A0A3Q0KU15_SCHMA Loading...

GATA zinc finger domain-containing protein 14-like

AlphaFold DB , UniProt , Accession A0A3Q0KU15, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 382 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	37	Very low	243 Å²	243	154.5 Å²	154.5	100%	1.197	80%	0.797	S	S	*	*				0	91.6	0	-64.9	167.4	85.6	0	0	106.6
2	V	34.9	Very low	36.7	Very low	140 Å²	140	152 Å²	152	85%	0.848	79%	0.794	S	S	*	*			trans	-107.8	108.8	179.9	-179.4	0	0	0	0	106.3	N4	V2-N4 PolarHBondContact O-N 3.2Å
3	S	38.1	Very low	36.5	Very low	84 Å²	84	146.2 Å²	146.2	59%	0.587	78%	0.782	S	S	*	*			trans	-67.8	123.5	177.6	36.5	0	0	0	0	109.3	Y5	S3-Y5 PolarHBondContact O-N 3.27Å
4	N	39.2	Very low	36.3	Very low	166 Å²	166	144.7 Å²	144.7	89%	0.888	78%	0.784	S	S	*	*			trans	-68	79.1	169	-79.9	-46	0	0	0	108.9	V2	V2-N4 PolarHBondContact O-N 3.2Å
5	Y	32.8	Very low	36.2	Very low	184 Å²	184	143.5 Å²	143.5	72%	0.722	78%	0.784	S	S	*	*			trans	-83.8	139.5	163.3	-88.4	-88.6	0	0	0	109.3	S3	S3-Y5 PolarHBondContact O-N 3.27Å
6	D	37.4	Very low	36.3	Very low	108 Å²	108	144.9 Å²	144.9	58%	0.578	79%	0.789	S	S	*	*			trans	72.1	63	151.9	-52.4	-17.5	0	0	0	117.7	F8	D6-F8 VanDerWaalsContact C-N 3.29Å; D6-F8 HydrophobicContact CB-CD2 3.86Å; D6-F8 HydrophobicContact CB-CE2 3.97Å; D6-F8 VanDerWaalsContact OD1-CE2 3.25Å; D6-F8 WeakPolarHBondContact OD1-CE2 3.3Å
7	R	35.8	Very low	36.1	Very low	240 Å²	240	145.1 Å²	145.1	91%	0.906	79%	0.789	S	S	*	*			trans	-95.1	69.6	141.1	-65	-169.1	-152	-173.5	6.7	108.7	S9	R7-S9 VanDerWaalsContact C-N 3.26Å; R7-S9 PolarHBondContact O-N 3.28Å
8	F	39.3	Very low	36	Very low	160 Å²	160	147.6 Å²	147.6	70%	0.702	79%	0.791	S	S	*	*			trans	-56.6	103.2	153.8	-70.2	-76.8	0	0	0	105.8	D6 N10	D6-F8 VanDerWaalsContact C-N 3.29Å; D6-F8 HydrophobicContact CB-CD2 3.86Å; D6-F8 HydrophobicContact CB-CE2 3.97Å; D6-F8 VanDerWaalsContact OD1-CE2 3.25Å; D6-F8 WeakPolarHBondContact OD1-CE2 3.3Å; F8-N10 PolarHBondContact O-N 3.11Å
9	S	39.2	Very low	36.1	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	79%	0.785	S	S	*	*			trans	-59.6	116.3	170.3	-76.9	0	0	0	0	106	R7 C11	R7-S9 VanDerWaalsContact C-N 3.26Å; R7-S9 PolarHBondContact O-N 3.28Å; S9-C11 PolarHBondContact O-N 3.31Å
10	N	37.2	Very low	36	Very low	154 Å²	154	145 Å²	145	82%	0.824	79%	0.785	S	S	*	*			trans	-60.2	82.5	171.4	-75.1	-19.6	0	0	0	108.4	F8 T12	F8-N10 PolarHBondContact O-N 3.11Å; N10-T12 PolarHBondContact O-N 3.49Å
11	C	35.7	Very low	36	Very low	120 Å²	120	148.4 Å²	148.4	81%	0.811	79%	0.788	S	S	*	*			trans	-75.2	84	166.4	-67.9	0	0	0	0	106.3	S9 A13	S9-C11 PolarHBondContact O-N 3.31Å; C11-A13 VanDerWaalsContact C-N 3.33Å; C11-A13 PolarHBondContact O-N 3.4Å
12	T	33	Very low	35.9	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	76%	0.759	S	S	*	*			trans	-61.3	99.5	167.3	-50.6	0	0	0	0	106.9	N10	N10-T12 PolarHBondContact O-N 3.49Å
13	A	33.7	Very low	36	Very low	77 Å²	77	139.9 Å²	139.9	64%	0.636	76%	0.755	S	S	*	*			trans	-57.8	134.7	171.8	0	0	0	0	0	108.2	C11 T15	C11-A13 VanDerWaalsContact C-N 3.33Å; C11-A13 PolarHBondContact O-N 3.4Å; A13-T15 PolarHBondContact O-N 3.34Å
14	P	33.4	Very low	35.9	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	76%	0.76	S	S	*	*			trans	-58.4	114.9	-179	21.4	-30.3	0	0	0	109	L16	P14-L16 PolarHBondContact O-N 3.4Å
15	T	35.4	Very low	35.8	Very low	127 Å²	127	141.1 Å²	141.1	78%	0.779	76%	0.759	S	S	*	*			trans	-60.2	120.4	170.6	30.8	0	0	0	0	107.6	A13 N17	A13-T15 PolarHBondContact O-N 3.34Å; T15-N17 PolarHBondContact O-N 3.39Å
16	L	37.6	Very low	36	Very low	165 Å²	165	135.9 Å²	135.9	86%	0.864	75%	0.749	S	S	*	*			trans	-55.1	102.9	176.6	-158.9	87.4	0	0	0	107.6	P14 K18	P14-L16 PolarHBondContact O-N 3.4Å; L16-K18 PolarHBondContact O-N 3.26Å
17	N	32.4	Very low	36	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	76%	0.764	S	S	*	*			trans	-60.6	111.5	177.5	-125.3	-17.7	0	0	0	105.5	T15 S19	T15-N17 PolarHBondContact O-N 3.39Å; N17-S19 PolarHBondContact O-N 3.47Å
18	K	34.7	Very low	36.2	Very low	190 Å²	190	135.1 Å²	135.1	83%	0.826	76%	0.757	S	S	*	*			trans	-64.5	76.8	167.5	-73.2	-179.6	178.1	178.6	0	106.4	L16 N20	L16-K18 PolarHBondContact O-N 3.26Å; K18-N20 PolarHBondContact O-N 3.26Å
19	S	38	Very low	36.3	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	76%	0.759	S	S	*	*			trans	-61.1	122	164.8	44.2	0	0	0	0	105.2	N17 Y21	N17-S19 PolarHBondContact O-N 3.47Å; S19-Y21 PolarHBondContact O-N 3.5Å
20	N	35.3	Very low	36.4	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	76%	0.761	S	S	*	*			trans	-47.1	114.7	-179.5	-74.8	-46.9	0	0	0	108.7	K18 T22	K18-N20 PolarHBondContact O-N 3.26Å; N20-T22 PolarHBondContact O-N 2.76Å
21	Y	36	Very low	36.5	Very low	217 Å²	217	139 Å²	139	85%	0.851	76%	0.762	S	S	*	*			trans	-58	88	164.1	-71.9	-85.5	0	0	0	106.9	S19 S23	S19-Y21 PolarHBondContact O-N 3.5Å; Y21-S23 VanDerWaalsContact C-N 3.33Å; Y21-S23 PolarHBondContact O-N 3.28Å; Y21-S23 VanDerWaalsContact O-N 3.1Å
22	T	35.7	Very low	37.2	Very low	95 Å²	95	138.1 Å²	138.1	58%	0.583	75%	0.752	S	S	*	*			trans	-75	101.6	165.5	-50.1	0	0	0	0	103.9	N20 H24	N20-T22 PolarHBondContact O-N 2.76Å; T22-H24 PolarHBondContact O-CD2 3.27Å; T22-H24 PolarHBondContact O-N 3.25Å
23	S	36.2	Very low	37.8	Very low	109 Å²	109	138 Å²	138	76%	0.762	75%	0.747	S	S	*	*			trans	-58.5	79.4	177.9	-51.9	0	0	0	0	109.7	Y21 S25	Y21-S23 VanDerWaalsContact C-N 3.33Å; Y21-S23 PolarHBondContact O-N 3.28Å; Y21-S23 VanDerWaalsContact O-N 3.1Å; S23-S25 PolarHBondContact O-N 3.19Å
24	H	36.1	Very low	38.4	Very low	152 Å²	152	141.3 Å²	141.3	70%	0.704	75%	0.754	S	S	*	*			trans	-75.5	81.6	165.1	-69.6	-62	0	0	0	107	T22 S26	T22-H24 PolarHBondContact O-CD2 3.27Å; T22-H24 PolarHBondContact O-N 3.25Å; H24-S26 PolarHBondContact O-N 3.4Å
25	S	36.6	Very low	39	Very low	123 Å²	123	139.3 Å²	139.3	86%	0.86	74%	0.739	S	S	*	*			trans	-64.1	68.8	155	163.9	0	0	0	0	108.1	S23	S23-S25 PolarHBondContact O-N 3.19Å
26	S	36.6	Very low	39.4	Very low	74 Å²	74	138.9 Å²	138.9	52%	0.517	74%	0.739	S	S	.	*			trans	-126.3	116.6	161.4	51.5	0	0	0	0	104.5	H24 L28	H24-S26 PolarHBondContact O-N 3.4Å; S26-L28 PolarHBondContact O-N 3.11Å
27	Q	38.7	Very low	39.6	Very low	190 Å²	190	136.6 Å²	136.6	89%	0.888	73%	0.732	S	S	*	*			trans	-45.3	77.8	168.9	-64.3	157.5	-21.9	0	0	109.8	N29	Q27-N29 VanDerWaalsContact C-N 3.26Å; Q27-N29 PolarHBondContact O-N 3.26Å
28	L	39.3	Very low	40.1	Very low	143 Å²	143	135.2 Å²	135.2	75%	0.749	73%	0.728	S	S	*	*			trans	-69.5	104.2	156.4	-79	166.8	0	0	0	102.1	S26 L30	S26-L28 PolarHBondContact O-N 3.11Å; L28-L30 PolarHBondContact O-N 3.42Å
29	N	40.6	Very low	40.4	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	72%	0.722	S	S	*	*			trans	-50.5	80.7	158.9	-75.9	-36.3	0	0	0	106.6	Q27 Y31	Q27-N29 VanDerWaalsContact C-N 3.26Å; Q27-N29 PolarHBondContact O-N 3.26Å; N29-Y31 HydrophobicContact CB-CD2 4.48Å; N29-Y31 PolarHBondContact O-N 3.26Å
30	L	41.7	Very low	40.7	Very low	143 Å²	143	137.7 Å²	137.7	75%	0.749	73%	0.732	S	S	*	*			trans	-67.2	91.1	163.4	-135.6	80.8	0	0	0	101.6	L28 V32	L28-L30 PolarHBondContact O-N 3.42Å; L30-V32 PolarHBondContact O-N 3.29Å
31	Y	40.4	Very low	41.2	Very low	215 Å²	215	137.2 Å²	137.2	84%	0.843	73%	0.734	S	S	*	*			trans	-52.7	93.8	154.4	-93.5	-97.5	0	0	0	103.8	N29 D33	N29-Y31 HydrophobicContact CB-CD2 4.48Å; N29-Y31 PolarHBondContact O-N 3.26Å; Y31-D33 PolarHBondContact O-N 3.47Å
32	V	50.7	Low	41.5	Very low	101 Å²	101	137.4 Å²	137.4	61%	0.612	73%	0.733	S	S	*	*			trans	-62.6	100.9	165	178.5	0	0	0	0	101.8	L30 N34	L30-V32 PolarHBondContact O-N 3.29Å; V32-N34 PolarHBondContact O-N 3.43Å; V32-N34 PolarHBondContact O-OD1 3.37Å
33	D	44.4	Very low	41.7	Very low	122 Å²	122	135.8 Å²	135.8	65%	0.652	74%	0.735	S	S	*	*			trans	-59.2	99.5	175.5	-161	13.1	0	0	0	104.6	Y31 T35	Y31-D33 PolarHBondContact O-N 3.47Å; D33-T35 PolarHBondContact O-N 2.82Å
34	N	46.4	Very low	42.2	Very low	145 Å²	145	139 Å²	139	78%	0.775	74%	0.738	S	S	*	*			trans	-73.2	31.3	-178.7	-71.4	-31	0	0	0	109.9	V32 P36	V32-N34 PolarHBondContact O-N 3.43Å; V32-N34 PolarHBondContact O-OD1 3.37Å; N34-P36 VanDerWaalsContact O-CD 3.3Å; N34-P36 WeakPolarHBondContact O-CD 3.33Å
35	T	46.4	Very low	42.8	Very low	83 Å²	83	137 Å²	137	51%	0.509	74%	0.736	S	S	.	*			trans	-63.5	119	171.1	42	0	0	0	0	106.3	D33 V37	D33-T35 PolarHBondContact O-N 2.82Å; T35-V37 PolarHBondContact O-N 3.06Å
36	P	42.6	Very low	43.2	Very low	119 Å²	119	137.5 Å²	137.5	77%	0.773	73%	0.728	S	S	*	*			trans	-59.6	113.4	178.4	21.7	-29.8	0	0	0	107.3	N34 T38	N34-P36 VanDerWaalsContact O-CD 3.3Å; N34-P36 WeakPolarHBondContact O-CD 3.33Å; P36-T38 PolarHBondContact O-N 3.04Å
37	V	43.6	Very low	43.4	Very low	117 Å²	117	139.5 Å²	139.5	71%	0.709	73%	0.729	S	S	*	*			trans	-61.1	106.5	170.8	178.9	0	0	0	0	105.5	T35 P39	T35-V37 PolarHBondContact O-N 3.06Å; V37-P39 WeakPolarHBondContact O-CD 3.4Å
38	T	41.2	Very low	43.8	Very low	119 Å²	119	140.1 Å²	140.1	73%	0.73	73%	0.731	S	S	*	*			trans	-52.2	119.5	170.4	13.8	0	0	0	0	106.8	P36 W40	P36-T38 PolarHBondContact O-N 3.04Å; T38-W40 PolarHBondContact O-N 3.48Å
39	P	42.5	Very low	43.8	Very low	107 Å²	107	136.9 Å²	136.9	70%	0.695	73%	0.733	S	S	*	*			trans	-56.2	124.3	177.9	21.1	-29.8	0	0	0	106.7	V37 V41	V37-P39 WeakPolarHBondContact O-CD 3.4Å; P39-V41 VanDerWaalsContact C-N 3.3Å; P39-V41 PolarHBondContact O-N 2.8Å
40	W	44.4	Very low	43.5	Very low	233 Å²	233	134.8 Å²	134.8	88%	0.883	72%	0.719	S	S	*	*			trans	-56.2	105.1	171.1	-66.8	63.8	0	0	0	104.8	T38 R42	T38-W40 PolarHBondContact O-N 3.48Å; W40-R42 PolarHBondContact O-N 3.41Å
41	V	45	Very low	43.6	Very low	135 Å²	135	134.7 Å²	134.7	82%	0.818	72%	0.718	S	S	*	*			trans	-62	98.6	172	-179.9	0	0	0	0	103.2	P39 G43	P39-V41 VanDerWaalsContact C-N 3.3Å; P39-V41 PolarHBondContact O-N 2.8Å; V41-G43 VanDerWaalsContact C-N 3.33Å; V41-G43 PolarHBondContact O-N 3.26Å
42	R	42.1	Very low	43.8	Very low	222 Å²	222	129.2 Å²	129.2	84%	0.838	71%	0.709	S	S	*	*			trans	-53.9	108.8	171.8	-87.4	-175.8	163	-178.2	-4.7	104.1	W40 E44	W40-R42 PolarHBondContact O-N 3.41Å; R42-E44 PolarHBondContact O-N 3.43Å
43	G	41.1	Very low	43.7	Very low	60 Å²	60	131.4 Å²	131.4	62%	0.619	72%	0.716	S	S	*	*			trans	-45.8	134.1	171.2	0	0	0	0	0	107	V41 V45	V41-G43 VanDerWaalsContact C-N 3.33Å; V41-G43 PolarHBondContact O-N 3.26Å; G43-V45 PolarHBondContact O-N 2.83Å
44	E	46.4	Very low	43.8	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	72%	0.721	S	S	*	*			trans	-38.4	118.5	-177	-68.9	177.6	155.2	0	0	109.1	R42 I46	R42-E44 PolarHBondContact O-N 3.43Å; E44-I46 PolarHBondContact O-N 3.21Å
45	V	47	Very low	43.7	Very low	111 Å²	111	134.9 Å²	134.9	67%	0.673	73%	0.725	S	S	*	*			trans	-55.5	111.3	179.8	173.9	0	0	0	0	105.9	G43 H47	G43-V45 PolarHBondContact O-N 2.83Å; V45-H47 PolarHBondContact O-N 2.8Å; V45-H47 PolarHBondContact O-ND1 2.88Å
46	I	45.4	Very low	43.4	Very low	132 Å²	132	133.7 Å²	133.7	68%	0.677	73%	0.729	S	S	*	*			trans	-70.2	94.6	176.6	-38.7	173.3	0	0	0	105	E44 E48 M50	E44-I46 PolarHBondContact O-N 3.21Å; I46-E48 PolarHBondContact O-N 2.75Å; I46-M50 HydrophobicContact CG2-CB 4.08Å
47	H	40.9	Very low	43.3	Very low	117 Å²	117	138.3 Å²	138.3	54%	0.542	73%	0.732	S	S	.	*			trans	-43.7	130	171.3	-17.6	52.9	0	0	0	109	V45 G49 M50	V45-H47 PolarHBondContact O-N 2.8Å; V45-H47 PolarHBondContact O-ND1 2.88Å; H47-G49 PolarHBondContact O-N 2.64Å; H47-M50 PolarHBondContact CE1-SD 2.88Å; H47-M50 PolarHBondContact ND1-SD 2.86Å; H47-M50 PolarHBondContact O-N 2.64Å
48	E	46.8	Very low	43.3	Very low	202 Å²	202	139.7 Å²	139.7	94%	0.944	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.5	114.7	166.7	-64.3	-84.7	166.5	0	0	108.7	I46	I46-E48 PolarHBondContact O-N 2.75Å
49	G	40.1	Very low	43.2	Very low	75 Å²	75	138.6 Å²	138.6	77%	0.773	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.3	-6.9	-179.7	0	0	0	0	0	116.4	H47 I51	H47-G49 PolarHBondContact O-N 2.64Å; G49-I51 PolarHBondContact O-N 3.44Å
50	M	34.2	Very low	43.4	Very low	95 Å²	95	142.4 Å²	142.4	47%	0.468	74%	0.735	S	S	.	*			trans	-77.6	103.4	167.2	-100.5	166.9	57	0	0	109.9	I46 H47	I46-M50 HydrophobicContact CG2-CB 4.08Å; H47-M50 PolarHBondContact CE1-SD 2.88Å; H47-M50 PolarHBondContact ND1-SD 2.86Å; H47-M50 PolarHBondContact O-N 2.64Å
51	I	43.6	Very low	43.3	Very low	142 Å²	142	136.9 Å²	136.9	73%	0.728	72%	0.723	S	S	*	*			trans	-50	125.5	165.6	-58.4	172.4	0	0	0	105.7	G49 I53	G49-I51 PolarHBondContact O-N 3.44Å; I51-I53 PolarHBondContact O-N 3.24Å
52	P	44	Very low	43.4	Very low	100 Å²	100	137.9 Å²	137.9	65%	0.649	72%	0.722	S	S	*	*			trans	-47.7	121.2	175.2	-19.2	25.9	0	0	0	106.6	D54	P52-D54 PolarHBondContact O-N 2.85Å
53	I	48.8	Very low	43.7	Very low	147 Å²	147	135.1 Å²	135.1	75%	0.754	72%	0.716	S	S	*	*			trans	-55	106	170.1	-61.6	170.4	0	0	0	102.9	I51 K55	I51-I53 PolarHBondContact O-N 3.24Å; I53-K55 PolarHBondContact O-N 3.21Å
54	D	46.5	Very low	43.6	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	71%	0.711	S	S	*	*			trans	-55.1	98	-179	-88.8	-32.8	0	0	0	104.2	P52 G56	P52-D54 PolarHBondContact O-N 2.85Å; D54-G56 PolarHBondContact O-N 2.75Å
55	K	45.4	Very low	43.4	Very low	198 Å²	198	136.1 Å²	136.1	86%	0.861	71%	0.71	S	S	*	*			trans	-61.4	97.4	168.7	-77.1	-175.2	177.9	179.3	0	101.6	I53 Y57	I53-K55 PolarHBondContact O-N 3.21Å; K55-Y57 PolarHBondContact O-N 3.27Å
56	G	40.4	Very low	43.5	Very low	57 Å²	57	140.8 Å²	140.8	59%	0.588	72%	0.715	S	S	*	*			trans	-39.1	115.7	-165.6	0	0	0	0	0	107.1	D54 I58	D54-G56 PolarHBondContact O-N 2.75Å; G56-I58 PolarHBondContact O-N 2.95Å
57	Y	40.6	Very low	43.4	Very low	216 Å²	216	144.3 Å²	144.3	85%	0.847	72%	0.721	S	S	*	*			trans	-58.4	97	-177.9	-155.8	-89.9	0	0	0	104.8	K55 P59	K55-Y57 PolarHBondContact O-N 3.27Å; Y57-P59 WeakPolarHBondContact O-CD 3.35Å
58	I	43.6	Very low	43.6	Very low	146 Å²	146	148.6 Å²	148.6	75%	0.749	73%	0.734	S	S	*	*			trans	-62.3	110	179	-64	175.9	0	0	0	102.1	G56 K60	G56-I58 PolarHBondContact O-N 2.95Å; I58-K60 VanDerWaalsContact C-N 3.3Å; I58-K60 PolarHBondContact O-N 3Å
59	P	38.9	Very low	43.2	Very low	97 Å²	97	142 Å²	142	63%	0.63	72%	0.72	S	S	*	*			trans	-59.9	109.9	175.9	25.3	-29.4	0	0	0	103.2	Y57 N61	Y57-P59 WeakPolarHBondContact O-CD 3.35Å; P59-N61 PolarHBondContact O-N 3.02Å
60	K	46.6	Very low	43	Very low	186 Å²	186	144.9 Å²	144.9	81%	0.809	72%	0.718	S	S	*	*			trans	-53.6	107.9	167.4	-82.3	-175.1	177.8	175.6	0	102.2	I58 I62	I58-K60 VanDerWaalsContact C-N 3.3Å; I58-K60 PolarHBondContact O-N 3Å; K60-I62 VanDerWaalsContact O-CG1 3.27Å; K60-I62 WeakPolarHBondContact O-CG1 3.27Å; K60-I62 PolarHBondContact O-N 3.12Å
61	N	42.2	Very low	43.1	Very low	118 Å²	118	146.9 Å²	146.9	63%	0.631	73%	0.73	S	S	*	*			trans	-54	102.7	177.6	-112.1	-20.8	0	0	0	103.8	P59 F63	P59-N61 PolarHBondContact O-N 3.02Å; N61-F63 HydrophobicContact CB-CD2 3.56Å; N61-F63 HydrophobicContact CB-CE2 3.53Å; N61-F63 HydrophobicContact CB-CG 4.37Å; N61-F63 HydrophobicContact CB-CZ 4.33Å; N61-F63 VanDerWaalsContact ND2-CE2 3.27Å; N61-F63 WeakPolarHBondContact ND2-CE2 3.01Å; N61-F63 PolarHBondContact O-N 3.2Å
62	I	46.5	Very low	42.7	Very low	156 Å²	156	146.3 Å²	146.3	80%	0.8	73%	0.728	S	S	*	*			trans	-75.3	63.1	170.1	-46.6	177.7	0	0	0	102.4	K60 G64	K60-I62 VanDerWaalsContact O-CG1 3.27Å; K60-I62 WeakPolarHBondContact O-CG1 3.27Å; K60-I62 PolarHBondContact O-N 3.12Å; I62-G64 PolarHBondContact O-N 2.93Å
63	F	49.9	Very low	42.3	Very low	163 Å²	163	147.3 Å²	147.3	72%	0.715	73%	0.728	S	S	*	*			trans	-56.9	92	148.1	-70.3	-60.2	0	0	0	102.1	N61 R65	N61-F63 HydrophobicContact CB-CD2 3.56Å; N61-F63 HydrophobicContact CB-CE2 3.53Å; N61-F63 HydrophobicContact CB-CG 4.37Å; N61-F63 HydrophobicContact CB-CZ 4.33Å; N61-F63 VanDerWaalsContact ND2-CE2 3.27Å; N61-F63 WeakPolarHBondContact ND2-CE2 3.01Å; N61-F63 PolarHBondContact O-N 3.2Å; F63-R65 PolarHBondContact O-N 2.92Å
64	G	37.4	Very low	41.6	Very low	50 Å²	50	147 Å²	147	52%	0.515	73%	0.729	S	S	.	*			trans	-43.8	118.4	178.5	0	0	0	0	0	104.3	I62 R66	I62-G64 PolarHBondContact O-N 2.93Å; G64-R66 VanDerWaalsContact C-N 3.32Å; G64-R66 PolarHBondContact O-N 2.71Å
65	R	43.4	Very low	41.4	Very low	209 Å²	209	146.2 Å²	146.2	79%	0.789	72%	0.724	S	S	*	*			trans	-48.4	111.8	176.1	-68.2	-177.3	-177.6	-163.4	0.8	103.6	F63 Y67	F63-R65 PolarHBondContact O-N 2.92Å; R65-Y67 HydrophobicContact CB-CE2 4.44Å; R65-Y67 WeakPolarHBondContact O-CD2 3.44Å; R65-Y67 PolarHBondContact O-N 3.1Å
66	R	48.6	Very low	41.1	Very low	209 Å²	209	143 Å²	143	79%	0.789	72%	0.716	S	S	*	*			trans	-63.7	95.4	172.7	-75.8	-174.2	-111.8	-161.5	-2.5	102.5	G64 Y68	G64-R66 VanDerWaalsContact C-N 3.32Å; G64-R66 PolarHBondContact O-N 2.71Å; R66-Y68 WeakPolarHBondContact O-CD2 3.27Å; R66-Y68 PolarHBondContact O-N 3.41Å
67	Y	43.6	Very low	40.8	Very low	205 Å²	205	147 Å²	147	80%	0.804	72%	0.724	S	S	*	*			trans	-61	99.5	167.1	-66.7	-82.9	0	0	0	102.5	R65 G69	R65-Y67 HydrophobicContact CB-CE2 4.44Å; R65-Y67 WeakPolarHBondContact O-CD2 3.44Å; R65-Y67 PolarHBondContact O-N 3.1Å; Y67-G69 PolarHBondContact O-N 3.48Å
68	Y	45.5	Very low	40.5	Very low	208 Å²	208	144 Å²	144	82%	0.816	72%	0.723	S	S	*	*			trans	-59.4	95.5	162.6	-65.8	-77.6	0	0	0	103.3	R66 N70	R66-Y68 WeakPolarHBondContact O-CD2 3.27Å; R66-Y68 PolarHBondContact O-N 3.41Å; Y68-N70 VanDerWaalsContact C-N 3.33Å; Y68-N70 PolarHBondContact O-N 3.02Å
69	G	37.9	Very low	40.1	Very low	62 Å²	62	144.7 Å²	144.7	64%	0.639	73%	0.728	S	S	*	*			trans	-54	110.8	168.4	0	0	0	0	0	104.1	Y67 N71	Y67-G69 PolarHBondContact O-N 3.48Å; G69-N71 PolarHBondContact O-N 3.1Å
70	N	34.9	Very low	39.9	Very low	137 Å²	137	147.4 Å²	147.4	73%	0.733	73%	0.734	S	S	*	*			trans	-64.6	86	171.7	-176.6	14.9	0	0	0	105.2	Y68 N72	Y68-N70 VanDerWaalsContact C-N 3.33Å; Y68-N70 PolarHBondContact O-N 3.02Å; N70-N72 PolarHBondContact O-N 3.06Å
71	N	37.9	Very low	39.4	Very low	136 Å²	136	146.7 Å²	146.7	73%	0.727	73%	0.731	S	S	*	*			trans	-79.7	65.2	-174.5	-156.2	25.1	0	0	0	106.9	G69 N73	G69-N71 PolarHBondContact O-N 3.1Å; N71-N73 PolarHBondContact O-N 3.03Å
72	N	34.8	Very low	39.1	Very low	130 Å²	130	150 Å²	150	70%	0.695	74%	0.741	S	S	*	*			trans	-91	18.7	178.1	-129.9	16.5	0	0	0	111.2	N70 N74	N70-N72 PolarHBondContact O-N 3.06Å; N72-N74 PolarHBondContact O-N 3.41Å
73	N	35.9	Very low	38.6	Very low	121 Å²	121	152.8 Å²	152.8	65%	0.647	74%	0.742	S	S	*	*			trans	-90.5	98.5	170.1	-78.6	9.5	0	0	0	107.9	N71 D75	N71-N73 PolarHBondContact O-N 3.03Å; N73-D75 PolarHBondContact O-N 3.18Å
74	N	32.8	Very low	37.7	Very low	142 Å²	142	151.8 Å²	151.8	76%	0.759	75%	0.745	S	S	*	*			trans	-61.6	29.6	168	-149.6	4.1	0	0	0	112.7	N72 N76	N72-N74 PolarHBondContact O-N 3.41Å; N74-N76 VanDerWaalsContact C-N 3.3Å; N74-N76 PolarHBondContact O-N 2.81Å; N74-N76 VanDerWaalsContact O-N 3.11Å
75	D	43.1	Very low	37.6	Very low	124 Å²	124	155.2 Å²	155.2	66%	0.663	76%	0.757	S	S	*	*			trans	-90.9	79.6	179.2	-63.4	-31	0	0	0	107.2	N73 N77	N73-D75 PolarHBondContact O-N 3.18Å; D75-N77 PolarHBondContact O-N 3.05Å
76	N	38.3	Very low	36.8	Very low	130 Å²	130	147.8 Å²	147.8	70%	0.695	75%	0.746	S	S	*	*			trans	-37.3	128.2	157.1	-65.4	-50.7	0	0	0	108.9	N74	N74-N76 VanDerWaalsContact C-N 3.3Å; N74-N76 PolarHBondContact O-N 2.81Å; N74-N76 VanDerWaalsContact O-N 3.11Å
77	N	35.5	Very low	36	Very low	141 Å²	141	144.4 Å²	144.4	75%	0.754	75%	0.749	S	S	*	*			trans	83	82.7	-179.6	-41.7	-38.8	0	0	0	113.7	D75	D75-N77 PolarHBondContact O-N 3.05Å
78	N	32.8	Very low	35.5	Very low	155 Å²	155	140.8 Å²	140.8	83%	0.829	75%	0.748	S	S	*	*				-166.1	103.4	120.8	-88	-34.8	0	0	0	108.7	M80	N78-M80 PolarHBondContact O-N 3.49Å
79	N	34.8	Very low	34.6	Very low	160 Å²	160	139 Å²	139	86%	0.856	75%	0.747	S	S	*	*			trans	-36.8	108.9	163.8	-81.4	-24.6	0	0	0	109.6	K81	N79-K81 VanDerWaalsContact C-N 3.29Å; N79-K81 PolarHBondContact O-N 3.3Å
80	M	35.8	Very low	34.1	Very low	154 Å²	154	139.1 Å²	139.1	76%	0.759	75%	0.748	S	S	*	*			trans	-54.7	101.4	163.4	-83.5	-83.3	-164.9	0	0	106.3	N78 F82	N78-M80 PolarHBondContact O-N 3.49Å; M80-F82 VanDerWaalsContact C-N 3.25Å; M80-F82 WeakPolarHBondContact O-CD2 3.45Å; M80-F82 PolarHBondContact O-N 3.36Å
81	K	35.3	Very low	33.8	Very low	171 Å²	171	140.1 Å²	140.1	74%	0.743	75%	0.753	S	S	*	*			trans	-62.1	93.9	171.8	-74.1	179.4	178.7	179.7	0	106.5	N79 Y83	N79-K81 VanDerWaalsContact C-N 3.29Å; N79-K81 PolarHBondContact O-N 3.3Å; K81-Y83 VanDerWaalsContact C-N 3.31Å; K81-Y83 PolarHBondContact O-N 2.8Å
82	F	36.7	Very low	33.3	Very low	188 Å²	188	138.5 Å²	138.5	83%	0.825	75%	0.752	S	S	*	*			trans	-56.3	105.3	155	-67.9	-84.3	0	0	0	105.4	M80 N84	M80-F82 VanDerWaalsContact C-N 3.25Å; M80-F82 WeakPolarHBondContact O-CD2 3.45Å; M80-F82 PolarHBondContact O-N 3.36Å; F82-N84 PolarHBondContact O-N 3.06Å
83	Y	35.7	Very low	33	Very low	214 Å²	214	137.8 Å²	137.8	84%	0.839	76%	0.756	S	S	*	*			trans	-67	77.5	163.4	-79.4	-88.9	0	0	0	106.4	K81	K81-Y83 VanDerWaalsContact C-N 3.31Å; K81-Y83 PolarHBondContact O-N 2.8Å
84	N	30	Very low	32.6	Very low	142 Å²	142	138 Å²	138	76%	0.759	76%	0.762	S	S	*	*			trans	-69.9	130.5	159.4	-131.7	7.3	0	0	0	105.3	F82 G86	F82-N84 PolarHBondContact O-N 3.06Å; N84-G86 PolarHBondContact O-N 2.96Å
85	P	35.4	Very low	32.7	Very low	121 Å²	121	137.2 Å²	137.2	79%	0.786	76%	0.762	S	S	*	*			trans	-71	74.4	173.2	30.9	-32.5	0	0	0	107.6	T87	P85-T87 PolarHBondContact O-N 2.98Å
86	G	27.5	Very low	32	Very low	54 Å²	54	138.3 Å²	138.3	56%	0.557	77%	0.768	S	S	*	*			trans	-73.1	117	172.8	0	0	0	0	0	107.9	N84 V88	N84-G86 PolarHBondContact O-N 2.96Å; G86-V88 VanDerWaalsContact C-N 3.31Å; G86-V88 WeakPolarHBondContact O-CG2 3.34Å; G86-V88 PolarHBondContact O-N 2.73Å
87	T	31.7	Very low	31.6	Very low	138 Å²	138	141.2 Å²	141.2	85%	0.847	78%	0.777	S	S	*	*			trans	-49.5	86.8	166.3	-44.4	0	0	0	0	110.3	P85 H89	P85-T87 PolarHBondContact O-N 2.98Å; T87-H89 PolarHBondContact O-N 3.46Å
88	V	32.3	Very low	31.5	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	78%	0.777	S	S	*	*			trans	-90.9	95.6	173.1	-169.1	0	0	0	0	108	G86 G90	G86-V88 VanDerWaalsContact C-N 3.31Å; G86-V88 WeakPolarHBondContact O-CG2 3.34Å; G86-V88 PolarHBondContact O-N 2.73Å; V88-G90 PolarHBondContact O-N 3Å
89	H	26.9	Very low	31.1	Very low	172 Å²	172	135.7 Å²	135.7	80%	0.796	77%	0.774	S	S	*	*			trans	-45.5	111.8	146.8	-103.7	36.1	0	0	0	108.3	T87	T87-H89 PolarHBondContact O-N 3.46Å
90	G	28.6	Very low	31	Very low	64 Å²	64	134.3 Å²	134.3	66%	0.66	77%	0.767	S	S	*	*			trans	-146.7	63	-179.3	0	0	0	0	0	109.2	V88 S92	V88-G90 PolarHBondContact O-N 3Å; G90-S92 PolarHBondContact O-N 3.42Å; G90-S92 VanDerWaalsContact O-N 3.16Å
91	D	27.1	Very low	30.8	Very low	157 Å²	157	134.3 Å²	134.3	84%	0.84	77%	0.77	S	S	*	*			trans	-57.7	107.5	160.3	-76.8	-37.1	0	0	0	109
92	S	28.8	Very low	30.7	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	77%	0.767	S	S	*	*			trans	-164.8	80.8	146	62.6	0	0	0	0	108.3	G90 T94	G90-S92 PolarHBondContact O-N 3.42Å; G90-S92 VanDerWaalsContact O-N 3.16Å; S92-T94 VanDerWaalsContact C-N 3.33Å; S92-T94 PolarHBondContact O-N 3.36Å
93	C	27.9	Very low	30.7	Very low	116 Å²	116	134 Å²	134	78%	0.784	77%	0.766	S	S	*	*			trans	-64.3	92.1	163.1	42.4	0	0	0	0	109.1	V95	C93-V95 PolarHBondContact O-N 3.47Å
94	T	27.9	Very low	30.7	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	76%	0.763	S	S	*	*			trans	-73.8	106.8	157.4	40.9	0	0	0	0	107.6	S92 D96	S92-T94 VanDerWaalsContact C-N 3.33Å; S92-T94 PolarHBondContact O-N 3.36Å; T94-D96 VanDerWaalsContact C-N 3.35Å; T94-D96 PolarHBondContact O-N 3.26Å
95	V	34.3	Very low	30.7	Very low	125 Å²	125	133.7 Å²	133.7	76%	0.758	76%	0.761	S	S	*	*			trans	-69.4	86.7	176.8	-172.8	0	0	0	0	108	C93	C93-V95 PolarHBondContact O-N 3.47Å
96	D	29.6	Very low	30.8	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	76%	0.761	S	S	*	*			trans	-96.5	112.6	164.6	-86.9	-24.1	0	0	0	109.6	T94 S98	T94-D96 VanDerWaalsContact C-N 3.35Å; T94-D96 PolarHBondContact O-N 3.26Å; D96-S98 PolarHBondContact O-N 3.42Å
97	E	29.9	Very low	31.3	Very low	191 Å²	191	141.1 Å²	141.1	89%	0.893	77%	0.767	S	S	*	*			trans	-49.4	93.2	173.7	-63.4	170	141.7	0	0	111.7
98	S	31.7	Very low	31.7	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	77%	0.765	S	S	*	*			trans	-159.7	93.5	148.6	48	0	0	0	0	109.4	D96 N100	D96-S98 PolarHBondContact O-N 3.42Å; S98-N100 PolarHBondContact O-N 3.04Å
99	G	25.7	Very low	32.3	Very low	75 Å²	75	148 Å²	148	77%	0.773	77%	0.77	S	S	*	*			trans	-58.8	98	170.4	0	0	0	0	0	110.1
100	N	31.8	Very low	33	Very low	131 Å²	131	150.1 Å²	150.1	70%	0.701	77%	0.771	S	S	*	*			trans	-146.8	96.4	155.5	-106.8	-25.7	0	0	0	106.8	S98 H102	S98-N100 PolarHBondContact O-N 3.04Å; N100-H102 PolarHBondContact O-N 2.95Å
101	N	32.9	Very low	33.4	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	77%	0.768	S	S	*	*			trans	-61.3	64.8	167.3	-66.1	-36.4	0	0	0	109.5	Y103	N101-Y103 PolarHBondContact O-N 2.82Å
102	H	32.3	Very low	34.1	Very low	147 Å²	147	153.1 Å²	153.1	68%	0.681	77%	0.768	S	S	*	*			trans	-71.9	99.1	157	-81.7	71.1	0	0	0	103.9	N100 Q104	N100-H102 PolarHBondContact O-N 2.95Å; H102-Q104 VanDerWaalsContact C-N 3.25Å; H102-Q104 PolarHBondContact O-N 3.21Å
103	Y	36	Very low	34.7	Very low	207 Å²	207	153.3 Å²	153.3	81%	0.812	77%	0.767	S	S	*	*			trans	-36	105.5	153.2	-72.7	-87.2	0	0	0	105.8	N101 Y105	N101-Y103 PolarHBondContact O-N 2.82Å; Y103-Y105 PolarHBondContact O-N 3.46Å
104	Q	35.9	Very low	35.4	Very low	165 Å²	165	157.9 Å²	157.9	77%	0.771	77%	0.769	S	S	*	*			trans	-66.5	85	164	-71.3	-169.3	10.2	0	0	102.5	H102 Y106	H102-Q104 VanDerWaalsContact C-N 3.25Å; H102-Q104 PolarHBondContact O-N 3.21Å; Q104-Y106 PolarHBondContact O-N 2.75Å
105	Y	30.6	Very low	36	Very low	184 Å²	184	157.5 Å²	157.5	72%	0.722	76%	0.763	S	S	*	*			trans	-49.8	97.4	148.8	-112.5	-91.5	0	0	0	102	Y103 N107	Y103-Y105 PolarHBondContact O-N 3.46Å; Y105-N107 PolarHBondContact O-N 3.01Å
106	Y	36.9	Very low	36.4	Very low	199 Å²	199	160.5 Å²	160.5	78%	0.78	76%	0.76	S	S	*	*			trans	-42.1	107	162.8	-81	-88.9	0	0	0	102.7	Q104 R108	Q104-Y106 PolarHBondContact O-N 2.75Å; Y106-R108 PolarHBondContact O-N 2.79Å
107	N	38.2	Very low	37.1	Very low	131 Å²	131	160.2 Å²	160.2	70%	0.701	75%	0.754	S	S	*	*			trans	-57.8	94.2	170.8	-82.4	-65.2	0	0	0	101.5	Y105 K109	Y105-N107 PolarHBondContact O-N 3.01Å; N107-K109 VanDerWaalsContact O-CA 3.3Å; N107-K109 WeakPolarHBondContact O-CA 3.15Å; N107-K109 PolarHBondContact O-N 3.27Å
108	R	40.9	Very low	37.8	Very low	212 Å²	212	158.8 Å²	158.8	80%	0.8	74%	0.741	S	S	*	*			trans	-38.4	105.7	166.8	-86	-175.5	-89	-159	-8	101.9	Y106 R110	Y106-R108 PolarHBondContact O-N 2.79Å; R108-R110 VanDerWaalsContact C-N 3.27Å; R108-R110 VanDerWaalsContact O-CA 3.25Å; R108-R110 WeakPolarHBondContact O-CA 3.38Å; R108-R110 PolarHBondContact O-N 2.84Å
109	K	45.7	Very low	38.3	Very low	199 Å²	199	164.6 Å²	164.6	87%	0.865	75%	0.749	S	S	*	*			trans	-37.8	105.1	-166	-76.4	-179.4	176.6	175.8	0	104.1	N107 G111	N107-K109 VanDerWaalsContact O-CA 3.3Å; N107-K109 WeakPolarHBondContact O-CA 3.15Å; N107-K109 PolarHBondContact O-N 3.27Å; K109-G111 WeakPolarHBondContact O-CA 3.25Å; K109-G111 PolarHBondContact O-N 2.76Å
110	R	41.1	Very low	39	Very low	217 Å²	217	168.3 Å²	168.3	82%	0.819	75%	0.746	S	S	*	*			trans	-49.8	105.8	-169.1	-83.6	178.9	140.9	179.6	-5	102.6	R108 R112	R108-R110 VanDerWaalsContact C-N 3.27Å; R108-R110 VanDerWaalsContact O-CA 3.25Å; R108-R110 WeakPolarHBondContact O-CA 3.38Å; R108-R110 PolarHBondContact O-N 2.84Å; R110-R112 PolarHBondContact O-N 3.06Å
111	G	35.5	Very low	39	Very low	58 Å²	58	165.8 Å²	165.8	60%	0.598	75%	0.751	S	S	*	*			trans	-49.9	118.7	-171.8	0	0	0	0	0	102.4	K109 P113	K109-G111 WeakPolarHBondContact O-CA 3.25Å; K109-G111 PolarHBondContact O-N 2.76Å; G111-P113 WeakPolarHBondContact O-CA 3.41Å
112	R	42.5	Very low	39.3	Very low	226 Å²	226	161.8 Å²	161.8	85%	0.853	75%	0.746	S	S	*	*			trans	-36	115.1	-173.7	-85.4	-178.7	165.5	-171.4	-3.6	104.5	R110 Y114	R110-R112 PolarHBondContact O-N 3.06Å; R112-Y114 VanDerWaalsContact C-N 3.33Å; R112-Y114 PolarHBondContact O-N 3.41Å
113	P	40.6	Very low	39.7	Very low	106 Å²	106	163.2 Å²	163.2	69%	0.688	75%	0.753	S	S	*	*			trans	-47.8	115.1	-174.6	16.9	-29.5	0	0	0	103.4	G111 N115	G111-P113 WeakPolarHBondContact O-CA 3.41Å; P113-N115 PolarHBondContact O-N 2.79Å
114	Y	42.6	Very low	40.1	Very low	211 Å²	211	163.4 Å²	163.4	83%	0.827	75%	0.752	S	S	*	*			trans	-58.5	102.1	177.1	-73.3	-86.9	0	0	0	100.9	R112 R116	R112-Y114 VanDerWaalsContact C-N 3.33Å; R112-Y114 PolarHBondContact O-N 3.41Å; Y114-R116 PolarHBondContact O-N 2.81Å
115	N	41.7	Very low	40.2	Very low	118 Å²	118	158.5 Å²	158.5	63%	0.631	75%	0.746	S	S	*	*			trans	-63.4	88.7	164.8	-102.8	-5.6	0	0	0	100.9	P113 H117	P113-N115 PolarHBondContact O-N 2.79Å; N115-H117 VanDerWaalsContact CB-CE1 3.43Å; N115-H117 WeakPolarHBondContact CB-CE1 3.35Å; N115-H117 PolarHBondContact O-N 2.89Å; N115-H117 PolarHBondContact O-ND1 2.89Å; N115-H117 VanDerWaalsContact O-ND1 3.12Å
116	R	42.4	Very low	40.5	Very low	187 Å²	187	159.7 Å²	159.7	71%	0.706	75%	0.75	S	S	*	*			trans	-55.8	84.2	147.3	-76.7	-173.8	-83.8	-156.5	-2.7	102.2	Y114 Y118	Y114-R116 PolarHBondContact O-N 2.81Å; R116-Y118 HydrophobicContact CB-CD2 4.1Å; R116-Y118 HydrophobicContact CB-CE2 3.83Å; R116-Y118 WeakPolarHBondContact O-CD2 3.43Å; R116-Y118 PolarHBondContact O-N 3.34Å
117	H	44.1	Very low	40.6	Very low	142 Å²	142	160.4 Å²	160.4	66%	0.657	75%	0.753	S	S	*	*			trans	-61.9	86.3	157.9	-63.8	99.1	0	0	0	102.4	N115 Y119	N115-H117 VanDerWaalsContact CB-CE1 3.43Å; N115-H117 WeakPolarHBondContact CB-CE1 3.35Å; N115-H117 PolarHBondContact O-N 2.89Å; N115-H117 PolarHBondContact O-ND1 2.89Å; N115-H117 VanDerWaalsContact O-ND1 3.12Å; H117-Y119 VanDerWaalsContact C-N 3.25Å; H117-Y119 PolarHBondContact O-N 3.21Å
118	Y	44.2	Very low	40.5	Very low	160 Å²	160	160.5 Å²	160.5	63%	0.627	75%	0.754	S	S	*	*			trans	-53.7	109	154.9	-71.7	-83.4	0	0	0	102.9	R116 H120	R116-Y118 HydrophobicContact CB-CD2 4.1Å; R116-Y118 HydrophobicContact CB-CE2 3.83Å; R116-Y118 WeakPolarHBondContact O-CD2 3.43Å; R116-Y118 PolarHBondContact O-N 3.34Å; Y118-H120 PolarHBondContact O-N 2.9Å
119	Y	43.8	Very low	40	Very low	228 Å²	228	157.1 Å²	157.1	89%	0.894	75%	0.752	S	S	*	*			trans	-56.1	96.1	167.7	-87.8	-97	0	0	0	105.3	H117 G121	H117-Y119 VanDerWaalsContact C-N 3.25Å; H117-Y119 PolarHBondContact O-N 3.21Å; Y119-G121 PolarHBondContact O-N 3.11Å
120	H	38.6	Very low	39.6	Very low	153 Å²	153	153.6 Å²	153.6	71%	0.708	74%	0.742	S	S	*	*			trans	-64.4	107.5	167.3	-76.8	-71.1	0	0	0	105	Y118 G122	Y118-H120 PolarHBondContact O-N 2.9Å; H120-G122 PolarHBondContact O-N 3.05Å
121	G	32.7	Very low	39.3	Very low	78 Å²	78	149.4 Å²	149.4	80%	0.804	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	118.9	170.5	0	0	0	0	0	109	Y119	Y119-G121 PolarHBondContact O-N 3.11Å
122	G	39.5	Very low	39.2	Very low	70 Å²	70	154.3 Å²	154.3	72%	0.722	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.1	59.5	160.9	0	0	0	0	0	116.6	H120 R124	H120-G122 PolarHBondContact O-N 3.05Å; G122-R124 VanDerWaalsContact C-N 3.33Å; G122-R124 PolarHBondContact O-N 2.87Å; G122-R124 VanDerWaalsContact O-N 3.08Å
123	Q	40.1	Very low	38.9	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.822	75%	0.745	S	S	*	*			trans	-72.7	100.8	149.6	-83.8	-170.3	-10.7	0	0	108.1	G125	Q123-G125 PolarHBondContact O-N 3.2Å
124	R	43.9	Very low	38.5	Very low	211 Å²	211	153 Å²	153	80%	0.796	75%	0.747	S	S	*	*			trans	-45.2	107.4	168.5	-67.6	171	173.5	-124.9	-1.6	107.9	G122 Y126	G122-R124 VanDerWaalsContact C-N 3.33Å; G122-R124 PolarHBondContact O-N 2.87Å; G122-R124 VanDerWaalsContact O-N 3.08Å; R124-Y126 VanDerWaalsContact C-N 3.3Å; R124-Y126 WeakPolarHBondContact O-CD2 3.34Å; R124-Y126 PolarHBondContact O-N 2.69Å
125	G	39.1	Very low	38	Very low	62 Å²	62	150.5 Å²	150.5	64%	0.639	75%	0.748	S	S	*	*			trans	-60.6	99.4	168.8	0	0	0	0	0	107.5	Q123 Y127	Q123-G125 PolarHBondContact O-N 3.2Å; G125-Y127 VanDerWaalsContact C-N 3.34Å; G125-Y127 PolarHBondContact O-N 3.34Å
126	Y	36.7	Very low	37.7	Very low	209 Å²	209	152.9 Å²	152.9	82%	0.82	76%	0.755	S	S	*	*			trans	-62.6	105.3	163.6	-71	-87.2	0	0	0	105.4	R124 N128	R124-Y126 VanDerWaalsContact C-N 3.3Å; R124-Y126 WeakPolarHBondContact O-CD2 3.34Å; R124-Y126 PolarHBondContact O-N 2.69Å; Y126-N128 VanDerWaalsContact C-N 3.34Å; Y126-N128 PolarHBondContact O-N 2.85Å
127	Y	37.9	Very low	37.2	Very low	214 Å²	214	154.7 Å²	154.7	84%	0.839	76%	0.762	S	S	*	*			trans	-54.4	101.9	171.8	-79.1	-93.7	0	0	0	107.4	G125 N129	G125-Y127 VanDerWaalsContact C-N 3.34Å; G125-Y127 PolarHBondContact O-N 3.34Å; Y127-N129 PolarHBondContact O-N 3.2Å
128	N	36.2	Very low	36.9	Very low	134 Å²	134	152.8 Å²	152.8	72%	0.717	76%	0.764	S	S	*	*			trans	-72.1	102.5	172.2	-170.3	-5.1	0	0	0	106.7	Y126 N130	Y126-N128 VanDerWaalsContact C-N 3.34Å; Y126-N128 PolarHBondContact O-N 2.85Å; N128-N130 PolarHBondContact O-N 3.27Å
129	N	32	Very low	36.4	Very low	141 Å²	141	155.9 Å²	155.9	75%	0.754	78%	0.775	S	S	*	*			trans	-80.1	69.7	-172.5	-151.9	9	0	0	0	108.9	Y127	Y127-N129 PolarHBondContact O-N 3.2Å
130	N	35.8	Very low	35.7	Very low	125 Å²	125	154 Å²	154	67%	0.668	77%	0.768	S	S	*	*			trans	-124.1	95	174.6	-89.9	-21.7	0	0	0	109.9	N128 N132	N128-N130 PolarHBondContact O-N 3.27Å; N130-N132 PolarHBondContact O-N 2.84Å
131	N	35.9	Very low	35.4	Very low	129 Å²	129	151.2 Å²	151.2	69%	0.69	76%	0.763	S	S	*	*	S	Bend	trans	42.5	78	138.1	-65.1	-23.1	0	0	0	116.4
132	N	33.7	Very low	35.3	Very low	160 Å²	160	156.8 Å²	156.8	86%	0.856	77%	0.766	S	S	*	*			trans	-163.9	87.7	130.3	-94.3	-33.4	0	0	0	108.5	N130 N134	N130-N132 PolarHBondContact O-N 2.84Å; N132-N134 PolarHBondContact O-N 2.92Å
133	H	34.6	Very low	34.6	Very low	167 Å²	167	159 Å²	159	77%	0.773	77%	0.765	S	S	*	*			trans	-63.1	97.7	171.3	-76.4	33	0	0	0	109.1
134	N	32.2	Very low	33.8	Very low	137 Å²	137	156.2 Å²	156.2	73%	0.733	76%	0.764	S	S	*	*			trans	-158.5	15.1	158.1	-96.3	-19	0	0	0	114.4	N132 H136	N132-N134 PolarHBondContact O-N 2.92Å; N134-H136 PolarHBondContact O-N 3.02Å
135	N	33.9	Very low	33	Very low	159 Å²	159	150.4 Å²	150.4	85%	0.85	76%	0.756	S	S	*	*			trans	-94.5	79	170	-75.9	-34.3	0	0	0	109.8	R137	N135-R137 PolarHBondContact O-N 2.9Å
136	H	34.9	Very low	32.6	Very low	169 Å²	169	153.1 Å²	153.1	78%	0.782	76%	0.762	S	S	*	*			trans	-65.2	42.9	162.6	-71.2	-70.2	0	0	0	112.4	N134 S138	N134-H136 PolarHBondContact O-N 3.02Å; H136-S138 PolarHBondContact O-N 2.88Å; H136-S138 VanDerWaalsContact O-N 3.15Å
137	R	32.5	Very low	32.2	Very low	225 Å²	225	148.6 Å²	148.6	85%	0.849	76%	0.761	S	S	*	*			trans	-91.1	63	167.8	-141.9	171.2	-169.4	-173.8	2	108.3	N135 R139	N135-R137 PolarHBondContact O-N 2.9Å; R137-R139 VanDerWaalsContact C-N 3.33Å; R137-R139 PolarHBondContact O-N 2.92Å
138	S	37.7	Very low	31.7	Very low	101 Å²	101	144.2 Å²	144.2	71%	0.706	76%	0.756	S	S	*	*			trans	-52.4	102.9	162	-47.7	0	0	0	0	106.4	H136 Y140	H136-S138 PolarHBondContact O-N 2.88Å; H136-S138 VanDerWaalsContact O-N 3.15Å; S138-Y140 PolarHBondContact O-N 3.18Å
139	R	33.5	Very low	31.1	Very low	225 Å²	225	147.6 Å²	147.6	85%	0.849	76%	0.76	S	S	*	*			trans	-68.2	79.2	171.1	-67	179.6	-174.8	-174.1	0.6	106.7	R137 P141	R137-R139 VanDerWaalsContact C-N 3.33Å; R137-R139 PolarHBondContact O-N 2.92Å; R139-P141 WeakPolarHBondContact O-CD 3.33Å
140	Y	27.7	Very low	31	Very low	189 Å²	189	146.6 Å²	146.6	74%	0.741	76%	0.761	S	S	*	*			trans	-76.4	117.8	164.3	-149.6	-93.6	0	0	0	106.5	S138 F142	S138-Y140 PolarHBondContact O-N 3.18Å; Y140-F142 PolarHBondContact O-N 2.81Å; Y140-F142 VanDerWaalsContact O-N 3.14Å
141	P	33.1	Very low	30.6	Very low	94 Å²	94	147.7 Å²	147.7	61%	0.61	77%	0.766	S	S	*	*			trans	-64.5	115.4	172.8	26.5	-30.2	0	0	0	107.1	R139 T143	R139-P141 WeakPolarHBondContact O-CD 3.33Å; P141-T143 VanDerWaalsContact C-N 3.27Å; P141-T143 PolarHBondContact O-N 3.39Å
142	F	29.6	Very low	30.1	Very low	196 Å²	196	147 Å²	147	86%	0.86	77%	0.771	S	S	*	*			trans	-67	95.4	166.3	-83.9	-88.3	0	0	0	107.3	Y140 C144	Y140-F142 PolarHBondContact O-N 2.81Å; Y140-F142 VanDerWaalsContact O-N 3.14Å; F142-C144 PolarHBondContact O-N 2.74Å
143	T	25.2	Very low	29.5	Very low	115 Å²	115	150.1 Å²	150.1	71%	0.706	77%	0.771	S	S	*	*			trans	-69.6	87.9	155	53.9	0	0	0	0	106	P141 S145	P141-T143 VanDerWaalsContact C-N 3.27Å; P141-T143 PolarHBondContact O-N 3.39Å; T143-S145 PolarHBondContact O-N 2.88Å
144	C	24.7	Very low	29	Very low	118 Å²	118	147.1 Å²	147.1	80%	0.797	77%	0.769	S	S	*	*			trans	-74.8	85.9	168.9	-139.2	0	0	0	0	106.6	F142	F142-C144 PolarHBondContact O-N 2.74Å
145	S	25.7	Very low	28.8	Very low	90 Å²	90	149.4 Å²	149.4	63%	0.629	78%	0.775	S	S	*	*			trans	-61.6	128.1	162.3	-61.8	0	0	0	0	107	T143 S147	T143-S145 PolarHBondContact O-N 2.88Å; S145-S147 PolarHBondContact O-N 3.03Å
146	P	30.9	Very low	28.4	Very low	118 Å²	118	146.2 Å²	146.2	77%	0.766	77%	0.766	S	S	*	*			trans	-65.8	99.9	-177.9	25.9	-31.7	0	0	0	108.3	V148	P146-V148 VanDerWaalsContact C-N 3.29Å; P146-V148 PolarHBondContact O-N 2.93Å
147	S	28	Very low	27.9	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	77%	0.765	S	S	*	*			trans	-77.9	93.4	166.7	39.7	0	0	0	0	106.9	S145 Y149	S145-S147 PolarHBondContact O-N 3.03Å; S147-Y149 PolarHBondContact O-N 3.45Å
148	V	27.1	Very low	27.6	Very low	122 Å²	122	143.4 Å²	143.4	74%	0.739	76%	0.764	S	S	*	*			trans	-50.1	101.1	157.6	178.2	0	0	0	0	106.8	P146	P146-V148 VanDerWaalsContact C-N 3.29Å; P146-V148 PolarHBondContact O-N 2.93Å
149	Y	24.8	Very low	26.9	Very low	206 Å²	206	144.4 Å²	144.4	81%	0.808	76%	0.761	S	S	*	*			trans	-176.5	120	145.1	-98.3	-70	0	0	0	109.2	S147 L151	S147-Y149 PolarHBondContact O-N 3.45Å; Y149-L151 PolarHBondContact O-N 2.99Å
150	P	28.8	Very low	26.9	Very low	119 Å²	119	140.5 Å²	140.5	77%	0.773	76%	0.755	S	S	*	*			trans	-71.7	94.9	173.9	28.6	-31.4	0	0	0	109.1	S152	P150-S152 VanDerWaalsContact C-N 3.34Å; P150-S152 PolarHBondContact O-N 2.95Å
151	L	28.2	Very low	26.9	Very low	149 Å²	149	137.4 Å²	137.4	78%	0.78	75%	0.752	S	S	*	*			trans	-75.4	94	166	-90.5	154.7	0	0	0	108.1	Y149 R153	Y149-L151 PolarHBondContact O-N 2.99Å; L151-R153 PolarHBondContact O-N 2.95Å
152	S	24.9	Very low	26.5	Very low	113 Å²	113	142.8 Å²	142.8	79%	0.79	76%	0.762	S	S	*	*			trans	-55.8	82.8	158	22.2	0	0	0	0	109.4	P150	P150-S152 VanDerWaalsContact C-N 3.34Å; P150-S152 PolarHBondContact O-N 2.95Å
153	R	22.5	Very low	26.3	Very low	227 Å²	227	140 Å²	140	86%	0.857	76%	0.756	S	S	*	*			trans	-107.3	90.4	165.9	-100.5	-175.7	175.1	-144.1	-0.3	109.8	L151	L151-R153 PolarHBondContact O-N 2.95Å
154	S	24.1	Very low	26.4	Very low	103 Å²	103	139 Å²	139	72%	0.72	75%	0.749	S	S	*	*			trans	-42.4	128.6	155.6	-39.3	0	0	0	0	111.5
155	Q	27.8	Very low	26.6	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	75%	0.748	S	S	*	*			trans	55.1	102.4	147.1	-52.8	-166.1	11.9	0	0	118.3
156	S	23.8	Very low	26.5	Very low	93 Å²	93	144 Å²	144	65%	0.65	75%	0.752	S	S	*	*			trans	-133.3	103.8	141.9	59.9	0	0	0	0	108.5	Y158	S156-Y158 PolarHBondContact O-N 2.83Å
157	T	25.9	Very low	26.4	Very low	127 Å²	127	144 Å²	144	78%	0.779	75%	0.75	S	S	*	*			trans	-36.7	96.5	159.7	-49.6	0	0	0	0	109.9	N159	T157-N159 VanDerWaalsContact C-N 3.34Å; T157-N159 PolarHBondContact O-N 3.47Å; T157-N159 VanDerWaalsContact O-N 3.11Å
158	Y	24.9	Very low	26.3	Very low	207 Å²	207	144.4 Å²	144.4	81%	0.812	75%	0.748	S	S	*	*			trans	-73.1	105.3	158.3	-92.6	-89	0	0	0	105.6	S156 I160	S156-Y158 PolarHBondContact O-N 2.83Å; Y158-I160 PolarHBondContact O-N 3.18Å
159	N	24.4	Very low	26.3	Very low	122 Å²	122	145.4 Å²	145.4	65%	0.652	75%	0.749	S	S	*	*			trans	-55.5	98.3	174.2	-160.4	29	0	0	0	107.4	T157 D161	T157-N159 VanDerWaalsContact C-N 3.34Å; T157-N159 PolarHBondContact O-N 3.47Å; T157-N159 VanDerWaalsContact O-N 3.11Å; N159-D161 PolarHBondContact ND2-OD1 3.21Å; N159-D161 PolarHBondContact O-N 3.14Å
160	I	32.8	Very low	26.3	Very low	143 Å²	143	142.2 Å²	142.2	73%	0.733	75%	0.751	S	S	*	*			trans	-74	96.3	164.6	-60.4	173.8	0	0	0	103.5	Y158 Y162	Y158-I160 PolarHBondContact O-N 3.18Å; I160-Y162 PolarHBondContact O-N 2.98Å
161	D	27	Very low	26.3	Very low	125 Å²	125	141.9 Å²	141.9	67%	0.668	75%	0.747	S	S	*	*			trans	-53.5	106.7	173.1	-68.6	-39.9	0	0	0	107.8	N159 N163	N159-D161 PolarHBondContact ND2-OD1 3.21Å; N159-D161 PolarHBondContact O-N 3.14Å; D161-N163 PolarHBondContact O-N 2.89Å
162	Y	26.1	Very low	26.1	Very low	207 Å²	207	142 Å²	142	81%	0.812	75%	0.748	S	S	*	*			trans	-61.3	85.6	170.9	-96.2	-99.6	0	0	0	108.2	I160 T164	I160-Y162 PolarHBondContact O-N 2.98Å; Y162-T164 PolarHBondContact O-N 2.99Å
163	N	26	Very low	26.3	Very low	137 Å²	137	143 Å²	143	73%	0.733	75%	0.745	S	S	*	*			trans	-79.1	82.8	158.3	-111.2	-9.5	0	0	0	108	D161 Y165	D161-N163 PolarHBondContact O-N 2.89Å; N163-Y165 VanDerWaalsContact C-N 3.33Å; N163-Y165 PolarHBondContact O-N 2.93Å
164	T	26.2	Very low	26.4	Very low	93 Å²	93	139.7 Å²	139.7	57%	0.571	74%	0.744	S	S	*	*			trans	-53.5	90	168.4	-59.5	0	0	0	0	109.2	Y162 T166	Y162-T164 PolarHBondContact O-N 2.99Å; T164-T166 HydrophobicContact CG2-CG2 3.9Å
165	Y	29.6	Very low	26.7	Very low	197 Å²	197	139.7 Å²	139.7	77%	0.773	74%	0.744	S	S	*	*			trans	-91.1	92	150.8	-70.8	-75	0	0	0	106.7	N163 T167	N163-Y165 VanDerWaalsContact C-N 3.33Å; N163-Y165 PolarHBondContact O-N 2.93Å; Y165-T167 PolarHBondContact O-N 2.98Å
166	T	23.8	Very low	26.8	Very low	116 Å²	116	138.1 Å²	138.1	71%	0.712	74%	0.742	S	S	*	*			trans	-47.6	99.5	159.8	31.9	0	0	0	0	109.7	T164	T164-T166 HydrophobicContact CG2-CG2 3.9Å
167	T	28.6	Very low	26.9	Very low	119 Å²	119	136.6 Å²	136.6	73%	0.73	74%	0.741	S	S	*	*			trans	-113.1	95.6	154.6	-14.7	0	0	0	0	106.5	Y165 N169	Y165-T167 PolarHBondContact O-N 2.98Å; T167-N169 VanDerWaalsContact C-N 3.31Å; T167-N169 PolarHBondContact O-N 3.23Å
168	T	25.5	Very low	27	Very low	122 Å²	122	141.1 Å²	141.1	75%	0.748	74%	0.744	S	S	*	*			trans	-55.5	92.7	167.5	45.4	0	0	0	0	109.1
169	N	27.5	Very low	27.3	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	75%	0.745	S	S	*	*			trans	-119.4	95.8	157.2	-91.9	-26.8	0	0	0	107.3	T167 T171	T167-N169 VanDerWaalsContact C-N 3.31Å; T167-N169 PolarHBondContact O-N 3.23Å; N169-T171 PolarHBondContact O-N 2.86Å
170	T	24.2	Very low	27.5	Very low	140 Å²	140	140.3 Å²	140.3	86%	0.859	75%	0.748	S	S	*	*			trans	-59.7	83.5	167.6	-2.5	0	0	0	0	108.9
171	T	28.2	Very low	27.3	Very low	111 Å²	111	144.7 Å²	144.7	68%	0.681	76%	0.755	S	S	*	*			trans	-131.8	88.3	159.1	19.5	0	0	0	0	107.8	N169 N173	N169-T171 PolarHBondContact O-N 2.86Å; T171-N173 VanDerWaalsContact C-N 3.33Å; T171-N173 PolarHBondContact O-N 2.82Å
172	N	24.6	Very low	27.6	Very low	151 Å²	151	149 Å²	149	81%	0.807	76%	0.764	S	S	*	*			trans	-44.4	95.2	162.3	-81.2	-28.1	0	0	0	109.8
173	N	27.9	Very low	27.8	Very low	136 Å²	136	144 Å²	144	73%	0.727	76%	0.759	S	S	*	*			trans	-132	101.8	158.5	-82.1	-40.6	0	0	0	106.2	T171 S175	T171-N173 VanDerWaalsContact C-N 3.33Å; T171-N173 PolarHBondContact O-N 2.82Å; N173-S175 PolarHBondContact O-N 3.17Å
174	N	26.3	Very low	28	Very low	156 Å²	156	145.1 Å²	145.1	83%	0.834	77%	0.765	S	S	*	*			trans	-63.5	57.6	170	-72.5	-33.9	0	0	0	110.7	N176	N174-N176 VanDerWaalsContact C-N 3.26Å; N174-N176 PolarHBondContact O-N 3.04Å
175	S	29.1	Very low	28.1	Very low	103 Å²	103	145.2 Å²	145.2	72%	0.72	77%	0.769	S	S	*	*			trans	-75.4	92.4	163.2	54.6	0	0	0	0	106.1	N173 G177	N173-S175 PolarHBondContact O-N 3.17Å; S175-G177 VanDerWaalsContact C-N 3.32Å; S175-G177 PolarHBondContact O-N 3Å
176	N	29.5	Very low	28	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	77%	0.767	S	S	*	*			trans	-39.9	101.1	163.3	-76.4	-35	0	0	0	108	N174 R178	N174-N176 VanDerWaalsContact C-N 3.26Å; N174-N176 PolarHBondContact O-N 3.04Å; N176-R178 VanDerWaalsContact C-N 3.31Å; N176-R178 PolarHBondContact O-N 2.84Å
177	G	26.8	Very low	28.4	Very low	61 Å²	61	141.7 Å²	141.7	63%	0.629	77%	0.765	S	S	*	*			trans	-62.4	96.1	-176.3	0	0	0	0	0	107.8	S175 N179	S175-G177 VanDerWaalsContact C-N 3.32Å; S175-G177 PolarHBondContact O-N 3Å; G177-N179 VanDerWaalsContact C-N 3.29Å; G177-N179 PolarHBondContact O-N 2.93Å
178	R	28.9	Very low	28.7	Very low	221 Å²	221	142.6 Å²	142.6	83%	0.834	76%	0.764	S	S	*	*			trans	-62.3	102.8	165.9	-77.1	-175.9	-175	172.1	1.8	105	N176 H180	N176-R178 VanDerWaalsContact C-N 3.31Å; N176-R178 PolarHBondContact O-N 2.84Å; R178-H180 VanDerWaalsContact C-N 3.29Å; R178-H180 PolarHBondContact O-CD2 3.24Å; R178-H180 PolarHBondContact O-N 3.06Å
179	N	31.2	Very low	29.1	Very low	155 Å²	155	144.7 Å²	144.7	83%	0.829	77%	0.77	S	S	*	*			trans	-54.4	99.6	170.8	-73.8	-34.5	0	0	0	107.1	G177 R181	G177-N179 VanDerWaalsContact C-N 3.29Å; G177-N179 PolarHBondContact O-N 2.93Å; N179-R181 VanDerWaalsContact C-N 3.29Å; N179-R181 PolarHBondContact O-N 2.7Å
180	H	28.2	Very low	29.5	Very low	157 Å²	157	142.8 Å²	142.8	73%	0.727	76%	0.76	S	S	*	*			trans	-64	99.5	168.4	-70.8	-77.3	0	0	0	105.6	R178 Y182	R178-H180 VanDerWaalsContact C-N 3.29Å; R178-H180 PolarHBondContact O-CD2 3.24Å; R178-H180 PolarHBondContact O-N 3.06Å; H180-Y182 VanDerWaalsContact C-N 3.28Å; H180-Y182 PolarHBondContact O-N 2.73Å
181	R	28.5	Very low	30.3	Very low	235 Å²	235	144.2 Å²	144.2	89%	0.887	76%	0.762	S	S	*	*			trans	-58.6	104	161.3	-71	-177.5	177.9	-176.9	-0.4	104.7	N179 S183	N179-R181 VanDerWaalsContact C-N 3.29Å; N179-R181 PolarHBondContact O-N 2.7Å; R181-S183 VanDerWaalsContact C-N 3.35Å; R181-S183 PolarHBondContact O-N 2.97Å
182	Y	32.1	Very low	30.7	Very low	215 Å²	215	147 Å²	147	84%	0.843	77%	0.767	S	S	*	*			trans	-59.6	104	169.9	-72.4	-85.1	0	0	0	106.4	H180 N184	H180-Y182 VanDerWaalsContact C-N 3.28Å; H180-Y182 PolarHBondContact O-N 2.73Å; Y182-N184 PolarHBondContact O-N 3.18Å
183	S	30.2	Very low	31.2	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	77%	0.767	S	S	*	*			trans	-60.4	119.1	164.4	-66.2	0	0	0	0	106.6	R181 C185	R181-S183 VanDerWaalsContact C-N 3.35Å; R181-S183 PolarHBondContact O-N 2.97Å; S183-C185 PolarHBondContact O-N 2.73Å
184	N	31.4	Very low	31.8	Very low	161 Å²	161	147.2 Å²	147.2	86%	0.861	77%	0.77	S	S	*	*			trans	-74.2	51.8	179.1	-164.1	28.7	0	0	0	110.3	Y182 G186	Y182-N184 PolarHBondContact O-N 3.18Å; N184-G186 VanDerWaalsContact C-N 3.33Å; N184-G186 PolarHBondContact O-N 2.76Å
185	C	28.7	Very low	32.5	Very low	95 Å²	95	144.6 Å²	144.6	64%	0.642	76%	0.76	S	S	*	*			trans	-101.2	58.3	177.6	-59.3	0	0	0	0	108.2	S183 Y187	S183-C185 PolarHBondContact O-N 2.73Å; C185-Y187 VanDerWaalsContact C-N 3.28Å; C185-Y187 HydrophobicContact CB-CD2 4.42Å; C185-Y187 HydrophobicContact CB-CE2 4.5Å; C185-Y187 PolarHBondContact O-N 2.68Å
186	G	27	Very low	33.4	Very low	72 Å²	72	147.2 Å²	147.2	74%	0.742	77%	0.766	S	S	*	*			trans	-84.9	71.2	169.5	0	0	0	0	0	109.6	N184	N184-G186 VanDerWaalsContact C-N 3.33Å; N184-G186 PolarHBondContact O-N 2.76Å
187	Y	31.2	Very low	34.3	Very low	166 Å²	166	148 Å²	148	65%	0.651	76%	0.764	S	S	*	*			trans	-81.3	124.8	171	-72.6	-84.3	0	0	0	109.5	C185 L189	C185-Y187 VanDerWaalsContact C-N 3.28Å; C185-Y187 HydrophobicContact CB-CD2 4.42Å; C185-Y187 HydrophobicContact CB-CE2 4.5Å; C185-Y187 PolarHBondContact O-N 2.68Å; Y187-L189 PolarHBondContact O-N 2.96Å; Y187-L189 VanDerWaalsContact O-N 3.09Å
188	L	34.7	Very low	34.9	Very low	139 Å²	139	151.7 Å²	151.7	73%	0.728	76%	0.76	S	S	*	*			trans	-56.1	111.8	164	-119.5	76.1	0	0	0	106.5	N190	L188-N190 PolarHBondContact O-N 2.66Å
189	L	35.8	Very low	35.5	Very low	165 Å²	165	146.8 Å²	146.8	86%	0.864	75%	0.749	S	S	*	*			trans	-66.8	70.4	162.3	-77.6	152.5	0	0	0	107.8	Y187	Y187-L189 PolarHBondContact O-N 2.96Å; Y187-L189 VanDerWaalsContact O-N 3.09Å
190	N	35.8	Very low	36	Very low	104 Å²	104	144.8 Å²	144.8	56%	0.556	74%	0.739	S	S	*	*			trans	-67.6	140.6	150	-65.3	-28.5	0	0	0	105.1	L188 E192	L188-N190 PolarHBondContact O-N 2.66Å; N190-E192 PolarHBondContact O-N 3Å
191	N	39.7	Very low	36.8	Very low	170 Å²	170	142.6 Å²	142.6	91%	0.909	73%	0.732	S	S	*	*	S	Bend	trans	-62.2	27.7	-169.4	-67.5	-15.9	0	0	0	116.2	Q193	N191-Q193 PolarHBondContact O-N 3.04Å
192	E	36.6	Very low	37.6	Very low	168 Å²	168	136.1 Å²	136.1	79%	0.785	72%	0.722	S	S	*	*			trans	-78	119.9	168.8	-79.2	172.2	158.9	0	0	108.3	N190	N190-E192 PolarHBondContact O-N 3Å
193	Q	36.5	Very low	38.1	Very low	170 Å²	170	131 Å²	131	79%	0.794	71%	0.709	S	S	*	*			trans	-52.2	135.2	171.4	-70.7	-178.1	-34.2	0	0	108.2	N191 T195	N191-Q193 PolarHBondContact O-N 3.04Å; Q193-T195 PolarHBondContact O-N 3.37Å
194	P	40.3	Very low	38.6	Very low	123 Å²	123	132 Å²	132	80%	0.799	71%	0.706	S	S	*	*			trans	-57.4	107.4	172.7	24.3	-31.3	0	0	0	107.1
195	T	40.7	Very low	39.1	Very low	100 Å²	100	129.2 Å²	129.2	61%	0.613	69%	0.694	S	S	*	*			trans	-66	140.9	168.8	45.5	0	0	0	0	107.1	Q193 E197	Q193-T195 PolarHBondContact O-N 3.37Å; T195-E197 PolarHBondContact O-N 2.75Å
196	D	47.9	Very low	39.8	Very low	158 Å²	158	129.6 Å²	129.6	85%	0.845	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-59.7	5.6	-171.7	-63.9	-39.3	0	0	0	115.2	Y198	D196-Y198 VanDerWaalsContact C-N 3.31Å; D196-Y198 PolarHBondContact O-N 3.09Å
197	E	47.6	Very low	40.3	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-84.5	3.9	-173.7	-152	169.5	-161.7	0	0	113.7	T195	T195-E197 PolarHBondContact O-N 2.75Å
198	Y	40.1	Very low	40.7	Very low	139 Å²	139	131.5 Å²	131.5	55%	0.545	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-117.6	20.9	-170.9	-110.8	-86.7	0	0	0	115.9	D196	D196-Y198 VanDerWaalsContact C-N 3.31Å; D196-Y198 PolarHBondContact O-N 3.09Å
199	I	41.8	Very low	41	Very low	118 Å²	118	132.6 Å²	132.6	61%	0.605	69%	0.689	S	S	*	*	S	Bend	trans	-88.6	-20.4	174.4	-59.6	179.4	0	0	0	111.8
200	D	41.3	Very low	41.2	Very low	114 Å²	114	134.6 Å²	134.6	61%	0.61	69%	0.687	S	S	*	*	H	α-helix	trans	-79.2	-27.7	-170.6	-72.9	-9.9	0	0	0	114.5	C202 L203 L204	D200-C202 VanDerWaalsContact C-N 3.31Å; D200-C202 PolarHBondContact O-N 2.92Å; D200-L203 PolarHBondContact O-N 3.14Å; D200-L204 PolarHBondContact O-N 3.27Å
201	D	45.2	Very low	41.3	Very low	110 Å²	110	137.8 Å²	137.8	59%	0.588	70%	0.699	S	S	*	*	H	α-helix	trans	-69.9	-27.3	-177.9	-80.2	-5.1	0	0	0	113.3	L203	D201-L203 VanDerWaalsContact C-N 3.34Å
202	C	45.8	Very low	41.3	Very low	100 Å²	100	137.1 Å²	137.1	68%	0.676	69%	0.694	S	S	*	*	H	α-helix	trans	-77.8	-21.1	177.1	-66.3	0	0	0	0	112.7	D200	D200-C202 VanDerWaalsContact C-N 3.31Å; D200-C202 PolarHBondContact O-N 2.92Å
203	L	42.4	Very low	41.6	Very low	108 Å²	108	137.8 Å²	137.8	57%	0.565	69%	0.694	S	S	*	*	H	α-helix	trans	-90.3	-21.8	-178.2	-67.5	176.8	0	0	0	112.8	D200 D201 T205	D200-L203 PolarHBondContact O-N 3.14Å; D201-L203 VanDerWaalsContact C-N 3.34Å; L203-T205 PolarHBondContact O-N 2.89Å
204	L	39.8	Very low	42.1	Very low	124 Å²	124	137 Å²	137	65%	0.649	70%	0.695	S	S	*	*	H	α-helix	trans	-67.9	-22	177.7	-108.8	92.6	0	0	0	113.7	D200 D206	D200-L204 PolarHBondContact O-N 3.27Å; L204-D206 PolarHBondContact O-N 2.87Å
205	T	42.8	Very low	42.3	Very low	102 Å²	102	138.2 Å²	138.2	63%	0.626	69%	0.694	S	S	*	*	H	α-helix	trans	-80.4	-15.1	-175.8	-8.2	0	0	0	0	114.2	L203	L203-T205 PolarHBondContact O-N 2.89Å
206	D	42.3	Very low	42.4	Very low	103 Å²	103	139.2 Å²	139.2	55%	0.551	70%	0.695	S	S	*	*	H	α-helix	trans	-95.7	-14.9	-177	-76.6	-7.2	0	0	0	113.6	L204 Y210	L204-D206 PolarHBondContact O-N 2.87Å; D206-Y210 WeakPolarHBondContact O-CD2 3.25Å
207	I	38.4	Very low	42	Very low	115 Å²	115	137.5 Å²	137.5	59%	0.59	69%	0.686	S	S	*	*	H	α-helix	trans	-73.7	-35.9	-177.5	-62.9	175.3	0	0	0	111.9	Q209 Y210	I207-Q209 PolarHBondContact O-N 3.11Å; I207-Y210 PolarHBondContact O-N 3.04Å
208	E	39.4	Very low	41.7	Very low	163 Å²	163	135.2 Å²	135.2	76%	0.762	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-68	-18.8	-179.1	-68.5	-169.8	168.8	0	0	113.5
209	Q	41.4	Very low	41.6	Very low	161 Å²	161	134 Å²	134	75%	0.752	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-83.1	-13	177	-68	-163.7	16	0	0	114.2	I207	I207-Q209 PolarHBondContact O-N 3.11Å
210	Y	39	Very low	41.7	Very low	207 Å²	207	135 Å²	135	81%	0.812	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-86.4	-7.1	178	-78.1	-76.5	0	0	0	114.5	D206 I207	D206-Y210 WeakPolarHBondContact O-CD2 3.25Å; I207-Y210 PolarHBondContact O-N 3.04Å
211	Q	38.4	Very low	41.5	Very low	172 Å²	172	137.4 Å²	137.4	80%	0.804	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-87.5	-2.4	177.8	-80.9	178.1	-2.3	0	0	115.2
212	L	39.2	Very low	41.4	Very low	155 Å²	155	136.9 Å²	136.9	81%	0.812	69%	0.685	S	S	*	*	S	Bend	trans	-111.1	21.9	-168.8	-132	112.5	0	0	0	117
213	K	44.3	Very low	41.1	Very low	182 Å²	182	137.3 Å²	137.3	79%	0.791	68%	0.681	S	S	*	*	S	Bend	trans	-132.5	23.4	-176.2	-124.5	169.5	-172.7	174.6	0	117.6
214	L	45.3	Very low	40.9	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	69%	0.688	S	S	*	*	S	Bend	trans	-98.9	-14.5	172.9	-78.4	168.8	0	0	0	115.5	I216	L214-I216 PolarHBondContact O-N 2.77Å
215	D	45.8	Very low	40.8	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	7.6	-171.6	-68.4	-10.6	0	0	0	116.4
216	I	42	Very low	40.6	Very low	122 Å²	122	139.9 Å²	139.9	63%	0.626	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-20.3	-176.2	-57.8	179.6	0	0	0	113.5	L214	L214-I216 PolarHBondContact O-N 2.77Å
217	N	39.6	Very low	40.3	Very low	121 Å²	121	140.4 Å²	140.4	65%	0.647	69%	0.689	S	S	*	*	S	Bend	trans	-92.6	-18.7	-170.9	-82.9	-14.2	0	0	0	116.1
218	D	42.2	Very low	40.3	Very low	122 Å²	122	141.4 Å²	141.4	65%	0.652	69%	0.694	S	S	*	*	H	α-helix	trans	-75.8	-28.5	-179.2	-73.6	-13.5	0	0	0	112.7	Q220	D218-Q220 PolarHBondContact O-N 2.71Å
219	N	38.3	Very low	40.3	Very low	114 Å²	114	140.6 Å²	140.6	61%	0.61	70%	0.695	S	S	*	*	H	α-helix	trans	-75.6	-23.4	179.7	-75.9	-28.7	0	0	0	114.1
220	Q	43.1	Very low	39.8	Very low	139 Å²	139	141.2 Å²	141.2	65%	0.65	70%	0.695	S	S	*	*	H	α-helix	trans	-79	-28.9	176.7	-70.8	-161.1	-7.6	0	0	112.8	D218	D218-Q220 PolarHBondContact O-N 2.71Å
221	K	37.8	Very low	39.5	Very low	164 Å²	164	137.6 Å²	137.6	71%	0.713	69%	0.694	S	S	*	*	H	α-helix	trans	-73	-31.7	177.9	-126.9	178.2	-177.5	-178.5	0	112.6
222	I	42.9	Very low	39	Very low	99 Å²	99	138.6 Å²	138.6	51%	0.508	70%	0.696	S	S	.	*	H	α-helix	trans	-70.8	-34.7	177.2	-62.9	174.1	0	0	0	111.5	Q224 L225	I222-Q224 VanDerWaalsContact C-N 3.33Å; I222-Q224 PolarHBondContact O-N 2.92Å; I222-L225 PolarHBondContact O-N 2.75Å
223	N	38.3	Very low	38.5	Very low	109 Å²	109	136.8 Å²	136.8	58%	0.583	69%	0.691	S	S	*	*	H	α-helix	trans	-74.2	-19.2	179.9	-78.5	-21	0	0	0	114.5
224	Q	37.7	Very low	37.6	Very low	155 Å²	155	134.3 Å²	134.3	72%	0.724	69%	0.692	S	S	*	*	H	α-helix	trans	-80.8	-27.2	173.7	-71.8	-168	3	0	0	113.2	I222	I222-Q224 VanDerWaalsContact C-N 3.33Å; I222-Q224 PolarHBondContact O-N 2.92Å
225	L	39.2	Very low	36.8	Very low	127 Å²	127	134.4 Å²	134.4	67%	0.665	70%	0.699	S	S	*	*	H	α-helix	trans	-73.9	-29.3	175.7	-89.8	150.1	0	0	0	112.7	I222 N227	I222-L225 PolarHBondContact O-N 2.75Å; L225-N227 VanDerWaalsContact C-N 3.3Å; L225-N227 PolarHBondContact O-N 2.67Å
226	N	38.9	Very low	35.9	Very low	105 Å²	105	133 Å²	133	56%	0.561	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-5.1	-179.8	-73.8	-15.4	0	0	0	115.1
227	N	35	Very low	35.1	Very low	115 Å²	115	132.3 Å²	132.3	62%	0.615	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-5.4	179.9	-96.7	-10.3	0	0	0	114.7	L225	L225-N227 VanDerWaalsContact C-N 3.3Å; L225-N227 PolarHBondContact O-N 2.67Å
228	I	39.4	Very low	34.7	Very low	135 Å²	135	132.2 Å²	132.2	69%	0.692	71%	0.711	S	S	*	*	S	Bend	trans	-81.2	-25.3	177	-61.8	177.8	0	0	0	111.4	K230	I228-K230 PolarHBondContact O-N 2.81Å
229	D	37.7	Very low	33.8	Very low	146 Å²	146	132 Å²	132	78%	0.781	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-6.7	-178.4	-75.3	-22.8	0	0	0	115.2
230	K	32.4	Very low	33.5	Very low	174 Å²	174	132.1 Å²	132.1	76%	0.757	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-0.1	-176.4	-85.2	-175.4	177.4	177	0	116.5	I228	I228-K230 PolarHBondContact O-N 2.81Å
231	V	31.1	Very low	32.6	Very low	131 Å²	131	132.2 Å²	132.2	79%	0.794	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	12.1	-179.8	-169.4	0	0	0	0	112.9
232	K	29.6	Very low	32.4	Very low	194 Å²	194	129.3 Å²	129.3	84%	0.843	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	3	-178.2	-151.6	172.4	179.3	178.4	0	116.4
233	T	27.3	Very low	31.8	Very low	116 Å²	116	129.4 Å²	129.4	71%	0.712	75%	0.746	S	S	*	*	S	Bend	trans	-143.2	83.9	-175.4	43.5	0	0	0	0	112.9
234	T	25.8	Very low	31.2	Very low	131 Å²	131	129.6 Å²	129.6	80%	0.804	76%	0.756	S	S	*	*			trans	177.8	92.6	141.8	27.5	0	0	0	0	109.9
235	T	29.7	Very low	31	Very low	155 Å²	155	127.7 Å²	127.7	95%	0.951	76%	0.759	S	S	*	*			trans	-149.4	89.5	148	-8.5	0	0	0	0	107.3
236	T	25.2	Very low	30.3	Very low	120 Å²	120	128 Å²	128	74%	0.736	77%	0.767	S	S	*	*			trans	-74.7	147.1	176.3	-16.6	0	0	0	0	109.7
237	S	26	Very low	29.9	Very low	107 Å²	107	128 Å²	128	75%	0.748	78%	0.775	S	S	*	*			trans	65.2	102.2	156.7	62.6	0	0	0	0	119.2
238	S	31.2	Very low	29.6	Very low	119 Å²	119	127.3 Å²	127.3	83%	0.832	78%	0.779	S	S	*	*				-164.3	119	117.1	29.5	0	0	0	0	109.7
239	S	23.7	Very low	29	Very low	117 Å²	117	126.2 Å²	126.2	82%	0.818	78%	0.784	S	S	*	*			trans	-75.9	139.1	177.2	-41.8	0	0	0	0	110.1
240	P	32.4	Very low	28.8	Very low	117 Å²	117	125.2 Å²	125.2	76%	0.76	79%	0.788	S	S	*	*				-134.1	129.7	129.7	24.1	-6.6	0	0	0	111.4
241	T	24.4	Very low	28.7	Very low	141 Å²	141	122.6 Å²	122.6	87%	0.865	79%	0.792	S	S	*	*			trans	-75.8	123.5	178.6	-29.3	0	0	0	0	109.9
242	S	31.8	Very low	28.9	Very low	103 Å²	103	122.3 Å²	122.3	72%	0.72	79%	0.793	S	S	*	*			trans	-151.5	111.8	161.3	13.6	0	0	0	0	111.7
243	S	30.3	Very low	29.3	Very low	101 Å²	101	118.6 Å²	118.6	71%	0.706	79%	0.791	S	S	*	*			trans	42.1	106.6	140.3	58.1	0	0	0	0	120.7
244	S	26.2	Very low	29.7	Very low	112 Å²	112	119.3 Å²	119.3	78%	0.783	80%	0.795	S	S	*	*				38.1	113.1	122.7	64.1	0	0	0	0	120.1
245	S	33.4	Very low	30.1	Very low	115 Å²	115	119 Å²	119	80%	0.804	79%	0.789	S	S	*	*				-169.1	117.8	126.7	49.2	0	0	0	0	110.8
246	T	24.6	Very low	30.7	Very low	134 Å²	134	117.4 Å²	117.4	82%	0.822	78%	0.784	S	S	*	*			trans	-45.8	146.8	160.9	30.4	0	0	0	0	113.7
247	S	30.4	Very low	31.4	Very low	105 Å²	105	118.7 Å²	118.7	73%	0.734	79%	0.786	S	S	*	*				163.6	127.5	124.1	-63.3	0	0	0	0	113.1
248	S	29.5	Very low	31.9	Very low	100 Å²	100	123.2 Å²	123.2	70%	0.699	79%	0.793	S	S	*	*			trans	45.6	108.8	137.9	60.6	0	0	0	0	120.2
249	S	27.6	Very low	32.5	Very low	113 Å²	113	123 Å²	123	79%	0.79	79%	0.786	S	S	*	*				75.2	114.3	86.3	76.6	0	0	0	0	116
250	S	33.2	Very low	33.2	Very low	124 Å²	124	122.9 Å²	122.9	87%	0.867	79%	0.785	S	S	*	*			trans	-176.8	131.4	136.1	45.5	0	0	0	0	111
251	S	29.7	Very low	33.3	Very low	119 Å²	119	124 Å²	124	83%	0.832	79%	0.785	S	S	*	*			trans	-75.3	179.5	-172	-51.1	0	0	0	0	113.8
252	P	35	Very low	33.8	Very low	126 Å²	126	124.7 Å²	124.7	82%	0.818	78%	0.784	S	S	*	*			trans	-92.3	154.7	-156.5	38.1	-34.5	0	0	0	114.1
253	S	38.8	Very low	34.1	Very low	116 Å²	116	127.7 Å²	127.7	81%	0.811	79%	0.788	S	S	*	*			trans	-99.5	120.1	170.6	51.4	0	0	0	0	111.5
254	T	34.1	Very low	34.4	Very low	130 Å²	130	127.7 Å²	127.7	80%	0.798	79%	0.788	S	S	*	*			trans	-47.7	174.7	154.6	56.9	0	0	0	0	110.9
255	D	35	Very low	34.7	Very low	126 Å²	126	131.5 Å²	131.5	67%	0.674	79%	0.794	S	S	*	*			cis	179.2	142.1	23.8	-161	-23	0	0	0	103.8
256	S	42.8	Very low	34.7	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	80%	0.796	S	S	*	*			trans	-178.3	61.3	153.7	-76.2	0	0	0	0	108.9	F258	S256-F258 PolarHBondContact O-N 3.49Å
257	D	39	Very low	35.1	Very low	148 Å²	148	132.9 Å²	132.9	79%	0.791	80%	0.795	S	S	*	*			trans	-68.9	112.7	165.4	-75.8	-30.8	0	0	0	108.8	V259	D257-V259 PolarHBondContact O-N 2.67Å
258	F	37.7	Very low	35.1	Very low	202 Å²	202	134 Å²	134	89%	0.886	80%	0.797	S	S	*	*			trans	-69.6	118.6	178.7	-150.2	-98.4	0	0	0	109.4	S256 S260	S256-F258 PolarHBondContact O-N 3.49Å; F258-S260 PolarHBondContact O-N 2.97Å
259	V	42.2	Very low	35.1	Very low	115 Å²	115	134.8 Å²	134.8	70%	0.697	80%	0.803	S	S	*	*			trans	-56	117.4	-174.3	179.4	0	0	0	0	111.6	D257	D257-V259 PolarHBondContact O-N 2.67Å
260	S	40	Very low	34.9	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	81%	0.806	S	S	*	*			trans	-86.9	111.3	162.6	-62.7	0	0	0	0	108.3	F258 D262	F258-S260 PolarHBondContact O-N 2.97Å; S260-D262 PolarHBondContact O-N 3.15Å; S260-D262 VanDerWaalsContact O-N 3.11Å
261	N	34.3	Very low	34.9	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	80%	0.804	S	S	*	*			trans	-72.5	97.5	175.7	-112.2	36.8	0	0	0	109.6	M263	N261-M263 PolarHBondContact O-N 2.9Å
262	D	35.3	Very low	34.6	Very low	157 Å²	157	134.3 Å²	134.3	84%	0.84	80%	0.801	S	S	*	*			trans	-88.2	96.4	167.5	-163.8	4.6	0	0	0	108.3	S260 S264	S260-D262 PolarHBondContact O-N 3.15Å; S260-D262 VanDerWaalsContact O-N 3.11Å; D262-S264 PolarHBondContact O-N 2.82Å
263	M	37.9	Very low	34.5	Very low	166 Å²	166	137.7 Å²	137.7	82%	0.818	80%	0.803	S	S	*	*			trans	-81.7	100.6	178.9	-158.6	97.2	81.5	0	0	109	N261	N261-M263 PolarHBondContact O-N 2.9Å
264	S	36.6	Very low	33.8	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	80%	0.797	S	S	*	*			trans	-50.5	147	179.4	52.8	0	0	0	0	115.9	D262	D262-S264 PolarHBondContact O-N 2.82Å
265	Q	32.1	Very low	33.4	Very low	192 Å²	192	135.8 Å²	135.8	90%	0.897	80%	0.795	S	S	*	*			trans	-56.5	137.6	174.6	-54.1	-179.5	11.3	0	0	113.4
266	L	33	Very low	32.9	Very low	164 Å²	164	135.7 Å²	135.7	86%	0.859	80%	0.799	S	S	*	*			trans	-97.8	109.4	167	-134.7	85	0	0	0	109.2
267	S	32.7	Very low	32	Very low	114 Å²	114	135 Å²	135	80%	0.797	79%	0.794	S	S	*	*			trans	-89.3	121.8	167.3	53.3	0	0	0	0	109.5
268	T	31.9	Very low	31.4	Very low	128 Å²	128	133.1 Å²	133.1	79%	0.785	79%	0.793	S	S	*	*			trans	-132.6	130.7	166.1	-31.3	0	0	0	0	110.4
269	S	28.1	Very low	30.7	Very low	117 Å²	117	128.2 Å²	128.2	82%	0.818	78%	0.783	S	S	*	*			trans	-70.8	162.9	-164.1	-51.4	0	0	0	0	115.9
270	A	23.8	Very low	29.7	Very low	102 Å²	102	128.5 Å²	128.5	84%	0.843	79%	0.791	S	S	*	*			trans	-61.8	137.8	174.3	0	0	0	0	0	114.3
271	S	33	Very low	28.9	Very low	120 Å²	120	128 Å²	128	84%	0.839	79%	0.787	S	S	*	*			trans	-142.7	111	154	58.5	0	0	0	0	109.7
272	T	23.8	Very low	28.3	Very low	123 Å²	123	126.9 Å²	126.9	76%	0.755	79%	0.79	S	S	*	*			trans	-71.2	132.4	168.1	-53.8	0	0	0	0	109.7
273	F	32.5	Very low	27.8	Very low	198 Å²	198	125.4 Å²	125.4	87%	0.868	79%	0.787	S	S	*	*			trans	-171.9	118.3	140.8	-91	-64.4	0	0	0	111.4
274	S	24.3	Very low	27	Very low	98 Å²	98	124.9 Å²	124.9	69%	0.685	79%	0.787	S	S	*	*			trans	43.7	117.1	133.6	-62	0	0	0	0	123
275	S	26	Very low	26.4	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	79%	0.79	S	S	*	*				90.1	131.7	123.9	-53.5	0	0	0	0	121.2
276	T	24.4	Very low	26	Very low	125 Å²	125	123.9 Å²	123.9	77%	0.767	78%	0.784	S	S	*	*			trans	87	91.7	147.4	9.6	0	0	0	0	118.7
277	S	23.7	Very low	25.7	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	78%	0.779	S	S	*	*			trans	12.5	118.1	132.4	53	0	0	0	0	118.6
278	S	25.7	Very low	25.4	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	78%	0.782	S	S	*	*				-174.3	140.6	128.9	27.5	0	0	0	0	111.8
279	S	23.1	Very low	25.3	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	78%	0.781	S	S	*	*			trans	61	96.5	153.5	46.1	0	0	0	0	119.9
280	S	21.4	Very low	25.5	Very low	121 Å²	121	129.1 Å²	129.1	85%	0.846	77%	0.773	S	S	*	*				11.1	108.7	125.3	55.5	0	0	0	0	117.6
281	S	22.7	Very low	25.9	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	77%	0.768	S	S	*	*			trans	-143.1	114.2	145.7	65.6	0	0	0	0	109.4	T283	S281-T283 PolarHBondContact O-N 3.42Å
282	S	22.4	Very low	26	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	75%	0.754	S	S	*	*			trans	-66.1	107.8	175	48.3	0	0	0	0	109.6
283	T	23.8	Very low	26.5	Very low	126 Å²	126	130.9 Å²	130.9	77%	0.773	76%	0.755	S	S	*	*			trans	-99	108.9	168.8	31.4	0	0	0	0	108.8	S281 Q285	S281-T283 PolarHBondContact O-N 3.42Å; T283-Q285 PolarHBondContact O-N 2.87Å
284	N	22.5	Very low	26.6	Very low	154 Å²	154	129.3 Å²	129.3	82%	0.824	75%	0.748	S	S	*	*			trans	-60	115.4	175.7	-80	-43.8	0	0	0	110.2	S286	N284-S286 PolarHBondContact O-N 2.76Å; N284-S286 VanDerWaalsContact O-N 3.11Å
285	Q	23.9	Very low	27	Very low	162 Å²	162	134 Å²	134	76%	0.757	75%	0.752	S	S	*	*			trans	-72.9	97.2	167.5	-71.1	-172.2	-9.4	0	0	108.7	T283 Y287	T283-Q285 PolarHBondContact O-N 2.87Å; Q285-Y287 PolarHBondContact O-N 2.72Å
286	S	23.9	Very low	27.4	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	75%	0.751	S	S	*	*			trans	-76.7	110.8	166.4	-78.3	0	0	0	0	108.9	N284 Q288	N284-S286 PolarHBondContact O-N 2.76Å; N284-S286 VanDerWaalsContact O-N 3.11Å; S286-Q288 PolarHBondContact O-N 3.48Å
287	Y	26.3	Very low	27.9	Very low	196 Å²	196	136.5 Å²	136.5	77%	0.769	75%	0.747	S	S	*	*			trans	-67.5	106.5	166.7	-70.6	-90.5	0	0	0	108.6	Q285 I289	Q285-Y287 PolarHBondContact O-N 2.72Å; Y287-I289 PolarHBondContact O-N 2.72Å
288	Q	26.8	Very low	28.5	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	75%	0.748	S	S	*	*			trans	-78.4	97.2	164.9	-75.9	-172.6	-7.3	0	0	107.9	S286 T290	S286-Q288 PolarHBondContact O-N 3.48Å; Q288-T290 PolarHBondContact O-N 2.9Å
289	I	29	Very low	29	Very low	148 Å²	148	142.3 Å²	142.3	76%	0.759	75%	0.746	S	S	*	*			trans	-71	113.3	166.2	-62.8	171.9	0	0	0	105.8	Y287 D291	Y287-I289 PolarHBondContact O-N 2.72Å; I289-D291 PolarHBondContact O-N 3.34Å
290	T	33.1	Very low	29.5	Very low	107 Å²	107	145.4 Å²	145.4	66%	0.656	75%	0.75	S	S	*	*			trans	-71.1	112.1	-179.2	37.4	0	0	0	0	110	Q288 S292	Q288-T290 PolarHBondContact O-N 2.9Å; T290-S292 PolarHBondContact O-N 2.82Å
291	D	32.6	Very low	30	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	30	176.1	-71.9	-43.8	0	0	0	114.9	I289 H293	I289-D291 PolarHBondContact O-N 3.34Å; D291-H293 PolarHBondContact O-N 2.73Å
292	S	34	Very low	30.6	Very low	78 Å²	78	149.2 Å²	149.2	55%	0.545	75%	0.746	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.7	-14.3	-176.7	65.2	0	0	0	0	114.1	T290	T290-S292 PolarHBondContact O-N 2.82Å
293	H	33.8	Very low	31	Very low	168 Å²	168	149 Å²	149	78%	0.778	74%	0.744	S	S	*	*	S	Bend	trans	-86.9	-17.9	-178.4	-84.5	-72.9	0	0	0	115	D291	D291-H293 PolarHBondContact O-N 2.73Å
294	F	35.7	Very low	31.5	Very low	165 Å²	165	152.3 Å²	152.3	72%	0.724	75%	0.747	S	S	*	*	S	Bend	trans	-89.5	-13.9	-177.6	-86.8	-78.2	0	0	0	114.8
295	Y	31.4	Very low	32.1	Very low	195 Å²	195	150 Å²	150	77%	0.765	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-19	-172.6	-141.1	-92.4	0	0	0	114.4
296	N	34.2	Very low	32.6	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-22	-176.5	-81.8	-26	0	0	0	114.5
297	E	36.1	Very low	32.9	Very low	146 Å²	146	152 Å²	152	68%	0.682	75%	0.749	S	S	*	*	H	α-helix	trans	-76.2	-31.2	179	-101.8	-175.1	162.5	0	0	113.1	K299 Q300	E297-K299 VanDerWaalsContact C-N 3.29Å; E297-K299 PolarHBondContact O-N 2.9Å; E297-Q300 PolarHBondContact O-N 3.07Å
298	F	35.3	Very low	33.3	Very low	170 Å²	170	147.8 Å²	147.8	75%	0.746	75%	0.748	S	S	*	*	H	α-helix	trans	-68.7	-26.4	-174.3	-147.5	-93.4	0	0	0	113.3
299	K	36.6	Very low	33.8	Very low	166 Å²	166	145.9 Å²	145.9	72%	0.722	74%	0.744	S	S	*	*	H	α-helix	trans	-78.1	-24.1	177.2	-92.3	-174.2	177.2	179.2	0	114.2	E297	E297-K299 VanDerWaalsContact C-N 3.29Å; E297-K299 PolarHBondContact O-N 2.9Å
300	Q	33.8	Very low	34	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	75%	0.746	S	S	*	*	H	α-helix	trans	-78.9	-26.4	180	-104.9	-174.9	38.7	0	0	113.2	E297 Q302	E297-Q300 PolarHBondContact O-N 3.07Å; Q300-Q302 VanDerWaalsContact C-N 3.3Å; Q300-Q302 PolarHBondContact O-N 3.31Å
301	L	31.6	Very low	34.1	Very low	137 Å²	137	147.9 Å²	147.9	72%	0.717	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-76.8	-15.3	-179.2	-67.2	175.9	0	0	0	113.8	C303	L301-C303 VanDerWaalsContact C-N 3.33Å; L301-C303 PolarHBondContact O-N 2.8Å
302	Q	35.9	Very low	34	Very low	166 Å²	166	146.6 Å²	146.6	78%	0.776	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-80.3	-12.6	-179.6	-144.3	175.6	4.9	0	0	113.8	Q300	Q300-Q302 VanDerWaalsContact C-N 3.3Å; Q300-Q302 PolarHBondContact O-N 3.31Å
303	C	30.2	Very low	33.9	Very low	113 Å²	113	149.6 Å²	149.6	76%	0.764	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-93.6	0.1	-173.3	-70.1	0	0	0	0	115.7	L301	L301-C303 VanDerWaalsContact C-N 3.33Å; L301-C303 PolarHBondContact O-N 2.8Å
304	K	34.4	Very low	33.7	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	77%	0.765	S	S	*	*	S	Bend	trans	-107.6	1.6	-171.9	-98.5	175.1	176.3	175.5	0	117.4
305	S	35.8	Very low	33.8	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	77%	0.765	S	S	*	*			trans	-115.8	45.6	-172.5	-45.8	0	0	0	0	114.2
306	K	34.3	Very low	34.2	Very low	205 Å²	205	141.4 Å²	141.4	89%	0.891	77%	0.765	S	S	*	*			trans	-122.2	51.2	167.5	-69.1	-173.2	179.8	180	0	111.3	S308	K306-S308 PolarHBondContact O-N 2.71Å
307	S	30.5	Very low	34.4	Very low	108 Å²	108	140.4 Å²	140.4	76%	0.755	76%	0.759	S	S	*	*			trans	-85	96.3	157.7	61.9	0	0	0	0	107.4	L309	S307-L309 PolarHBondContact O-N 3.05Å
308	S	34.5	Very low	34.4	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	76%	0.76	S	S	*	*			trans	-61.2	102.7	167.8	50.1	0	0	0	0	108.2	K306 N310	K306-S308 PolarHBondContact O-N 2.71Å; S308-N310 PolarHBondContact O-N 2.87Å; S308-N310 VanDerWaalsContact O-N 3.1Å
309	L	36.2	Very low	34.2	Very low	143 Å²	143	139.9 Å²	139.9	75%	0.749	76%	0.76	S	S	*	*			trans	-70.3	103	171.6	-158.6	86.9	0	0	0	106.6	S307 L311	S307-L309 PolarHBondContact O-N 3.05Å; L309-L311 VanDerWaalsContact C-N 3.34Å; L309-L311 HydrophobicContact CD2-CD1 4.41Å; L309-L311 HydrophobicContact CD2-CG 4.37Å; L309-L311 PolarHBondContact O-N 3.18Å
310	N	33.7	Very low	34.1	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	76%	0.757	S	S	*	*			trans	-66.2	96.7	169.1	-97.6	-23.3	0	0	0	107.6	S308 S312	S308-N310 PolarHBondContact O-N 2.87Å; S308-N310 VanDerWaalsContact O-N 3.1Å; N310-S312 VanDerWaalsContact C-N 3.3Å; N310-S312 PolarHBondContact O-N 2.83Å
311	L	34.5	Very low	34.2	Very low	144 Å²	144	136.4 Å²	136.4	75%	0.754	75%	0.753	S	S	*	*			trans	-71.6	91.9	165.2	-73.5	112.7	0	0	0	107.1	L309 T313	L309-L311 VanDerWaalsContact C-N 3.34Å; L309-L311 HydrophobicContact CD2-CD1 4.41Å; L309-L311 HydrophobicContact CD2-CG 4.37Å; L309-L311 PolarHBondContact O-N 3.18Å; L311-T313 PolarHBondContact O-N 2.96Å
312	S	30.7	Very low	34.3	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	75%	0.751	S	S	*	*			trans	-58.2	112.6	158.4	-85.6	0	0	0	0	106.7	N310 S314	N310-S312 VanDerWaalsContact C-N 3.3Å; N310-S312 PolarHBondContact O-N 2.83Å; S312-S314 VanDerWaalsContact C-N 3.29Å; S312-S314 PolarHBondContact O-N 2.77Å
313	T	33.5	Very low	34.2	Very low	140 Å²	140	135 Å²	135	86%	0.859	75%	0.752	S	S	*	*			trans	-56.5	91.4	172.9	21.7	0	0	0	0	108.7	L311 S315	L311-T313 PolarHBondContact O-N 2.96Å; T313-S315 PolarHBondContact O-N 2.84Å
314	S	29.6	Very low	34.4	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	76%	0.755	S	S	*	*			trans	-64.7	115.5	163.7	48.9	0	0	0	0	106.9	S312 I316	S312-S314 VanDerWaalsContact C-N 3.29Å; S312-S314 PolarHBondContact O-N 2.77Å; S314-I316 PolarHBondContact O-N 2.94Å; S314-I316 VanDerWaalsContact O-N 3.14Å
315	S	37.2	Very low	34.6	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	75%	0.754	S	S	*	*			trans	-48.9	116	177	50.3	0	0	0	0	110.7	T313 I317	T313-S315 PolarHBondContact O-N 2.84Å; S315-I317 PolarHBondContact O-N 2.83Å
316	I	40.1	Very low	35	Very low	151 Å²	151	139.4 Å²	139.4	77%	0.774	75%	0.754	S	S	*	*			trans	-74.1	105.6	172.6	-60.6	171.5	0	0	0	106.4	S314 V318	S314-I316 PolarHBondContact O-N 2.94Å; S314-I316 VanDerWaalsContact O-N 3.14Å; I316-V318 HydrophobicContact CG2-CG2 3.74Å; I316-V318 PolarHBondContact O-N 3.11Å
317	I	37.6	Very low	35.4	Very low	117 Å²	117	136.4 Å²	136.4	60%	0.6	75%	0.748	S	S	*	*			trans	-75.2	95.8	169.4	-58	175.2	0	0	0	106.5	S315 Y319	S315-I317 PolarHBondContact O-N 2.83Å; I317-Y319 HydrophobicContact CB-CE2 4.35Å; I317-Y319 HydrophobicContact CG2-CD2 4.15Å; I317-Y319 HydrophobicContact CG2-CE1 4.39Å; I317-Y319 HydrophobicContact CG2-CE2 3.76Å; I317-Y319 PolarHBondContact O-N 3.28Å
318	V	35.7	Very low	36	Very low	119 Å²	119	139.3 Å²	139.3	72%	0.721	76%	0.755	S	S	*	*			trans	-77.4	101.7	172.3	-177.4	0	0	0	0	107.3	I316 N320	I316-V318 HydrophobicContact CG2-CG2 3.74Å; I316-V318 PolarHBondContact O-N 3.11Å; V318-N320 PolarHBondContact O-N 2.74Å; V318-N320 VanDerWaalsContact O-N 3.11Å
319	Y	31.4	Very low	36.2	Very low	186 Å²	186	141.6 Å²	141.6	73%	0.729	76%	0.759	S	S	*	*			trans	-68	108	168.3	-69.7	-87.5	0	0	0	108	I317 I321	I317-Y319 HydrophobicContact CB-CE2 4.35Å; I317-Y319 HydrophobicContact CG2-CD2 4.15Å; I317-Y319 HydrophobicContact CG2-CE1 4.39Å; I317-Y319 HydrophobicContact CG2-CE2 3.76Å; I317-Y319 PolarHBondContact O-N 3.28Å; Y319-I321 PolarHBondContact O-N 2.95Å
320	N	34.4	Very low	36.1	Very low	123 Å²	123	142.9 Å²	142.9	66%	0.658	76%	0.76	S	S	*	*			trans	-73.3	96.6	173.1	-165.7	1.5	0	0	0	108.3	V318 N322	V318-N320 PolarHBondContact O-N 2.74Å; V318-N320 VanDerWaalsContact O-N 3.11Å; N320-N322 PolarHBondContact ND2-ND2 2.95Å; N320-N322 PolarHBondContact O-N 2.99Å
321	I	35.9	Very low	36.4	Very low	135 Å²	135	143.7 Å²	143.7	69%	0.692	76%	0.76	S	S	*	*			trans	-77.4	63	177.9	-41.3	172.1	0	0	0	108.3	Y319 N323	Y319-I321 PolarHBondContact O-N 2.95Å; I321-N323 PolarHBondContact O-N 3.06Å
322	N	34	Very low	36.7	Very low	127 Å²	127	144 Å²	144	68%	0.679	76%	0.762	S	S	*	*			trans	-74.9	98.5	168.7	-87.9	-19	0	0	0	107.7	N320 K324	N320-N322 PolarHBondContact ND2-ND2 2.95Å; N320-N322 PolarHBondContact O-N 2.99Å; N322-K324 VanDerWaalsContact C-N 3.28Å; N322-K324 PolarHBondContact O-N 3.07Å
323	N	34.3	Very low	37.2	Very low	148 Å²	148	149.7 Å²	149.7	79%	0.791	77%	0.768	S	S	*	*			trans	-61	86.7	168.7	-66.2	-46.6	0	0	0	109.6	I321	I321-N323 PolarHBondContact O-N 3.06Å
324	K	34	Very low	37.5	Very low	189 Å²	189	148.2 Å²	148.2	82%	0.822	76%	0.759	S	S	*	*			trans	-139.4	107	157.4	-76.1	-169.5	179.1	172.6	0	108.2	N322 E326	N322-K324 VanDerWaalsContact C-N 3.28Å; N322-K324 PolarHBondContact O-N 3.07Å; K324-E326 PolarHBondContact O-N 2.99Å
325	D	39.4	Very low	38	Very low	156 Å²	156	149.4 Å²	149.4	83%	0.834	76%	0.757	S	S	*	*			trans	-49	111.6	156.2	-47.9	-71	0	0	0	107.8
326	E	44.2	Very low	38.3	Very low	161 Å²	161	148.9 Å²	148.9	75%	0.752	75%	0.75	S	S	*	*			trans	-178.7	112.3	152.1	-80.3	-39	149.8	0	0	106.1	K324	K324-E326 PolarHBondContact O-N 2.99Å
327	D	42.9	Very low	38.4	Very low	141 Å²	141	148.5 Å²	148.5	75%	0.754	74%	0.744	S	S	*	*			trans	45.9	101.4	156.4	-61.3	-26	0	0	0	118.7	N329	D327-N329 PolarHBondContact O-N 3.37Å
328	D	42.1	Very low	38.6	Very low	169 Å²	169	149.3 Å²	149.3	90%	0.904	75%	0.75	S	S	*	*			trans	-55.6	73.1	158.6	-69.7	-45	0	0	0	111.1
329	N	38.3	Very low	38.9	Very low	155 Å²	155	149.5 Å²	149.5	83%	0.829	75%	0.747	S	S	*	*			trans	-96.3	93.6	153.4	-115.2	-18.1	0	0	0	106.8	D327	D327-N329 PolarHBondContact O-N 3.37Å
330	H	35.5	Very low	39.4	Very low	170 Å²	170	146.2 Å²	146.2	79%	0.787	74%	0.741	S	S	*	*			trans	-44.6	148.2	156.1	-93.9	-69.8	0	0	0	110.2
331	E	38.3	Very low	39.6	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	74%	0.743	S	S	*	*			trans	104.8	79.8	174	-56.2	-176.6	-155.3	0	0	113.9
332	D	41.3	Very low	39.7	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	74%	0.74	S	S	*	*			trans	-157.6	91.7	130.3	-95.9	-25.8	0	0	0	108.5	T334	D332-T334 PolarHBondContact O-N 2.72Å
333	Y	41.4	Very low	39.8	Very low	231 Å²	231	145.3 Å²	145.3	91%	0.906	74%	0.736	S	S	*	*			trans	-63.4	83.3	159.4	-76.2	-91.3	0	0	0	107.3	D335	Y333-D335 PolarHBondContact O-N 2.72Å
334	T	39.7	Very low	40.2	Very low	109 Å²	109	142.5 Å²	142.5	67%	0.669	72%	0.724	S	S	*	*			trans	-78.3	107.8	162.1	42.5	0	0	0	0	106.8	D332 V336	D332-T334 PolarHBondContact O-N 2.72Å; T334-V336 WeakPolarHBondContact O-CG2 3.48Å; T334-V336 PolarHBondContact O-N 3.12Å
335	D	39.8	Very low	40.3	Very low	128 Å²	128	140 Å²	140	68%	0.684	72%	0.715	S	S	*	*			trans	-62.8	78.1	175.6	-148.8	-2.7	0	0	0	108.4	Y333 H337	Y333-D335 PolarHBondContact O-N 2.72Å; D335-H337 PolarHBondContact O-N 2.74Å; D335-H337 IonicContact OD1-CD2 3.84Å
336	V	44.4	Very low	40	Very low	92 Å²	92	139.6 Å²	139.6	56%	0.558	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	35	174.8	-162.3	0	0	0	0	110.3	T334 D338	T334-V336 WeakPolarHBondContact O-CG2 3.48Å; T334-V336 PolarHBondContact O-N 3.12Å; V336-D338 VanDerWaalsContact C-N 3.33Å
337	H	41.2	Very low	39.5	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.657	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-11.2	173.6	-104	-68	0	0	0	112.8	D335	D335-H337 PolarHBondContact O-N 2.74Å; D335-H337 IonicContact OD1-CD2 3.84Å
338	D	42.3	Very low	39	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	70%	0.704	S	S	*	*	S	Bend	trans	-85.9	-27.9	-176.9	-74.6	-16.2	0	0	0	114.1	V336 I340	V336-D338 VanDerWaalsContact C-N 3.33Å; D338-I340 PolarHBondContact O-N 2.64Å
339	D	41.5	Very low	38.7	Very low	123 Å²	123	136.9 Å²	136.9	66%	0.658	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-11	-173.8	-73.9	-15.3	0	0	0	114.7
340	I	42.5	Very low	38.5	Very low	117 Å²	117	134.2 Å²	134.2	60%	0.6	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-20.7	-178.1	-58.9	178.5	0	0	0	111.8	D338	D338-I340 PolarHBondContact O-N 2.64Å
341	Q	38.4	Very low	38.4	Very low	152 Å²	152	134 Å²	134	71%	0.71	69%	0.685	S	S	*	*	H	α-helix	trans	-69.2	-36.4	178	-76.5	-105	-22.5	0	0	112.5	T343	Q341-T343 VanDerWaalsContact C-N 3.33Å; Q341-T343 PolarHBondContact O-N 2.66Å
342	D	37.2	Very low	38.3	Very low	118 Å²	118	133.9 Å²	133.9	63%	0.631	69%	0.685	S	S	*	*	H	α-helix	trans	-72	-23.2	-176.3	-90.3	1.7	0	0	0	114
343	T	37.8	Very low	37.8	Very low	95 Å²	95	131.7 Å²	131.7	58%	0.583	68%	0.681	S	S	*	*	H	α-helix	trans	-80.3	-27.5	-177.8	-44.4	0	0	0	0	112.4	Q341	Q341-T343 VanDerWaalsContact C-N 3.33Å; Q341-T343 PolarHBondContact O-N 2.66Å
344	V	41	Very low	37.4	Very low	90 Å²	90	127 Å²	127	55%	0.545	67%	0.672	S	S	.	*	H	α-helix	trans	-78.5	-36.3	-177.9	-177.5	0	0	0	0	111.6	H346 Q347 M348	V344-H346 VanDerWaalsContact C-N 3.31Å; V344-H346 PolarHBondContact O-N 2.75Å; V344-Q347 PolarHBondContact O-N 2.85Å; V344-M348 PolarHBondContact O-N 2.85Å
345	E	37.9	Very low	37	Very low	135 Å²	135	129.2 Å²	129.2	63%	0.631	68%	0.68	S	S	*	*	H	α-helix	trans	-66.6	-32.1	175.8	-81.4	-162.5	158.2	0	0	112.6	Q347 M348 N349	E345-Q347 VanDerWaalsContact C-N 3.28Å; E345-Q347 PolarHBondContact O-N 3.5Å; E345-M348 PolarHBondContact O-N 3.08Å; E345-N349 PolarHBondContact O-N 2.94Å
346	H	33.1	Very low	36.5	Very low	148 Å²	148	130.3 Å²	130.3	69%	0.685	69%	0.686	S	S	*	*	H	α-helix	trans	-75	-12.3	177	-76.5	-2.1	0	0	0	114.9	V344	V344-H346 VanDerWaalsContact C-N 3.31Å; V344-H346 PolarHBondContact O-N 2.75Å
347	Q	33.6	Very low	35.9	Very low	152 Å²	152	132.1 Å²	132.1	71%	0.71	69%	0.692	S	S	*	*	H	α-helix	trans	-90.2	-25.6	171.1	-76.5	-166.8	-26.1	0	0	113.7	V344 E345	V344-Q347 PolarHBondContact O-N 2.85Å; E345-Q347 VanDerWaalsContact C-N 3.28Å; E345-Q347 PolarHBondContact O-N 3.5Å
348	M	32.4	Very low	35.3	Very low	144 Å²	144	134.5 Å²	134.5	71%	0.709	70%	0.703	S	S	*	*	H	α-helix	trans	-76.7	-27.8	175.3	-76.7	-161	170.1	0	0	113.3	V344 E345 S350	V344-M348 PolarHBondContact O-N 2.85Å; E345-M348 PolarHBondContact O-N 3.08Å; M348-S350 VanDerWaalsContact C-N 3.34Å; M348-S350 PolarHBondContact O-N 3.44Å
349	N	35.2	Very low	35	Very low	118 Å²	118	136.5 Å²	136.5	63%	0.631	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-4.2	-179.6	-73.3	0.7	0	0	0	115.1	E345	E345-N349 PolarHBondContact O-N 2.94Å
350	S	34.5	Very low	34.8	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-17.8	176.1	-164.1	0	0	0	0	113.4	M348	M348-S350 VanDerWaalsContact C-N 3.34Å; M348-S350 PolarHBondContact O-N 3.44Å
351	M	33.7	Very low	34.3	Very low	164 Å²	164	134.8 Å²	134.8	81%	0.808	72%	0.722	S	S	*	*	S	Bend	trans	-82.9	-14.4	179	-84.5	-169.5	-79.7	0	0	114.6
352	E	35.5	Very low	34.2	Very low	169 Å²	169	136.6 Å²	136.6	79%	0.79	73%	0.728	S	S	*	*	S	Bend	trans	-98.2	-9.6	-174.8	-105.5	177.1	172.6	0	0	115.8
353	S	30.6	Very low	34.4	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	11.5	-171.7	-160.3	0	0	0	0	116.6
354	N	33.3	Very low	34.3	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	19.7	-179.2	-119	0.3	0	0	0	116.7	N356	N354-N356 VanDerWaalsContact C-N 3.3Å; N354-N356 PolarHBondContact O-N 2.85Å
355	N	30.2	Very low	34.1	Very low	156 Å²	156	136 Å²	136	83%	0.834	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	6.2	173.7	-95.9	-13.8	0	0	0	115.3
356	N	30.3	Very low	34	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	1.3	-176.9	-78.9	-9.4	0	0	0	116.6	N354 Q358	N354-N356 VanDerWaalsContact C-N 3.3Å; N354-N356 PolarHBondContact O-N 2.85Å; N356-Q358 VanDerWaalsContact C-N 3.35Å; N356-Q358 PolarHBondContact O-N 3.05Å
357	N	32.1	Very low	34.2	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	75%	0.751	S	S	*	*			trans	-97.2	75.1	171.1	-72.7	-2.6	0	0	0	110.3	E359	N357-E359 PolarHBondContact O-N 3.35Å
358	Q	28.7	Very low	34.6	Very low	192 Å²	192	135.5 Å²	135.5	90%	0.897	75%	0.752	S	S	*	*			trans	-64.4	66.2	160.4	-164.5	179.7	19.3	0	0	109.2	N356	N356-Q358 VanDerWaalsContact C-N 3.35Å; N356-Q358 PolarHBondContact O-N 3.05Å
359	E	34.9	Very low	34.8	Very low	177 Å²	177	138.7 Å²	138.7	83%	0.827	76%	0.757	S	S	*	*			trans	-96.5	113.6	166.3	-80.5	-166.7	166.2	0	0	109.7	N357 G361	N357-E359 PolarHBondContact O-N 3.35Å; E359-G361 VanDerWaalsContact C-N 3.26Å; E359-G361 PolarHBondContact O-N 3.17Å
360	V	37	Very low	34.7	Very low	131 Å²	131	140.3 Å²	140.3	79%	0.794	77%	0.765	S	S	*	*			trans	-43	72.8	175.3	-170.1	0	0	0	0	113.3	K362	V360-K362 PolarHBondContact O-N 2.72Å
361	G	33.6	Very low	35	Very low	73 Å²	73	141.2 Å²	141.2	75%	0.753	77%	0.767	S	S	*	*			trans	-81.2	89.9	168.2	0	0	0	0	0	110	E359 S363	E359-G361 VanDerWaalsContact C-N 3.26Å; E359-G361 PolarHBondContact O-N 3.17Å; G361-S363 PolarHBondContact O-N 2.85Å
362	K	36.3	Very low	35.2	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	76%	0.764	S	S	*	*			trans	-45.7	124.8	174	-74.6	169.9	175.4	173.4	0	110.5	V360 G364	V360-K362 PolarHBondContact O-N 2.72Å; K362-G364 PolarHBondContact O-N 2.86Å
363	S	41.4	Very low	35.4	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	76%	0.756	S	S	*	*			trans	-54.7	105.7	166.4	53.5	0	0	0	0	108.9	G361 N365	G361-S363 PolarHBondContact O-N 2.85Å; S363-N365 PolarHBondContact O-N 2.68Å
364	G	35.8	Very low	35.7	Very low	69 Å²	69	142.9 Å²	142.9	71%	0.711	76%	0.762	S	S	*	*			trans	-59.1	109.4	172.5	0	0	0	0	0	108.8	K362 M366	K362-G364 PolarHBondContact O-N 2.86Å; G364-M366 PolarHBondContact O-N 2.64Å
365	N	35.5	Very low	35.9	Very low	107 Å²	107	143.3 Å²	143.3	57%	0.572	76%	0.764	S	S	*	*			trans	-64.5	129.2	175.8	-174.7	6.3	0	0	0	108	S363 N367	S363-N365 PolarHBondContact O-N 2.68Å; N365-N367 PolarHBondContact ND2-ND2 2.62Å; N365-N367 PolarHBondContact O-N 2.72Å
366	M	35.4	Very low	36.3	Very low	174 Å²	174	143.3 Å²	143.3	86%	0.857	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-62.2	7.5	-176.2	-76.4	-179.8	172	0	0	115	G364 D368	G364-M366 PolarHBondContact O-N 2.64Å; M366-D368 VanDerWaalsContact C-N 3.3Å; M366-D368 PolarHBondContact O-N 2.72Å
367	N	38.7	Very low	36.5	Very low	115 Å²	115	143.6 Å²	143.6	62%	0.615	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-79.5	-8.2	-177.5	-69.4	-7.3	0	0	0	113.8	N365 Y369	N365-N367 PolarHBondContact ND2-ND2 2.62Å; N365-N367 PolarHBondContact O-N 2.72Å; N367-Y369 PolarHBondContact O-N 3.16Å
368	D	42.2	Very low	36.8	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-78.2	-1.6	-175.2	-68.2	-7.3	0	0	0	114.2	M366	M366-D368 VanDerWaalsContact C-N 3.3Å; M366-D368 PolarHBondContact O-N 2.72Å
369	Y	36	Very low	37.5	Very low	210 Å²	210	142.9 Å²	142.9	82%	0.824	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-102.4	7.5	-176.2	-69.1	-75.6	0	0	0	116.1	N367	N367-Y369 PolarHBondContact O-N 3.16Å
370	L	33.7	Very low	37.8	Very low	152 Å²	152	141 Å²	141	80%	0.796	77%	0.769	S	S	*	*			trans	-118.7	63.2	179.3	-75.8	167.8	0	0	0	112
371	T	39.6	Very low	38	Very low	120 Å²	120	143.1 Å²	143.1	74%	0.736	78%	0.775	S	S	*	*			trans	-112.3	86.1	159.2	-34.6	0	0	0	0	107.4	V373	T371-V373 VanDerWaalsContact C-N 3.34Å; T371-V373 PolarHBondContact O-N 2.69Å
372	L	38.9	Very low	38	Very low	142 Å²	142	147 Å²	147	74%	0.743	82%	0.815	S	S	*	*			trans	-66.4	100.5	165.8	-73.5	162.4	0	0	0	106.2	W374	L372-W374 VanDerWaalsContact O-CD1 3.24Å; L372-W374 PolarHBondContact O-N 2.76Å; L372-W374 VanDerWaalsContact O-N 3.12Å
373	V	38.5	Very low	38.1	Very low	104 Å²	104	144.9 Å²	144.9	63%	0.63	82%	0.815	S	S	*	*			trans	-65.8	107.9	172.3	-179.2	0	0	0	0	106.4	T371 D375	T371-V373 VanDerWaalsContact C-N 3.34Å; T371-V373 PolarHBondContact O-N 2.69Å; V373-D375 VanDerWaalsContact C-N 3.25Å; V373-D375 WeakPolarHBondContact CG1-OD1 3.3Å; V373-D375 PolarHBondContact O-N 3.03Å
374	W	37.4	Very low	37.9	Very low	224 Å²	224	146.4 Å²	146.4	85%	0.848	82%	0.815	S	S	*	*			trans	-71.9	92.7	163.8	-66.8	74.2	0	0	0	105	L372 D376	L372-W374 VanDerWaalsContact O-CD1 3.24Å; L372-W374 PolarHBondContact O-N 2.76Å; L372-W374 VanDerWaalsContact O-N 3.12Å; W374-D376 PolarHBondContact O-N 3.23Å
375	D	37.1	Very low	38.1	Very low	142 Å²	142	150.7 Å²	150.7	76%	0.759	82%	0.82	S	S	*	*			trans	-62.3	109.6	174	-81	-36.1	0	0	0	108.1	V373 L377	V373-D375 VanDerWaalsContact C-N 3.25Å; V373-D375 WeakPolarHBondContact CG1-OD1 3.3Å; V373-D375 PolarHBondContact O-N 3.03Å; D375-L377 PolarHBondContact O-N 3.02Å
376	D	38.7	Very low	38.2	Very low	156 Å²	156	153.2 Å²	153.2	83%	0.834	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-54	127.6	178.6	-74.6	-44.4	0	0	0	110.8	W374	W374-D376 PolarHBondContact O-N 3.23Å
377	L	35.2	Very low	38.4	Very low	157 Å²	157	151.9 Å²	151.9	82%	0.822	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-58.2	138.3	171.8	-104.3	81.3	0	0	0	110	D375 E379	D375-L377 PolarHBondContact O-N 3.02Å; L377-E379 PolarHBondContact O-N 3.05Å
378	P	39.2	Very low	38.4	Very low	119 Å²	119	154.4 Å²	154.4	77%	0.773	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-66.6	117.7	179.6	25.7	-32.2	0	0	0	110.8	T380	P378-T380 PolarHBondContact O-N 2.69Å
379	E	43.6	Very low	38.1	Very low	187 Å²	187	155.8 Å²	155.8	87%	0.874	86%	0.857	S	S	*	*			trans	-55.1	111.2	164.9	-72.9	-177.7	158.3	0	0	109.1	L377 L381	L377-E379 PolarHBondContact O-N 3.05Å; E379-L381 PolarHBondContact O-N 2.98Å
380	T	39.7	Very low	38.3	Very low	139 Å²	139	151.6 Å²	151.6	85%	0.853	86%	0.86	S	S	*	*			trans	-61.2	117.5	169.7	38.8	0	0	0	0	109.6	P378 G382	P378-T380 PolarHBondContact O-N 2.69Å; T380-G382 PolarHBondContact O-N 2.88Å
381	L	42	Very low	38.6	Very low	174 Å²	174	151.6 Å²	151.6	91%	0.911	87%	0.865	S	S	*	*			trans	-38.5	120.2	174.1	-63.8	157.8	0	0	0	114.1	E379	E379-L381 PolarHBondContact O-N 2.98Å
382	G	33.7	Very low	38.6	Very low	155 Å²	155	154.5 Å²	154.5	100%	1.598	88%	0.877	S	S	*	*				51	0	117.6	0	0	0	0	0	119.6	T380	T380-G382 PolarHBondContact O-N 2.88Å

Retrieved 382 of 382 residues in 260.5 ms (Link to these results)

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