0	0	0	121.9
980	N	26.5	Very low	29.4	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	74%	0.743	S	S	*	*				35.8	156	124.7	-68.2	5.5	0	0	0	121.9
981	S	25.7	Very low	29.2	Very low	95 Å²	95	135.5 Å²	135.5	66%	0.664	74%	0.744	S	S	*	*			cis	161.3	141.4	-19.9	62.5	0	0	0	0	107.3
982	A	26.8	Very low	29.8	Very low	95 Å²	95	135.6 Å²	135.6	79%	0.785	74%	0.742	S	S	*	*			trans	54	87.5	147.7	0	0	0	0	0	122.1
983	G	26.9	Very low	29.5	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	74%	0.74	S	S	*	*				79.7	-156.8	113.9	0	0	0	0	0	120.8
984	Q	29.1	Very low	29.3	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	75%	0.751	S	S	*	*			trans	77.5	113.5	-173.4	-56.2	-147.5	31.8	0	0	114.5
985	N	28.1	Very low	29	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	75%	0.751	S	S	*	*				80.6	144.9	79.9	-76.7	-37.3	0	0	0	112.6
986	R	30.9	Very low	28.8	Very low	201 Å²	201	134.3 Å²	134.3	76%	0.758	75%	0.752	S	S	*	*			cis	-170.7	166	15.3	-128	168.8	168.9	-162	-1.1	111
987	I	28.9	Very low	28.7	Very low	110 Å²	110	131.6 Å²	131.6	56%	0.564	75%	0.75	S	S	*	*			trans	72.3	149.5	145	-77.5	166	0	0	0	116.3
988	H	26.9	Very low	28.7	Very low	179 Å²	179	133.7 Å²	133.7	83%	0.829	75%	0.752	S	S	*	*			cis	-125.6	170.3	22.9	-106.8	-66.4	0	0	0	116.2
989	H	28	Very low	28.8	Very low	166 Å²	166	133.4 Å²	133.4	77%	0.769	75%	0.746	S	S	*	*			trans	-83	-178.6	176.9	-68.3	-71.1	0	0	0	113.3
990	P	44.1	Very low	28.8	Very low	125 Å²	125	133.2 Å²	133.2	81%	0.812	75%	0.746	S	S	*	*			cis	-138.4	-176.5	11	41	-20	0	0	0	118.5
991	C	25.4	Very low	28.8	Very low	117 Å²	117	133.9 Å²	133.9	79%	0.791	75%	0.748	S	S	*	*			trans	-93.5	-176	170.5	-139.6	0	0	0	0	109.7
992	P	44.6	Very low	28.9	Very low	100 Å²	100	135.7 Å²	135.7	65%	0.649	76%	0.756	S	S	*	*			cis	-148.2	-169.1	7.7	45	-24.1	0	0	0	118.8
993	R	27	Very low	28.9	Very low	223 Å²	223	136.3 Å²	136.3	84%	0.842	75%	0.754	S	S	*	*			trans	94.3	148	145.1	-82.7	177.3	-178.2	-178.9	0.7	123
994	T	25.5	Very low	29.6	Very low	142 Å²	142	138.8 Å²	138.8	87%	0.871	76%	0.756	S	S	*	*			trans	81.8	152.8	150.6	29.9	0	0	0	0	122.1
995	S	24.6	Very low	29.5	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	75%	0.752	S	S	*	*			trans	-126	-178.1	-176	56.3	0	0	0	0	110.7
996	S	25.1	Very low	29.5	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	76%	0.763	S	S	*	*			trans	68.7	135	-174.2	8.8	0	0	0	0	112.9
997	A	26.2	Very low	29.4	Very low	92 Å²	92	137.6 Å²	137.6	76%	0.76	77%	0.767	S	S	*	*				68.6	140.3	55	0	0	0	0	0	111.8
998	E	27.7	Very low	29.4	Very low	155 Å²	155	140.5 Å²	140.5	72%	0.724	78%	0.782	S	S	*	*			cis	-139.7	168.3	16.7	-58.2	168.1	78.7	0	0	111.3
999	H	28.8	Very low	29.3	Very low	141 Å²	141	139.4 Å²	139.4	65%	0.653	78%	0.782	S	S	*	*				143.4	159.8	98.9	-91.7	-28.3	0	0	0	107.7
1000	N	28.1	Very low	29.3	Very low	122 Å²	122	136.7 Å²	136.7	65%	0.652	78%	0.782	S	S	*	*			cis	-160.4	-178.5	-5.5	-115.3	-24.2	0	0	0	110.8
1001	L	27	Very low	28.4	Very low	155 Å²	155	135.6 Å²	135.6	81%	0.812	78%	0.777	S	S	*	*			trans	79.6	132	172.2	-49.7	171.7	0	0	0	115.3
1002	T	27.3	Very low	28.4	Very low	134 Å²	134	137.6 Å²	137.6	82%	0.822	78%	0.779	S	S	*	*			cis	-154.8	160.1	-6.6	-4.6	0	0	0	0	111.4
1003	S	27.2	Very low	27.8	Very low	108 Å²	108	142 Å²	142	76%	0.755	79%	0.787	S	S	*	*			trans	-73.9	159.8	166.9	-133.4	0	0	0	0	111.1
1004	P	40.8	Very low	27.8	Very low	128 Å²	128	139.3 Å²	139.3	83%	0.831	79%	0.789	S	S	*	*				-139.6	178.9	57.4	39.1	-20.6	0	0	0	116
1005	A	26.7	Very low	27.8	Very low	89 Å²	89	143.3 Å²	143.3	74%	0.736	79%	0.788	S	S	*	*			trans	-104.9	165.5	179.4	0	0	0	0	0	113.3
1006	Q	29	Very low	27.9	Very low	199 Å²	199	148.8 Å²	148.8	93%	0.93	79%	0.794	S	S	*	*			trans	-159.2	164.9	139.1	-112.8	169.7	30	0	0	113.3
1007	K	28	Very low	28.1	Very low	194 Å²	194	148 Å²	148	84%	0.843	79%	0.788	S	S	*	*			trans	-102.9	160.3	-179	-55.4	168.3	-179.4	173.1	0	109.8
1008	I	28.5	Very low	28.2	Very low	171 Å²	171	152.2 Å²	152.2	88%	0.877	79%	0.792	S	S	*	*				-171.8	162.5	126.9	-99.4	155.7	0	0	0	112.1
1009	L	26.6	Very low	28.2	Very low	157 Å²	157	149.1 Å²	149.1	82%	0.822	79%	0.787	S	S	*	*			trans	-92.4	146.1	-162.5	-56.9	133.6	0	0	0	114.5
1010	S	26.4	Very low	28.2	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	79%	0.786	S	S	*	*				166.7	136.2	128.4	40.8	0	0	0	0	109.1
1011	S	25.3	Very low	28.2	Very low	102 Å²	102	149.9 Å²	149.9	71%	0.713	79%	0.785	S	S	*	*			cis	85.8	131.7	24.6	87.6	0	0	0	0	115.8
1012	L	27.1	Very low	28.4	Very low	159 Å²	159	151.6 Å²	151.6	83%	0.832	79%	0.789	S	S	*	*			trans	73.9	131.3	-173.4	-51.7	170.9	0	0	0	114.1
1013	K	31.4	Very low	28.8	Very low	191 Å²	191	152.2 Å²	152.2	83%	0.83	78%	0.782	S	S	*	*			cis	67	112	45.9	-78.4	-171.9	172.9	175.8	0	114.7
1014	L	26	Very low	29.2	Very low	168 Å²	168	154.3 Å²	154.3	88%	0.88	78%	0.78	S	S	*	*			trans	171.5	133.2	149.9	-87.8	149.7	0	0	0	103.5
1015	R	26.1	Very low	29	Very low	226 Å²	226	154.8 Å²	154.8	85%	0.853	78%	0.775	S	S	*	*			cis	53.3	123.3	22.6	-138.3	-174.9	-166.3	-167	5.8	115.5
1016	R	25.7	Very low	29.4	Very low	214 Å²	214	159.4 Å²	159.4	81%	0.808	78%	0.779	S	S	*	*			trans	80.7	95.9	169.7	-74.3	-173.3	167.4	169.8	-4.6	119.1
1017	S	30.8	Very low	29.9	Very low	94 Å²	94	159.8 Å²	159.8	66%	0.657	80%	0.795	S	S	*	*				39.4	120.7	108.1	64.9	0	0	0	0	120.5
1018	H	27.6	Very low	30	Very low	180 Å²	180	158.1 Å²	158.1	83%	0.833	79%	0.792	S	S	*	*			trans	-143.9	152.9	131.8	-94.4	-81	0	0	0	106.9
1019	S	28.1	Very low	30.1	Very low	90 Å²	90	157.4 Å²	157.4	63%	0.629	79%	0.788	S	S	*	*				66.9	138.8	61.1	-115.6	0	0	0	0	111.5
1020	E	28.9	Very low	30.3	Very low	135 Å²	135	157.4 Å²	157.4	63%	0.631	79%	0.786	S	S	*	*			cis	-166.7	174.3	13.6	-144.4	-179.3	178.2	0	0	111.5
1021	K	28.8	Very low	30.5	Very low	145 Å²	145	160.3 Å²	160.3	63%	0.63	79%	0.787	S	S	*	*			trans	45.9	131.8	152.2	-73.6	152.3	-173.9	154.7	0	122.3
1022	E	30.8	Very low	30.8	Very low	190 Å²	190	163.9 Å²	163.9	89%	0.888	79%	0.792	S	S	*	*				-128.5	135.4	101.9	-74.6	179.1	151.1	0	0	105.6
1023	E	35.5	Very low	31.1	Very low	147 Å²	147	164.3 Å²	164.3	69%	0.687	79%	0.789	S	S	*	*				68.9	133.2	59.5	-75	-150.5	-166	0	0	113
1024	Q	36.1	Very low	31	Very low	152 Å²	152	162.4 Å²	162.4	71%	0.71	79%	0.786	S	S	*	*			cis	-132.7	-173.5	7.3	-62.3	-170.3	-17.6	0	0	110.4
1025	L	36.6	Very low	31.4	Very low	138 Å²	138	161.9 Å²	161.9	72%	0.723	78%	0.779	S	S	*	*			cis	-146.7	-127.4	7.2	-145.9	169.9	0	0	0	110.3
1026	F	34	Very low	31.9	Very low	186 Å²	186	156.6 Å²	156.6	82%	0.816	77%	0.773	S	S	*	*			trans	-135.2	161.8	-173	-85.7	-116.4	0	0	0	108.9
1027	V	39.8	Very low	32.4	Very low	208 Å²	208	151.4 Å²	151.4	100%	1.261	77%	0.77	S	S	*	*			cis	-137.8	0	50	173.6	0	0	0	0	112.3

Retrieved 1,027 of 1,027 residues in 253.3 ms (Link to these results)

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