A0A5K4F1G3_SCHMA Loading...

Ras-GEF domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1G3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 437 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	33.9	Very low	238 Å²	238	142.1 Å²	142.1	100%	1.172	82%	0.815	S	S	*	*				0	122	0	-81.6	177.7	165.7	0	0	108
2	S	34.8	Very low	34.2	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	81%	0.814	S	S	*	*			trans	20.2	136.7	140.8	61.3	0	0	0	0	121.8
3	L	35.1	Very low	34.2	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	81%	0.814	S	S	*	*			trans	81.1	115.8	141.8	-62.5	154.2	0	0	0	116.6
4	V	31.6	Very low	34.2	Very low	118 Å²	118	141.8 Å²	141.8	72%	0.715	81%	0.814	S	S	*	*				68.1	135.9	53.8	178.4	0	0	0	0	112.2
5	N	32	Very low	34.5	Very low	133 Å²	133	145.7 Å²	145.7	71%	0.711	81%	0.812	S	S	*	*			trans	85.2	144.1	171.7	-71.7	0.9	0	0	0	116.9
6	D	31.3	Very low	35.1	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	81%	0.81	S	S	*	*			cis	178.2	146	-23.3	-118.2	-26.8	0	0	0	103.4
7	G	29.3	Very low	36.1	Very low	67 Å²	67	140.8 Å²	140.8	69%	0.691	81%	0.805	S	S	*	*				103.5	121.2	127.4	0	0	0	0	0	119.8
8	K	34.9	Very low	36.7	Very low	199 Å²	199	144 Å²	144	87%	0.865	81%	0.812	S	S	*	*			trans	89	101.3	155.8	-65.6	175.6	173.5	175.3	0	114.7
9	S	34	Very low	37.4	Very low	119 Å²	119	142.9 Å²	142.9	83%	0.832	80%	0.799	S	S	*	*			cis	68.7	79.8	44.8	-36.1	0	0	0	0	113.6
10	E	35.2	Very low	38.8	Very low	195 Å²	195	138.7 Å²	138.7	91%	0.911	78%	0.78	S	S	*	*			trans	-117.4	107.9	158.7	-80.8	-175.2	153.7	0	0	110
11	A	35.7	Very low	40	Very low	98 Å²	98	139.1 Å²	139.1	81%	0.81	78%	0.779	S	S	*	*			trans	17.3	96.3	161.2	0	0	0	0	0	118.8	Q13	A11-Q13 PolarHBondContact O-N 3.42Å
12	S	37.4	Very low	40.5	Very low	114 Å²	114	133.2 Å²	133.2	80%	0.797	75%	0.751	S	S	*	*			trans	-62.6	117.7	153.3	-53.3	0	0	0	0	109.5	T14	S12-T14 PolarHBondContact O-N 3.4Å
13	Q	34.9	Very low	41.8	Very low	175 Å²	175	133.2 Å²	133.2	82%	0.818	74%	0.74	S	S	*	*			trans	-46.8	108.6	170.1	-77.8	170.9	-12.9	0	0	110.1	A11 Y15	A11-Q13 PolarHBondContact O-N 3.42Å; Q13-Y15 PolarHBondContact O-N 3.39Å
14	T	33.7	Very low	43.2	Very low	133 Å²	133	128.3 Å²	128.3	82%	0.816	72%	0.721	S	S	*	*			trans	-77.6	109.2	169.9	-59.1	0	0	0	0	106.9	S12	S12-T14 PolarHBondContact O-N 3.4Å
15	Y	38.8	Very low	44.6	Very low	201 Å²	201	130 Å²	130	79%	0.788	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-54.5	133	168.9	-81.7	-92.1	0	0	0	109.2	Q13 A17	Q13-Y15 PolarHBondContact O-N 3.39Å; Y15-A17 PolarHBondContact O-N 3.35Å
16	P	43.8	Very low	46	Very low	120 Å²	120	129 Å²	129	78%	0.779	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-63.9	123.7	179.9	25.1	-30.7	0	0	0	108.8	E18	P16-E18 PolarHBondContact O-N 3.43Å
17	A	51.7	Low	47.3	Very low	87 Å²	87	128.5 Å²	128.5	72%	0.719	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-47.9	132.1	174.2	0	0	0	0	0	110	Y15 Q19	Y15-A17 PolarHBondContact O-N 3.35Å; A17-Q19 PolarHBondContact O-N 3.47Å
18	E	47.3	Very low	48.5	Very low	199 Å²	199	131.3 Å²	131.3	93%	0.93	69%	0.689	S	S	*	*			trans	-43.1	98.1	176.5	-63.7	177.4	164.3	0	0	110.3	P16 S20	P16-E18 PolarHBondContact O-N 3.43Å; E18-S20 PolarHBondContact O-N 3.28Å
19	Q	51.1	Low	49.2	Very low	123 Å²	123	126.2 Å²	126.2	58%	0.575	67%	0.668	S	S	*	*			trans	-65.4	130.2	177.7	-94.1	177.5	-9	0	0	108.3	A17 I21	A17-Q19 PolarHBondContact O-N 3.47Å; Q19-I21 PolarHBondContact O-N 3.23Å
20	S	63.8	Low	49.8	Very low	59 Å²	59	125.5 Å²	125.5	41%	0.413	65%	0.654	S	S	.	*			trans	-57.2	134.6	175.4	-178	0	0	0	0	109.9	E18 I22 Q23 A24	E18-S20 PolarHBondContact O-N 3.28Å; S20-I22 PolarHBondContact O-N 3.3Å; S20-I22 PolarHBondContact OG-N 3.39Å; S20-Q23 PolarHBondContact O-N 3.26Å; S20-A24 PolarHBondContact O-N 3Å; S20-A24 VanDerWaalsContact O-N 3.11Å
21	I	65.7	Low	50.2	Low	147 Å²	147	120.5 Å²	120.5	75%	0.754	64%	0.637	S	S	*	*	H	α-helix	trans	-46.3	-31.8	171.7	-78.1	169.5	0	0	0	111.9	Q19 A24 W25	Q19-I21 PolarHBondContact O-N 3.23Å; I21-A24 PolarHBondContact O-N 2.97Å; I21-W25 WeakPolarHBondContact O-CB 3.47Å; I21-W25 PolarHBondContact O-N 3.46Å
22	I	48.1	Very low	50.3	Low	114 Å²	114	122.7 Å²	122.7	59%	0.585	63%	0.63	S	S	*	*	H	α-helix	trans	-68.8	-42.4	178.3	-58.6	171.8	0	0	0	111.4	S20 A24 W25 E26	S20-I22 PolarHBondContact O-N 3.3Å; S20-I22 PolarHBondContact OG-N 3.39Å; I22-A24 VanDerWaalsContact C-N 3.34Å; I22-W25 PolarHBondContact O-N 2.98Å; I22-E26 PolarHBondContact O-N 2.89Å
23	Q	63.4	Low	50.4	Low	97 Å²	97	122.9 Å²	122.9	45%	0.453	62%	0.622	S	S	.	*	H	α-helix	trans	-69.5	-33.4	175.7	-79.8	-176.9	-27	0	0	112	S20 R27	S20-Q23 PolarHBondContact O-N 3.26Å; Q23-R27 WeakPolarHBondContact O-CB 3.48Å; Q23-R27 PolarHBondContact O-N 3.11Å; Q23-R27 VanDerWaalsContact O-N 3.07Å
24	A	63.8	Low	50.3	Low	48 Å²	48	119.6 Å²	119.6	40%	0.397	61%	0.614	S	S	.	*	H	α-helix	trans	-65	-42.7	172.7	0	0	0	0	0	110.9	S20 I21 I22 R27 Q28	S20-A24 PolarHBondContact O-N 3Å; S20-A24 VanDerWaalsContact O-N 3.11Å; I21-A24 PolarHBondContact O-N 2.97Å; I22-A24 VanDerWaalsContact C-N 3.34Å; A24-R27 PolarHBondContact O-N 3.31Å; A24-Q28 PolarHBondContact O-N 2.99Å
25	W	62	Low	50.3	Low	155 Å²	155	120 Å²	120	59%	0.587	61%	0.611	S	S	*	*	H	α-helix	trans	-69.3	-42.8	178.2	-171.1	84.3	0	0	0	113.1	I21 I22 R27 Q28 Q29	I21-W25 WeakPolarHBondContact O-CB 3.47Å; I21-W25 PolarHBondContact O-N 3.46Å; I22-W25 PolarHBondContact O-N 2.98Å; W25-R27 VanDerWaalsContact C-N 3.33Å; W25-R27 PolarHBondContact O-N 2.78Å; W25-Q28 PolarHBondContact O-N 3.19Å; W25-Q28 VanDerWaalsContact O-N 3.12Å; W25-Q29 HydrophobicContact CD2-CG 4.18Å; W25-Q29 HydrophobicContact CE3-CG 4.14Å; W25-Q29 HydrophobicContact CH2-CG 3.87Å; W25-Q29 HydrophobicContact CZ2-CG 3.88Å; W25-Q29 VanDerWaalsContact CZ2-NE2 3.33Å; W25-Q29 HydrophobicContact CZ3-CG 3.99Å; W25-Q29 PolarHBondContact O-N 3.17Å
26	E	59.9	Low	50	Low	112 Å²	112	115 Å²	115	52%	0.523	61%	0.605	S	S	.	*	H	α-helix	trans	-58	-44.8	172.9	-86.6	-179.8	160.3	0	0	111.1	I22 Q28 Q29 D30	I22-E26 PolarHBondContact O-N 2.89Å; E26-Q28 VanDerWaalsContact C-N 3.32Å; E26-Q28 PolarHBondContact O-N 3.31Å; E26-Q29 PolarHBondContact O-N 3.29Å; E26-D30 WeakPolarHBondContact O-CB 3.3Å; E26-D30 PolarHBondContact O-N 2.89Å
27	R	60	Low	49.6	Very low	136 Å²	136	115.4 Å²	115.4	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-65.2	-34.1	174.5	-78	-153.7	-179.8	94.1	1.7	113.2	Q23 A24 W25 Q29 D30 V31	Q23-R27 WeakPolarHBondContact O-CB 3.48Å; Q23-R27 PolarHBondContact O-N 3.11Å; Q23-R27 VanDerWaalsContact O-N 3.07Å; A24-R27 PolarHBondContact O-N 3.31Å; W25-R27 VanDerWaalsContact C-N 3.33Å; W25-R27 PolarHBondContact O-N 2.78Å; R27-Q29 VanDerWaalsContact C-N 3.33Å; R27-D30 PolarHBondContact O-N 3.33Å; R27-V31 VanDerWaalsContact O-CB 3.26Å; R27-V31 WeakPolarHBondContact O-CB 3.13Å; R27-V31 WeakPolarHBondContact O-CG2 3.4Å; R27-V31 PolarHBondContact O-N 3.11Å
28	Q	54.7	Low	48.6	Very low	127 Å²	127	117.8 Å²	117.8	59%	0.593	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-38.5	177.9	-143.7	167.5	10	0	0	111	A24 W25 E26 H32	A24-Q28 PolarHBondContact O-N 2.99Å; W25-Q28 PolarHBondContact O-N 3.19Å; W25-Q28 VanDerWaalsContact O-N 3.12Å; E26-Q28 VanDerWaalsContact C-N 3.32Å; E26-Q28 PolarHBondContact O-N 3.31Å; Q28-H32 PolarHBondContact O-CD2 3.07Å; Q28-H32 PolarHBondContact O-N 3.03Å; Q28-H32 VanDerWaalsContact O-N 3.11Å
29	Q	47.6	Very low	48.1	Very low	91 Å²	91	115.3 Å²	115.3	43%	0.425	59%	0.59	S	S	.	*	H	α-helix	trans	-66.8	-43.5	171.1	-68.6	-72	-10.8	0	0	111.7	W25 E26 R27 V31 H32 L33	W25-Q29 HydrophobicContact CD2-CG 4.18Å; W25-Q29 HydrophobicContact CE3-CG 4.14Å; W25-Q29 HydrophobicContact CH2-CG 3.87Å; W25-Q29 HydrophobicContact CZ2-CG 3.88Å; W25-Q29 VanDerWaalsContact CZ2-NE2 3.33Å; W25-Q29 HydrophobicContact CZ3-CG 3.99Å; W25-Q29 PolarHBondContact O-N 3.17Å; E26-Q29 PolarHBondContact O-N 3.29Å; R27-Q29 VanDerWaalsContact C-N 3.33Å; Q29-V31 PolarHBondContact O-N 2.93Å; Q29-H32 CarbonylContact O-C 3.54Å; Q29-H32 WeakPolarHBondContact O-CB 3.18Å; Q29-H32 PolarHBondContact O-N 3.19Å; Q29-H32 VanDerWaalsContact O-N 3.14Å; Q29-L33 WeakPolarHBondContact O-CD1 3.22Å; Q29-L33 PolarHBondContact O-N 3.28Å; Q29-L33 VanDerWaalsContact O-N 3.1Å
30	D	46.6	Very low	47.5	Very low	104 Å²	104	115.6 Å²	115.6	56%	0.556	59%	0.592	S	S	*	*	H	α-helix	trans	-66.9	-33	176.9	-87.6	-12.4	0	0	0	113.1	E26 R27 H32 L33 T34	E26-D30 WeakPolarHBondContact O-CB 3.3Å; E26-D30 PolarHBondContact O-N 2.89Å; R27-D30 PolarHBondContact O-N 3.33Å; D30-H32 VanDerWaalsContact C-N 3.33Å; D30-L33 CarbonylContact O-C 3.36Å; D30-L33 VanDerWaalsContact O-CA 3.32Å; D30-L33 WeakPolarHBondContact O-CA 3.31Å; D30-L33 WeakPolarHBondContact O-CB 3.35Å; D30-L33 PolarHBondContact O-N 2.88Å; D30-T34 PolarHBondContact O-N 2.83Å
31	V	45.1	Very low	46.3	Very low	91 Å²	91	119.2 Å²	119.2	55%	0.552	61%	0.607	S	S	*	*	H	α-helix	trans	-69.9	-32.2	172.2	171.3	0	0	0	0	110.4	R27 Q29 L33 T34	R27-V31 VanDerWaalsContact O-CB 3.26Å; R27-V31 WeakPolarHBondContact O-CB 3.13Å; R27-V31 WeakPolarHBondContact O-CG2 3.4Å; R27-V31 PolarHBondContact O-N 3.11Å; Q29-V31 PolarHBondContact O-N 2.93Å; V31-L33 PolarHBondContact O-N 3.17Å; V31-T34 PolarHBondContact O-N 2.91Å; V31-T34 PolarHBondContact O-OG1 2.95Å
32	H	37.4	Very low	44.9	Very low	144 Å²	144	120.3 Å²	120.3	67%	0.667	61%	0.614	S	S	*	*	H	α-helix	trans	-71.3	-13.5	167.4	-79.2	-67.1	0	0	0	113.4	Q28 Q29 D30	Q28-H32 PolarHBondContact O-CD2 3.07Å; Q28-H32 PolarHBondContact O-N 3.03Å; Q28-H32 VanDerWaalsContact O-N 3.11Å; Q29-H32 CarbonylContact O-C 3.54Å; Q29-H32 WeakPolarHBondContact O-CB 3.18Å; Q29-H32 PolarHBondContact O-N 3.19Å; Q29-H32 VanDerWaalsContact O-N 3.14Å; D30-H32 VanDerWaalsContact C-N 3.33Å
33	L	40	Very low	44.1	Very low	117 Å²	117	117.8 Å²	117.8	61%	0.613	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	1.9	170.8	-75.2	143.5	0	0	0	113.3	Q29 D30 V31 N35	Q29-L33 WeakPolarHBondContact O-CD1 3.22Å; Q29-L33 PolarHBondContact O-N 3.28Å; Q29-L33 VanDerWaalsContact O-N 3.1Å; D30-L33 CarbonylContact O-C 3.36Å; D30-L33 VanDerWaalsContact O-CA 3.32Å; D30-L33 WeakPolarHBondContact O-CA 3.31Å; D30-L33 WeakPolarHBondContact O-CB 3.35Å; D30-L33 PolarHBondContact O-N 2.88Å; V31-L33 PolarHBondContact O-N 3.17Å; L33-N35 CarbonylContact O-C 3.56Å; L33-N35 PolarHBondContact O-N 2.89Å
34	T	32.3	Very low	42.8	Very low	107 Å²	107	122.6 Å²	122.6	66%	0.656	62%	0.624	S	S	*	*			trans	-69.7	16.7	172.4	56.9	0	0	0	0	114.1	D30 V31 S36	D30-T34 PolarHBondContact O-N 2.83Å; V31-T34 PolarHBondContact O-N 2.91Å; V31-T34 PolarHBondContact O-OG1 2.95Å; T34-S36 PolarHBondContact O-N 3.1Å
35	N	33.9	Very low	41	Very low	142 Å²	142	125.9 Å²	125.9	76%	0.759	64%	0.644	S	S	*	*	S	Bend	trans	-71.5	87.8	151.7	-72.3	-41.6	0	0	0	107.7	L33 H37	L33-N35 CarbonylContact O-C 3.56Å; L33-N35 PolarHBondContact O-N 2.89Å; N35-H37 PolarHBondContact O-N 2.8Å
36	S	32.6	Very low	39.5	Very low	95 Å²	95	123.3 Å²	123.3	66%	0.664	65%	0.65	S	S	*	*			trans	-11.6	83.6	165.6	170	0	0	0	0	113.9	T34 L38	T34-S36 PolarHBondContact O-N 3.1Å; S36-L38 PolarHBondContact O-N 3.37Å
37	H	34.2	Very low	38.1	Very low	129 Å²	129	125.6 Å²	125.6	60%	0.597	67%	0.666	S	S	*	*			trans	-75.2	81.8	162.5	-174.4	-83.3	0	0	0	105.6	N35 D39	N35-H37 PolarHBondContact O-N 2.8Å; H37-D39 PolarHBondContact O-N 3.36Å
38	L	31.7	Very low	36.7	Very low	136 Å²	136	123 Å²	123	71%	0.712	68%	0.682	S	S	*	*			trans	-47.5	115.9	165.9	-92.2	156.1	0	0	0	106.9	S36 M40	S36-L38 PolarHBondContact O-N 3.37Å; L38-M40 PolarHBondContact O-N 2.93Å
39	D	35.7	Very low	35.5	Very low	147 Å²	147	120.5 Å²	120.5	79%	0.786	69%	0.69	S	S	*	*	S	Bend	trans	-58.7	61.3	172.4	-78.6	-42.4	0	0	0	111.6	H37	H37-D39 PolarHBondContact O-N 3.36Å
40	M	38.4	Very low	34.5	Very low	129 Å²	129	122 Å²	122	64%	0.635	71%	0.711	S	S	*	*			trans	-104	11.2	179.6	-153.1	174.8	51.8	0	0	111.8	L38	L38-M40 PolarHBondContact O-N 2.93Å
41	L	40.4	Very low	33.8	Very low	136 Å²	136	125.4 Å²	125.4	71%	0.712	73%	0.727	S	S	*	*	S	Bend	trans	-93.4	-8.6	177.2	-73.7	170.9	0	0	0	113.8
42	D	35	Very low	32.9	Very low	169 Å²	169	126.7 Å²	126.7	90%	0.904	74%	0.74	S	S	*	*	S	Bend	trans	-90.6	-11.2	177.6	-117.1	8.7	0	0	0	113.7
43	A	32.4	Very low	32.5	Very low	61 Å²	61	125.5 Å²	125.5	50%	0.504	75%	0.748	S	S	.	*	S	Bend	trans	-111	94.3	169.1	0	0	0	0	0	107.9
44	W	36	Very low	32	Very low	198 Å²	198	125.6 Å²	125.6	75%	0.75	76%	0.758	S	S	*	*			trans	173.4	61	142.5	-72.5	-14.7	0	0	0	109.1	W235	W44-W235 HydrophobicContact CZ3-CH2 4.48Å
45	S	26.4	Very low	32	Very low	117 Å²	117	126 Å²	126	82%	0.818	77%	0.765	S	S	*	*			trans	-95.4	133.3	145.9	-67	0	0	0	0	106.9
46	S	28.9	Very low	31.9	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	76%	0.76	S	S	*	*			trans	83.6	114.7	-166.1	-51.1	0	0	0	0	111.5
47	D	31.1	Very low	31.8	Very low	160 Å²	160	124.8 Å²	124.8	86%	0.856	77%	0.767	S	S	*	*			cis	-142.4	151.5	33.7	-77	-50.6	0	0	0	113
48	G	29.7	Very low	31.8	Very low	83 Å²	83	128 Å²	128	86%	0.856	78%	0.779	S	S	*	*			trans	-68.3	142.1	167	0	0	0	0	0	111.6
49	G	30.4	Very low	31.6	Very low	74 Å²	74	126.6 Å²	126.6	76%	0.763	78%	0.781	S	S	*	*			trans	-162.3	92.9	173.7	0	0	0	0	0	109.9
50	S	27.3	Very low	31.2	Very low	123 Å²	123	127.1 Å²	127.1	86%	0.86	78%	0.784	S	S	*	*			trans	-66.6	134.4	166.6	-53	0	0	0	0	109.9
51	I	30.9	Very low	30.7	Very low	175 Å²	175	127.4 Å²	127.4	90%	0.897	79%	0.788	S	S	*	*			trans	-156.8	151.5	146.4	40.9	167.8	0	0	0	111.3
52	S	26.2	Very low	30.4	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	80%	0.797	S	S	*	*			trans	-85.9	163.3	-150.5	-52.2	0	0	0	0	116.3
53	S	29.4	Very low	30	Very low	119 Å²	119	127.5 Å²	127.5	83%	0.832	79%	0.79	S	S	*	*			trans	-43.7	136.4	164.4	-49.2	0	0	0	0	113.8
54	S	30.3	Very low	30.2	Very low	120 Å²	120	131.2 Å²	131.2	84%	0.839	81%	0.807	S	S	*	*			trans	-144.5	118.6	154.5	-64.7	0	0	0	0	108.6
55	S	31	Very low	29.8	Very low	114 Å²	114	128.4 Å²	128.4	80%	0.797	81%	0.806	S	S	*	*			trans	-64.1	140.7	171.5	51.7	0	0	0	0	111.8
56	S	32.8	Very low	30.3	Very low	93 Å²	93	128 Å²	128	65%	0.65	80%	0.8	S	S	*	*			trans	-148.4	98.5	147.2	62.6	0	0	0	0	109	F58	S56-F58 PolarHBondContact O-N 3.43Å
57	C	30.6	Very low	30.3	Very low	120 Å²	120	131.8 Å²	131.8	81%	0.811	81%	0.807	S	S	*	*			trans	-67.4	117.2	160.1	-53.9	0	0	0	0	107.2
58	F	33.1	Very low	30.3	Very low	196 Å²	196	130.7 Å²	130.7	86%	0.86	80%	0.801	S	S	*	*			trans	-102.7	101.1	158.7	-81.3	-80.7	0	0	0	107.1	S56	S56-F58 PolarHBondContact O-N 3.43Å
59	S	27.2	Very low	30.3	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	80%	0.796	S	S	*	*			trans	-98	124.5	155.4	-63	0	0	0	0	106.4
60	D	28.4	Very low	30.2	Very low	158 Å²	158	134.7 Å²	134.7	85%	0.845	79%	0.793	S	S	*	*			trans	-175.9	98.2	153.8	-107.3	-23.7	0	0	0	104.6
61	D	27	Very low	30.1	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	79%	0.789	S	S	*	*				63.7	93.3	73.2	-142	-7.7	0	0	0	111.7
62	H	34.4	Very low	30	Very low	197 Å²	197	133.2 Å²	133.2	91%	0.912	78%	0.783	S	S	*	*			trans	-151.6	117.3	148.2	-88.1	-38.5	0	0	0	111.4
63	C	27.4	Very low	30.1	Very low	111 Å²	111	132.3 Å²	132.3	75%	0.75	78%	0.776	S	S	*	*			trans	-67	135.7	172.5	-165.7	0	0	0	0	112.4
64	T	36.5	Very low	30.2	Very low	139 Å²	139	134.1 Å²	134.1	85%	0.853	78%	0.775	S	S	*	*			trans	-147.1	86.3	150.4	27.9	0	0	0	0	105
65	D	27.6	Very low	30.5	Very low	139 Å²	139	133.9 Å²	133.9	74%	0.743	77%	0.771	S	S	*	*				85.5	111.3	94.4	-163.2	15.1	0	0	0	112.3
66	P	36.7	Very low	30.3	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	78%	0.775	S	S	*	*			trans	-92.8	121.6	-179.4	34.1	-27.8	0	0	0	110.6
67	E	28.9	Very low	30.1	Very low	182 Å²	182	138 Å²	138	85%	0.85	78%	0.784	S	S	*	*			trans	-179.3	98	150.6	-106.6	174.3	-160.1	0	0	110.9
68	N	30.7	Very low	29.8	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	78%	0.784	S	S	*	*				177.3	107	123.9	-104.2	-75.7	0	0	0	112.3
69	L	30.4	Very low	29.8	Very low	141 Å²	141	136.5 Å²	136.5	74%	0.738	78%	0.778	S	S	*	*				66.1	104.3	127.4	-60.3	179.8	0	0	0	119.8
70	S	27.6	Very low	30.1	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	78%	0.777	S	S	*	*				79.2	89.3	116.6	-52.5	0	0	0	0	117.7
71	L	24.7	Very low	30.1	Very low	149 Å²	149	137.8 Å²	137.8	78%	0.78	78%	0.776	S	S	*	*			trans	-33.4	136.5	140.2	-76.9	134.5	0	0	0	113.4
72	P	30	Very low	30.4	Very low	119 Å²	119	140.1 Å²	140.1	77%	0.773	78%	0.783	S	S	*	*			trans	-89.1	104.4	138.7	26.7	-14.9	0	0	0	109
73	S	26.7	Very low	30.1	Very low	98 Å²	98	139 Å²	139	69%	0.685	78%	0.775	S	S	*	*			trans	-87.2	99.7	166.9	-61.2	0	0	0	0	109.4
74	I	32.8	Very low	30.2	Very low	156 Å²	156	141 Å²	141	80%	0.8	77%	0.773	S	S	*	*			trans	-145.5	138.5	172.8	-62.5	-174.2	0	0	0	108.9
75	P	36.3	Very low	30	Very low	115 Å²	115	143 Å²	143	75%	0.747	78%	0.778	S	S	*	*				-104.1	163.1	-115.2	37.4	-37.7	0	0	0	115.9	C77	P75-C77 PolarHBondContact O-N 3.41Å
76	L	27.4	Very low	30.2	Very low	170 Å²	170	142.6 Å²	142.6	89%	0.89	78%	0.776	S	S	*	*			trans	-46.2	101.2	165.1	-160.7	79.3	0	0	0	111	E78	L76-E78 PolarHBondContact O-N 2.85Å
77	C	28.3	Very low	29.8	Very low	125 Å²	125	143 Å²	143	85%	0.845	78%	0.782	S	S	*	*			trans	-82.3	106.6	167.4	-129.2	0	0	0	0	107.8	P75	P75-C77 PolarHBondContact O-N 3.41Å
78	E	23.6	Very low	30	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-56.1	126.1	167.6	-115.7	-175.4	164.5	0	0	110.1	L76	L76-E78 PolarHBondContact O-N 2.85Å
79	P	33.2	Very low	30.1	Very low	112 Å²	112	143.8 Å²	143.8	73%	0.727	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.8	137.3	162	24.5	-19.5	0	0	0	109.7
80	P	32.7	Very low	30.2	Very low	113 Å²	113	144 Å²	144	73%	0.734	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.6	144.9	-171	-15.5	29.7	0	0	0	113.9	E82	P80-E82 PolarHBondContact O-N 3.48Å
81	E	29	Very low	30.3	Very low	179 Å²	179	144.5 Å²	144.5	84%	0.836	78%	0.782	S	S	*	*			trans	-64.7	88.6	169.5	-64.2	-169.5	151.5	0	0	112	K83	E81-K83 PolarHBondContact O-N 2.95Å
82	E	34.1	Very low	30.6	Very low	183 Å²	183	144.7 Å²	144.7	86%	0.855	78%	0.779	S	S	*	*			trans	-92.7	97.5	164.8	-72.8	-166.1	168.4	0	0	111.2	P80	P80-E82 PolarHBondContact O-N 3.48Å
83	K	27.8	Very low	30.6	Very low	173 Å²	173	150.2 Å²	150.2	75%	0.752	78%	0.784	S	S	*	*			trans	-52.9	149.7	157.2	-74.2	162.8	177	160.4	0	110.3	E81	E81-K83 PolarHBondContact O-N 2.95Å
84	H	28.5	Very low	30.9	Very low	153 Å²	153	154.3 Å²	154.3	71%	0.708	79%	0.79	S	S	*	*			trans	93.6	83	171.6	-68.3	-89.8	0	0	0	117.2
85	L	33.3	Very low	30.8	Very low	180 Å²	180	151.7 Å²	151.7	94%	0.942	79%	0.786	S	S	*	*			trans	-128.7	108.9	136	-79.5	173.3	0	0	0	109.9
86	N	31.1	Very low	30.5	Very low	131 Å²	131	154 Å²	154	70%	0.701	79%	0.786	S	S	*	*			trans	-60.6	136.2	175.9	-73.8	-48.3	0	0	0	111	I88	N86-I88 PolarHBondContact O-N 2.9Å; N86-I88 VanDerWaalsContact O-N 3.1Å
87	S	28.1	Very low	31	Very low	117 Å²	117	150.7 Å²	150.7	82%	0.818	78%	0.775	S	S	*	*			trans	-46.1	105	158.9	158.2	0	0	0	0	111.5
88	I	34.6	Very low	31.2	Very low	155 Å²	155	153.5 Å²	153.5	80%	0.795	78%	0.775	S	S	*	*			trans	-125.3	113.1	156.4	-63.3	177.4	0	0	0	107.7	N86 D90	N86-I88 PolarHBondContact O-N 2.9Å; N86-I88 VanDerWaalsContact O-N 3.1Å; I88-D90 PolarHBondContact O-N 2.93Å
89	K	31.6	Very low	31.9	Very low	178 Å²	178	150.5 Å²	150.5	77%	0.774	76%	0.76	S	S	*	*			trans	-42.3	126.2	159.9	-77.5	167.3	166.3	175.7	0	109.7
90	D	33	Very low	32.1	Very low	147 Å²	147	154.9 Å²	154.9	79%	0.786	76%	0.763	S	S	*	*				179.7	113.1	115.8	-85.9	-29.6	0	0	0	111.1	I88	I88-D90 PolarHBondContact O-N 2.93Å
91	T	28.9	Very low	32.4	Very low	110 Å²	110	154.7 Å²	154.7	68%	0.675	76%	0.762	S	S	*	*			trans	14.1	132.1	140.9	-19	0	0	0	0	119.9
92	H	31.5	Very low	33.1	Very low	153 Å²	153	148.7 Å²	148.7	71%	0.708	74%	0.735	S	S	*	*			trans	69.6	70.5	158	-66.4	-67.4	0	0	0	118.2
93	R	30.3	Very low	33.5	Very low	234 Å²	234	148 Å²	148	88%	0.883	73%	0.732	S	S	*	*				-129.4	119.2	128.1	-71.1	-159.9	178.1	-157.9	1.4	108.6	S95	R93-S95 PolarHBondContact O-N 3.35Å; R93-S95 PolarHBondContact O-OG 2.75Å
94	F	32.4	Very low	34.2	Very low	184 Å²	184	146.9 Å²	146.9	81%	0.807	72%	0.724	S	S	*	*			trans	-62.1	71.8	160.1	-71.2	-92.8	0	0	0	107.5	H96	F94-H96 VanDerWaalsContact C-N 3.3Å; F94-H96 PolarHBondContact O-N 2.96Å
95	S	32.1	Very low	34.7	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	72%	0.72	S	S	*	*			trans	-63.1	102.9	163.4	33.1	0	0	0	0	105.1	R93 P97	R93-S95 PolarHBondContact O-N 3.35Å; R93-S95 PolarHBondContact O-OG 2.75Å; S95-P97 WeakPolarHBondContact O-CD 3.29Å; S95-P97 VanDerWaalsContact O-N 3.07Å
96	H	28.7	Very low	35.5	Very low	164 Å²	164	144.6 Å²	144.6	76%	0.759	71%	0.709	S	S	*	*			trans	-40.4	118.8	163.9	-81.5	36.2	0	0	0	107.2	F94 Q98	F94-H96 VanDerWaalsContact C-N 3.3Å; F94-H96 PolarHBondContact O-N 2.96Å; H96-Q98 VanDerWaalsContact C-N 3.26Å; H96-Q98 PolarHBondContact O-N 3.2Å
97	P	38.7	Very low	36	Very low	99 Å²	99	144.3 Å²	144.3	64%	0.643	72%	0.718	S	S	*	*			trans	-60.9	104	166.7	-14.3	28	0	0	0	104.7	S95 K99	S95-P97 WeakPolarHBondContact O-CD 3.29Å; S95-P97 VanDerWaalsContact O-N 3.07Å; P97-K99 HydrophobicContact CB-CD 4.24Å; P97-K99 HydrophobicContact CB-CG 3.85Å; P97-K99 PolarHBondContact O-N 3.09Å
98	Q	32	Very low	37	Very low	184 Å²	184	142 Å²	142	86%	0.86	71%	0.706	S	S	*	*			trans	-64.6	68.8	154.8	-79.7	-170.4	-25.1	0	0	105.8	H96 Y100	H96-Q98 VanDerWaalsContact C-N 3.26Å; H96-Q98 PolarHBondContact O-N 3.2Å; Q98-Y100 PolarHBondContact O-N 3.01Å; Q98-Y100 VanDerWaalsContact O-N 3.09Å
99	K	38.5	Very low	37.8	Very low	110 Å²	110	137.8 Å²	137.8	48%	0.478	70%	0.701	S	S	.	*			trans	-68.1	107.2	168.3	-87	175.5	176.7	176.8	0	103.7	P97 D122	P97-K99 HydrophobicContact CB-CD 4.24Å; P97-K99 HydrophobicContact CB-CG 3.85Å; P97-K99 PolarHBondContact O-N 3.09Å; K99-D122 IonicContact NZ-OD1 2.63Å; K99-D122 PolarHBondContact NZ-OD1 2.9Å
100	Y	37.5	Very low	39	Very low	204 Å²	204	134.3 Å²	134.3	80%	0.8	69%	0.694	S	S	*	*			trans	-29.3	131.8	169.2	-74.7	-95.1	0	0	0	110.4	Q98 L102	Q98-Y100 PolarHBondContact O-N 3.01Å; Q98-Y100 VanDerWaalsContact O-N 3.09Å; Y100-L102 PolarHBondContact O-N 3.43Å
101	P	39.2	Very low	40.5	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	68%	0.68	S	S	*	*			trans	-56.1	103.4	178	-18.8	29.4	0	0	0	108.2	H103	P101-H103 PolarHBondContact O-CD2 3.08Å; P101-H103 PolarHBondContact O-N 2.98Å
102	L	43.2	Very low	42.6	Very low	52 Å²	52	131.3 Å²	131.3	27%	0.272	67%	0.668	S	S	.	*			trans	-60.7	110.1	172.8	-70.9	169.1	0	0	0	105	Y100 Y104 E115 D118	Y100-L102 PolarHBondContact O-N 3.43Å; L102-Y104 HydrophobicContact CB-CE1 4.29Å; L102-Y104 HydrophobicContact CB-CE2 4.13Å; L102-Y104 WeakPolarHBondContact O-CD2 3.41Å; L102-Y104 WeakPolarHBondContact O-CE2 3.37Å; L102-Y104 PolarHBondContact O-N 2.88Å; L102-E115 HydrophobicContact CD2-CG 4.42Å; L102-D118 HydrophobicContact CD1-CB 4.25Å
103	H	42.4	Very low	44.7	Very low	170 Å²	170	126.6 Å²	126.6	79%	0.787	66%	0.66	S	S	*	*			trans	-69.4	79.1	170.9	-80.7	-91.9	0	0	0	106.9	P101 L105	P101-H103 PolarHBondContact O-CD2 3.08Å; P101-H103 PolarHBondContact O-N 2.98Å; H103-L105 PolarHBondContact O-N 3.18Å
104	Y	43.3	Very low	46.9	Very low	149 Å²	149	122.7 Å²	122.7	58%	0.584	65%	0.65	S	S	*	*			trans	-51.8	113.3	167.4	-57.9	-78.2	0	0	0	106.3	L102 K106 E115	L102-Y104 HydrophobicContact CB-CE1 4.29Å; L102-Y104 HydrophobicContact CB-CE2 4.13Å; L102-Y104 WeakPolarHBondContact O-CD2 3.41Å; L102-Y104 WeakPolarHBondContact O-CE2 3.37Å; L102-Y104 PolarHBondContact O-N 2.88Å; Y104-K106 PolarHBondContact O-N 3.07Å; Y104-E115 WeakPolarHBondContact CA-OE1 3.27Å
105	L	39.2	Very low	49	Very low	121 Å²	121	114.6 Å²	114.6	63%	0.634	62%	0.615	S	S	*	*			trans	-68.1	73.2	160.6	-77.9	164.5	0	0	0	106.7	H103 S107 A108	H103-L105 PolarHBondContact O-N 3.18Å; L105-S107 PolarHBondContact O-N 3.38Å; L105-A108 PolarHBondContact O-N 3.03Å
106	K	48.6	Very low	51.2	Low	164 Å²	164	113.4 Å²	113.4	71%	0.713	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-17	-177.7	-173.9	172	-178	170.8	0	111.9	Y104 D262	Y104-K106 PolarHBondContact O-N 3.07Å; K106-D262 IonicContact NZ-OD1 3.07Å; K106-D262 PolarHBondContact NZ-OD1 3.47Å; K106-D262 VanDerWaalsContact NZ-OD1 3.07Å
107	S	41.7	Very low	53.6	Low	125 Å²	125	110.6 Å²	110.6	87%	0.874	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-16.7	-171.4	-40.1	0	0	0	0	115	L105	L105-S107 PolarHBondContact O-N 3.38Å
108	A	50.7	Low	55.7	Low	68 Å²	68	107.9 Å²	107.9	56%	0.562	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-14.4	-171.8	0	0	0	0	0	114.9	L105 V110	L105-A108 PolarHBondContact O-N 3.03Å; A108-V110 HydrophobicContact CB-CB 4.42Å; A108-V110 HydrophobicContact CB-CG2 4.36Å; A108-V110 PolarHBondContact O-N 3Å
109	G	51.6	Low	58.1	Low	67 Å²	67	103.8 Å²	103.8	69%	0.691	56%	0.556	S	S	*	*			trans	61.8	8	-172.8	0	0	0	0	0	114.1
110	V	56.3	Low	60.2	Low	105 Å²	105	101.2 Å²	101.2	64%	0.636	56%	0.555	S	S	*	*			trans	-99.5	103.5	174.9	-176.7	0	0	0	0	107	A108	A108-V110 HydrophobicContact CB-CB 4.42Å; A108-V110 HydrophobicContact CB-CG2 4.36Å; A108-V110 PolarHBondContact O-N 3Å
111	Y	63.3	Low	62.5	Low	127 Å²	127	95 Å²	95	50%	0.498	54%	0.535	S	S	.	.			trans	-69.7	132.3	166.9	-62.9	-83	0	0	0	108.5	E115 V116	Y111-E115 HydrophobicContact CD1-CB 4.23Å; Y111-V116 VanDerWaalsContact CB-CG2 3.42Å; Y111-V116 HydrophobicContact CG-CG2 4.26Å
112	T	74.6	Confident	64.9	Low	67 Å²	67	92.4 Å²	92.4	41%	0.411	52%	0.515	S	S	.	.			trans	-60.6	151.1	164.4	63	0	0	0	0	109.2	K114 E115 V116	T112-K114 PolarHBondContact O-N 3.11Å; T112-E115 WeakPolarHBondContact CB-OE2 3.38Å; T112-E115 PolarHBondContact N-OE2 3.29Å; T112-E115 PolarHBondContact O-N 2.96Å; T112-E115 WeakPolarHBondContact OG1-CG 3.37Å; T112-E115 PolarHBondContact OG1-N 3.39Å; T112-E115 PolarHBondContact OG1-OE2 3.25Å; T112-V116 PolarHBondContact O-N 3.26Å; T112-V116 VanDerWaalsContact O-N 3.1Å
113	G	74.6	Confident	66.8	Low	54 Å²	54	99.4 Å²	99.4	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-54.1	-32.3	178.5	0	0	0	0	0	112.9	I117	G113-I117 WeakPolarHBondContact O-CD1 3.44Å; G113-I117 VanDerWaalsContact O-CG1 3.26Å; G113-I117 WeakPolarHBondContact O-CG1 3.3Å; G113-I117 PolarHBondContact O-N 3.21Å
114	K	77.4	Confident	69	Low	152 Å²	152	99.3 Å²	99.3	66%	0.661	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-46.4	174.9	-169.4	177	179.8	-178.5	0	112.4	T112 V116 I117 D118	T112-K114 PolarHBondContact O-N 3.11Å; K114-V116 VanDerWaalsContact C-N 3.33Å; K114-V116 PolarHBondContact O-N 2.82Å; K114-I117 WeakPolarHBondContact O-CB 3.5Å; K114-I117 PolarHBondContact O-N 2.85Å; K114-D118 PolarHBondContact O-N 3.4Å
115	E	76.2	Confident	71.3	Confident	14 Å²	14	96.6 Å²	96.6	7%	0.065	52%	0.524	C	S	.	.	H	α-helix	trans	-65	-35.8	178.4	-71.1	164.3	139.3	0	0	112.6	L102 Y104 Y111 T112 I117 D118 L119	L102-E115 HydrophobicContact CD2-CG 4.42Å; Y104-E115 WeakPolarHBondContact CA-OE1 3.27Å; Y111-E115 HydrophobicContact CD1-CB 4.23Å; T112-E115 WeakPolarHBondContact CB-OE2 3.38Å; T112-E115 PolarHBondContact N-OE2 3.29Å; T112-E115 PolarHBondContact O-N 2.96Å; T112-E115 WeakPolarHBondContact OG1-CG 3.37Å; T112-E115 PolarHBondContact OG1-N 3.39Å; T112-E115 PolarHBondContact OG1-OE2 3.25Å; E115-I117 VanDerWaalsContact C-N 3.32Å; E115-D118 PolarHBondContact O-N 3.46Å; E115-L119 WeakPolarHBondContact O-CB 3.33Å; E115-L119 PolarHBondContact O-N 3.24Å
116	V	77	Confident	73.6	Confident	76 Å²	76	94.5 Å²	94.5	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-41.3	174.8	178.9	0	0	0	0	110.8	Y111 T112 K114 A120	Y111-V116 VanDerWaalsContact CB-CG2 3.42Å; Y111-V116 HydrophobicContact CG-CG2 4.26Å; T112-V116 PolarHBondContact O-N 3.26Å; T112-V116 VanDerWaalsContact O-N 3.1Å; K114-V116 VanDerWaalsContact C-N 3.33Å; K114-V116 PolarHBondContact O-N 2.82Å; V116-A120 VanDerWaalsContact O-CB 3.31Å; V116-A120 WeakPolarHBondContact O-CB 3.3Å; V116-A120 PolarHBondContact O-N 3.36Å
117	I	79.9	Confident	75.4	Confident	105 Å²	105	93.1 Å²	93.1	54%	0.538	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-47.2	177	-67.1	164.2	0	0	0	110.2	G113 K114 E115 L119 A120 I121	G113-I117 WeakPolarHBondContact O-CD1 3.44Å; G113-I117 VanDerWaalsContact O-CG1 3.26Å; G113-I117 WeakPolarHBondContact O-CG1 3.3Å; G113-I117 PolarHBondContact O-N 3.21Å; K114-I117 WeakPolarHBondContact O-CB 3.5Å; K114-I117 PolarHBondContact O-N 2.85Å; E115-I117 VanDerWaalsContact C-N 3.32Å; I117-L119 PolarHBondContact O-N 3.23Å; I117-A120 WeakPolarHBondContact O-CB 3.47Å; I117-A120 PolarHBondContact O-N 2.85Å; I117-A120 VanDerWaalsContact O-N 3.16Å; I117-I121 HydrophobicContact CG2-CD1 3.84Å; I117-I121 HydrophobicContact CG2-CG1 4.44Å; I117-I121 VanDerWaalsContact O-CG1 3.3Å; I117-I121 WeakPolarHBondContact O-CG1 3.35Å; I117-I121 PolarHBondContact O-N 2.88Å
118	D	83.8	Confident	77.7	Confident	42 Å²	42	92.3 Å²	92.3	23%	0.225	49%	0.491	C	S	.	.	H	α-helix	trans	-61.6	-43	178.9	-70.1	-30.1	0	0	0	111.7	L102 K114 E115 A120 I121 D122	L102-D118 HydrophobicContact CD1-CB 4.25Å; K114-D118 PolarHBondContact O-N 3.4Å; E115-D118 PolarHBondContact O-N 3.46Å; D118-A120 VanDerWaalsContact C-N 3.33Å; D118-A120 PolarHBondContact O-N 2.86Å; D118-I121 PolarHBondContact O-N 3.22Å; D118-D122 PolarHBondContact O-N 3.42Å
119	L	82.1	Confident	79.5	Confident	98 Å²	98	94.2 Å²	94.2	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-38.1	175.4	-172	71.8	0	0	0	112.1	E115 I117 R123	E115-L119 WeakPolarHBondContact O-CB 3.33Å; E115-L119 PolarHBondContact O-N 3.24Å; I117-L119 PolarHBondContact O-N 3.23Å; L119-R123 VanDerWaalsContact O-CB 3.28Å; L119-R123 WeakPolarHBondContact O-CB 3.45Å; L119-R123 PolarHBondContact O-N 3.43Å
120	A	81.3	Confident	81.4	Confident	57 Å²	57	96.3 Å²	96.3	47%	0.471	49%	0.486	S	S	.	.	H	α-helix	trans	-65.5	-40.2	175.6	0	0	0	0	0	111.4	V116 I117 D118 W124	V116-A120 VanDerWaalsContact O-CB 3.31Å; V116-A120 WeakPolarHBondContact O-CB 3.3Å; V116-A120 PolarHBondContact O-N 3.36Å; I117-A120 WeakPolarHBondContact O-CB 3.47Å; I117-A120 PolarHBondContact O-N 2.85Å; I117-A120 VanDerWaalsContact O-N 3.16Å; D118-A120 VanDerWaalsContact C-N 3.33Å; D118-A120 PolarHBondContact O-N 2.86Å; A120-W124 WeakPolarHBondContact O-CB 3.31Å; A120-W124 PolarHBondContact O-N 3.42Å
121	I	86.9	Confident	82.8	Confident	72 Å²	72	93.2 Å²	93.2	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-51.2	174.3	-67.9	166	0	0	0	110	I117 D118 R123 W124 E125	I117-I121 HydrophobicContact CG2-CD1 3.84Å; I117-I121 HydrophobicContact CG2-CG1 4.44Å; I117-I121 VanDerWaalsContact O-CG1 3.3Å; I117-I121 WeakPolarHBondContact O-CG1 3.35Å; I117-I121 PolarHBondContact O-N 2.88Å; D118-I121 PolarHBondContact O-N 3.22Å; I121-R123 VanDerWaalsContact C-N 3.28Å; I121-R123 PolarHBondContact O-N 3.19Å; I121-W124 WeakPolarHBondContact O-CB 3.43Å; I121-W124 PolarHBondContact O-N 3.33Å; I121-W124 VanDerWaalsContact O-N 3.08Å; I121-E125 HydrophobicContact CG2-CG 4.38Å; I121-E125 WeakPolarHBondContact O-CG 3.15Å; I121-E125 PolarHBondContact O-N 3.4Å
122	D	88.7	Confident	84.1	Confident	56 Å²	56	92.9 Å²	92.9	30%	0.299	47%	0.472	S	S	.	.	H	α-helix	trans	-59.9	-39.4	-179.6	-73	-11.4	0	0	0	111.9	K99 D118 S126	K99-D122 IonicContact NZ-OD1 2.63Å; K99-D122 PolarHBondContact NZ-OD1 2.9Å; D118-D122 PolarHBondContact O-N 3.42Å; D122-S126 WeakPolarHBondContact O-CB 3.26Å; D122-S126 PolarHBondContact O-N 3.15Å; D122-S126 PolarHBondContact O-OG 3.33Å
123	R	84.3	Confident	84.8	Confident	198 Å²	198	95.9 Å²	95.9	75%	0.747	48%	0.481	S	S	*	.	H	α-helix	trans	-67.1	-41.3	175.4	-176	175.5	-178.4	146	1.1	112	L119 I121 S126 Y127	L119-R123 VanDerWaalsContact O-CB 3.28Å; L119-R123 WeakPolarHBondContact O-CB 3.45Å; L119-R123 PolarHBondContact O-N 3.43Å; I121-R123 VanDerWaalsContact C-N 3.28Å; I121-R123 PolarHBondContact O-N 3.19Å; R123-S126 PolarHBondContact O-N 3.48Å; R123-Y127 WeakPolarHBondContact O-CB 3.39Å; R123-Y127 PolarHBondContact O-N 3.47Å
124	W	88.2	Confident	85.5	Confident	168 Å²	168	96.2 Å²	96.2	64%	0.636	48%	0.478	S	S	*	.	H	α-helix	trans	-65.1	-43.7	177	176.9	-113.3	0	0	0	111.6	A120 I121 S126 Y127 K128	A120-W124 WeakPolarHBondContact O-CB 3.31Å; A120-W124 PolarHBondContact O-N 3.42Å; I121-W124 WeakPolarHBondContact O-CB 3.43Å; I121-W124 PolarHBondContact O-N 3.33Å; I121-W124 VanDerWaalsContact O-N 3.08Å; W124-S126 VanDerWaalsContact C-N 3.34Å; W124-S126 PolarHBondContact O-N 3.11Å; W124-Y127 HydrophobicContact CE3-CD1 4.05Å; W124-Y127 HydrophobicContact CH2-CD1 4.45Å; W124-Y127 AromaticContact CZ3-CD1 3.74Å; W124-Y127 HydrophobicContact CZ3-CD1 3.74Å; W124-Y127 HydrophobicContact CZ3-CE1 4.07Å; W124-Y127 PolarHBondContact O-N 2.99Å; W124-K128 WeakPolarHBondContact O-CB 2.98Å; W124-K128 PolarHBondContact O-N 2.96Å
125	E	90.8	Very high	86	Confident	93 Å²	93	94.4 Å²	94.4	44%	0.435	48%	0.475	S	S	.	.	H	α-helix	trans	-60.6	-44	174.7	-72.8	-177.4	170.9	0	0	111.5	I121 Y127 K128 N129	I121-E125 HydrophobicContact CG2-CG 4.38Å; I121-E125 WeakPolarHBondContact O-CG 3.15Å; I121-E125 PolarHBondContact O-N 3.4Å; E125-Y127 PolarHBondContact O-N 3.35Å; E125-K128 PolarHBondContact O-N 2.85Å; E125-N129 WeakPolarHBondContact O-CB 3.45Å; E125-N129 VanDerWaalsContact O-CG 3.26Å; E125-N129 PolarHBondContact O-N 3.43Å; E125-N129 PolarHBondContact O-ND2 3.12Å
126	S	87.5	Confident	86.7	Confident	77 Å²	77	100.8 Å²	100.8	54%	0.538	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-44.5	175.8	-61.3	0	0	0	0	112.1	D122 R123 W124 N129 L130	D122-S126 WeakPolarHBondContact O-CB 3.26Å; D122-S126 PolarHBondContact O-N 3.15Å; D122-S126 PolarHBondContact O-OG 3.33Å; R123-S126 PolarHBondContact O-N 3.48Å; W124-S126 VanDerWaalsContact C-N 3.34Å; W124-S126 PolarHBondContact O-N 3.11Å; S126-N129 PolarHBondContact O-N 2.93Å; S126-L130 PolarHBondContact O-N 3.37Å
127	Y	86.7	Confident	87.3	Confident	134 Å²	134	100.3 Å²	100.3	53%	0.525	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-43.4	176.5	176.2	-104.8	0	0	0	112.2	R123 W124 E125 N129 L130 C131	R123-Y127 WeakPolarHBondContact O-CB 3.39Å; R123-Y127 PolarHBondContact O-N 3.47Å; W124-Y127 HydrophobicContact CE3-CD1 4.05Å; W124-Y127 HydrophobicContact CH2-CD1 4.45Å; W124-Y127 AromaticContact CZ3-CD1 3.74Å; W124-Y127 HydrophobicContact CZ3-CD1 3.74Å; W124-Y127 HydrophobicContact CZ3-CE1 4.07Å; W124-Y127 PolarHBondContact O-N 2.99Å; E125-Y127 PolarHBondContact O-N 3.35Å; Y127-N129 PolarHBondContact O-N 2.96Å; Y127-L130 PolarHBondContact O-N 2.74Å; Y127-C131 PolarHBondContact O-N 3.46Å; Y127-C131 PolarHBondContact O-SG 3.32Å
128	K	89.4	Confident	87.7	Confident	109 Å²	109	99.9 Å²	99.9	47%	0.474	50%	0.495	S	S	.	.	H	α-helix	trans	-59.6	-46	176.2	-178.3	-175.4	174	-172.3	0	111.1	W124 E125 L130 C131 H132	W124-K128 WeakPolarHBondContact O-CB 2.98Å; W124-K128 PolarHBondContact O-N 2.96Å; E125-K128 PolarHBondContact O-N 2.85Å; K128-L130 VanDerWaalsContact C-N 3.35Å; K128-L130 PolarHBondContact O-N 3.47Å; K128-C131 PolarHBondContact O-N 3.07Å; K128-H132 PolarHBondContact O-CD2 2.98Å; K128-H132 VanDerWaalsContact O-CD2 3.29Å; K128-H132 PolarHBondContact O-N 2.96Å
129	N	90	Very high	87.9	Confident	107 Å²	107	106.2 Å²	106.2	57%	0.572	52%	0.516	S	S	*	.	H	α-helix	trans	-62.2	-42.2	178.5	-71.7	-22.5	0	0	0	111.7	E125 S126 Y127 C131 H132 Q133	E125-N129 WeakPolarHBondContact O-CB 3.45Å; E125-N129 VanDerWaalsContact O-CG 3.26Å; E125-N129 PolarHBondContact O-N 3.43Å; E125-N129 PolarHBondContact O-ND2 3.12Å; S126-N129 PolarHBondContact O-N 2.93Å; Y127-N129 PolarHBondContact O-N 2.96Å; N129-C131 PolarHBondContact O-N 2.88Å; N129-H132 PolarHBondContact O-N 3.45Å; N129-Q133 PolarHBondContact O-N 2.91Å
130	L	90.1	Very high	88.2	Confident	111 Å²	111	105.1 Å²	105.1	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-41.8	175.7	-171.9	68.6	0	0	0	112	S126 Y127 K128 Q133 A134	S126-L130 PolarHBondContact O-N 3.37Å; Y127-L130 PolarHBondContact O-N 2.74Å; K128-L130 VanDerWaalsContact C-N 3.35Å; K128-L130 PolarHBondContact O-N 3.47Å; L130-Q133 PolarHBondContact O-N 2.68Å; L130-A134 WeakPolarHBondContact O-CB 3.1Å; L130-A134 PolarHBondContact O-N 2.82Å
131	C	87.1	Confident	88.4	Confident	41 Å²	41	108.2 Å²	108.2	28%	0.277	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-43.9	176	-68	0	0	0	0	111.9	Y127 K128 N129 Q133 A134 L135	Y127-C131 PolarHBondContact O-N 3.46Å; Y127-C131 PolarHBondContact O-SG 3.32Å; K128-C131 PolarHBondContact O-N 3.07Å; N129-C131 PolarHBondContact O-N 2.88Å; C131-Q133 VanDerWaalsContact C-N 3.32Å; C131-Q133 PolarHBondContact O-N 2.82Å; C131-A134 PolarHBondContact O-N 2.81Å; C131-L135 WeakPolarHBondContact O-CB 3.45Å; C131-L135 WeakPolarHBondContact O-CG 3.44Å; C131-L135 PolarHBondContact O-N 3.47Å
132	H	89.2	Confident	88.3	Confident	120 Å²	120	110 Å²	110	56%	0.556	52%	0.523	S	S	*	.	H	α-helix	trans	-59.1	-43.4	174.9	-90.5	-110.2	0	0	0	111.6	K128 N129 L135 Y136	K128-H132 PolarHBondContact O-CD2 2.98Å; K128-H132 VanDerWaalsContact O-CD2 3.29Å; K128-H132 PolarHBondContact O-N 2.96Å; N129-H132 PolarHBondContact O-N 3.45Å; H132-L135 PolarHBondContact O-N 3.49Å; H132-Y136 WeakPolarHBondContact O-CB 3.49Å; H132-Y136 PolarHBondContact O-N 2.71Å
133	Q	90.2	Very high	88.1	Confident	130 Å²	130	109.8 Å²	109.8	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-65.6	-43.6	178	-169.5	174.3	9.6	0	0	111.9	N129 L130 C131 Y136 V137	N129-Q133 PolarHBondContact O-N 2.91Å; L130-Q133 PolarHBondContact O-N 2.68Å; C131-Q133 VanDerWaalsContact C-N 3.32Å; C131-Q133 PolarHBondContact O-N 2.82Å; Q133-Y136 PolarHBondContact O-N 3.25Å; Q133-V137 WeakPolarHBondContact O-CG2 3.21Å; Q133-V137 PolarHBondContact O-N 3.07Å
134	A	88.1	Confident	88.1	Confident	60 Å²	60	104.9 Å²	104.9	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-43.1	176.7	0	0	0	0	0	112.2	L130 C131 V137 L138	L130-A134 WeakPolarHBondContact O-CB 3.1Å; L130-A134 PolarHBondContact O-N 2.82Å; C131-A134 PolarHBondContact O-N 2.81Å; A134-V137 PolarHBondContact O-N 3.5Å; A134-L138 WeakPolarHBondContact O-CB 3.26Å; A134-L138 PolarHBondContact O-N 2.82Å
135	L	88.4	Confident	87.8	Confident	114 Å²	114	100.1 Å²	100.1	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-65.5	-38.1	175.8	-73.2	173.1	0	0	0	112.1	C131 H132 L138 R139	C131-L135 WeakPolarHBondContact O-CB 3.45Å; C131-L135 WeakPolarHBondContact O-CG 3.44Å; C131-L135 PolarHBondContact O-N 3.47Å; H132-L135 PolarHBondContact O-N 3.49Å; L135-L138 PolarHBondContact O-N 2.85Å; L135-R139 WeakPolarHBondContact O-CB 3.5Å; L135-R139 PolarHBondContact O-N 2.79Å
136	Y	90.8	Very high	87.5	Confident	149 Å²	149	103 Å²	103	58%	0.584	52%	0.516	S	S	*	.	H	α-helix	trans	-61.4	-47.3	174.7	179.9	-94	0	0	0	111.4	H132 Q133 L138 R139 Q140	H132-Y136 WeakPolarHBondContact O-CB 3.49Å; H132-Y136 PolarHBondContact O-N 2.71Å; Q133-Y136 PolarHBondContact O-N 3.25Å; Y136-L138 VanDerWaalsContact C-N 3.35Å; Y136-L138 PolarHBondContact O-N 3.17Å; Y136-R139 PolarHBondContact O-N 3Å; Y136-Q140 WeakPolarHBondContact O-CB 3.22Å; Y136-Q140 PolarHBondContact O-N 3.3Å
137	V	89.8	Confident	87.1	Confident	66 Å²	66	103.5 Å²	103.5	40%	0.4	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176.6	172.7	0	0	0	0	111.1	Q133 A134 Q140 Q141	Q133-V137 WeakPolarHBondContact O-CG2 3.21Å; Q133-V137 PolarHBondContact O-N 3.07Å; A134-V137 PolarHBondContact O-N 3.5Å; V137-Q140 PolarHBondContact O-N 2.92Å; V137-Q141 HydrophobicContact CG1-CG 4.47Å; V137-Q141 VanDerWaalsContact O-CG 3.32Å; V137-Q141 WeakPolarHBondContact O-CG 3.5Å; V137-Q141 PolarHBondContact O-N 2.88Å
138	L	87.8	Confident	86.9	Confident	95 Å²	95	100.1 Å²	100.1	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-64.5	-41.3	178.2	-175.1	137.7	0	0	0	111.9	A134 L135 Y136 Q141 L142	A134-L138 WeakPolarHBondContact O-CB 3.26Å; A134-L138 PolarHBondContact O-N 2.82Å; L135-L138 PolarHBondContact O-N 2.85Å; Y136-L138 VanDerWaalsContact C-N 3.35Å; Y136-L138 PolarHBondContact O-N 3.17Å; L138-Q141 PolarHBondContact O-N 3Å; L138-L142 HydrophobicContact CD2-CD1 3.69Å; L138-L142 HydrophobicContact CD2-CG 4.41Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 2.92Å
139	R	89.4	Confident	86.4	Confident	175 Å²	175	101.5 Å²	101.5	66%	0.66	51%	0.51	S	S	*	.	H	α-helix	trans	-60.3	-46.7	173.4	-177.1	-176.9	-178.9	-161.5	0.5	110.8	L135 Y136 Q141 L142 V143	L135-R139 WeakPolarHBondContact O-CB 3.5Å; L135-R139 PolarHBondContact O-N 2.79Å; Y136-R139 PolarHBondContact O-N 3Å; R139-Q141 VanDerWaalsContact C-N 3.35Å; R139-Q141 PolarHBondContact O-N 3.41Å; R139-L142 PolarHBondContact O-N 2.95Å; R139-V143 HydrophobicContact CG-CG2 4.43Å; R139-V143 WeakPolarHBondContact O-CB 3.46Å; R139-V143 VanDerWaalsContact O-CG2 3.27Å; R139-V143 WeakPolarHBondContact O-CG2 3.47Å; R139-V143 PolarHBondContact O-N 2.87Å
140	Q	87.8	Confident	85.9	Confident	75 Å²	75	98 Å²	98	35%	0.35	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-44.9	178.9	-168.6	60.2	44.4	0	0	111	Y136 V137 L142 V143 D144	Y136-Q140 WeakPolarHBondContact O-CB 3.22Å; Y136-Q140 PolarHBondContact O-N 3.3Å; V137-Q140 PolarHBondContact O-N 2.92Å; Q140-L142 VanDerWaalsContact C-N 3.34Å; Q140-L142 PolarHBondContact O-N 3.35Å; Q140-V143 PolarHBondContact O-N 3.29Å; Q140-D144 PolarHBondContact NE2-OD1 3.21Å; Q140-D144 WeakPolarHBondContact O-CB 3.33Å; Q140-D144 PolarHBondContact O-N 2.75Å
141	Q	85.7	Confident	85.4	Confident	123 Å²	123	96.4 Å²	96.4	58%	0.575	49%	0.487	S	S	*	.	H	α-helix	trans	-61.6	-39.1	176.2	-73.3	176	-5.6	0	0	113	V137 L138 R139 A145	V137-Q141 HydrophobicContact CG1-CG 4.47Å; V137-Q141 VanDerWaalsContact O-CG 3.32Å; V137-Q141 WeakPolarHBondContact O-CG 3.5Å; V137-Q141 PolarHBondContact O-N 2.88Å; L138-Q141 PolarHBondContact O-N 3Å; R139-Q141 VanDerWaalsContact C-N 3.35Å; R139-Q141 PolarHBondContact O-N 3.41Å; Q141-A145 WeakPolarHBondContact O-CB 3.32Å; Q141-A145 PolarHBondContact O-N 3.18Å
142	L	84	Confident	85.1	Confident	109 Å²	109	99.9 Å²	99.9	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-66.2	-42.7	175	-75.8	173.2	0	0	0	111.5	L138 R139 Q140 A145 Y146	L138-L142 HydrophobicContact CD2-CD1 3.69Å; L138-L142 HydrophobicContact CD2-CG 4.41Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 2.92Å; R139-L142 PolarHBondContact O-N 2.95Å; Q140-L142 VanDerWaalsContact C-N 3.34Å; Q140-L142 PolarHBondContact O-N 3.35Å; L142-A145 PolarHBondContact O-N 3.35Å; L142-Y146 WeakPolarHBondContact O-CB 3.32Å; L142-Y146 PolarHBondContact O-N 2.81Å
143	V	85.5	Confident	84.5	Confident	52 Å²	52	99.2 Å²	99.2	32%	0.315	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-47	177	171.3	0	0	0	0	110.6	R139 Q140 A145 Y146 I147	R139-V143 HydrophobicContact CG-CG2 4.43Å; R139-V143 WeakPolarHBondContact O-CB 3.46Å; R139-V143 VanDerWaalsContact O-CG2 3.27Å; R139-V143 WeakPolarHBondContact O-CG2 3.47Å; R139-V143 PolarHBondContact O-N 2.87Å; Q140-V143 PolarHBondContact O-N 3.29Å; V143-A145 VanDerWaalsContact C-N 3.27Å; V143-A145 PolarHBondContact O-N 2.99Å; V143-Y146 PolarHBondContact O-N 3.1Å; V143-I147 HydrophobicContact CG1-CD1 3.35Å; V143-I147 HydrophobicContact CG1-CG1 3.98Å; V143-I147 WeakPolarHBondContact O-CB 3.04Å; V143-I147 WeakPolarHBondContact O-CG1 3.32Å; V143-I147 PolarHBondContact O-N 3.14Å
144	D	83.3	Confident	83.9	Confident	94 Å²	94	96.1 Å²	96.1	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-64.6	-31.1	178.6	-67.2	-15.6	0	0	0	112.3	Q140 P148	Q140-D144 PolarHBondContact NE2-OD1 3.21Å; Q140-D144 WeakPolarHBondContact O-CB 3.33Å; Q140-D144 PolarHBondContact O-N 2.75Å; D144-P148 WeakPolarHBondContact O-CD 3.32Å; D144-P148 WeakPolarHBondContact O-CG 3.39Å
145	A	82.2	Confident	83.5	Confident	68 Å²	68	99.9 Å²	99.9	56%	0.562	49%	0.494	S	S	*	.	H	α-helix	trans	-81.3	-38.2	175	0	0	0	0	0	112.6	Q141 L142 V143	Q141-A145 WeakPolarHBondContact O-CB 3.32Å; Q141-A145 PolarHBondContact O-N 3.18Å; L142-A145 PolarHBondContact O-N 3.35Å; V143-A145 VanDerWaalsContact C-N 3.27Å; V143-A145 PolarHBondContact O-N 2.99Å
146	Y	85.2	Confident	82.7	Confident	154 Å²	154	98 Å²	98	60%	0.604	50%	0.495	S	S	*	.	H	α-helix	trans	-82.5	-40.4	-172.7	-175.5	-97.7	0	0	0	113.1	L142 V143 Y149 A150	L142-Y146 WeakPolarHBondContact O-CB 3.32Å; L142-Y146 PolarHBondContact O-N 2.81Å; V143-Y146 PolarHBondContact O-N 3.1Å; Y146-Y149 WeakPolarHBondContact O-CB 3.48Å; Y146-Y149 PolarHBondContact O-N 2.98Å; Y146-Y149 VanDerWaalsContact O-N 3.15Å; Y146-A150 HydrophobicContact CD1-CB 4.43Å; Y146-A150 HydrophobicContact CE1-CB 4.07Å; Y146-A150 WeakPolarHBondContact O-CB 3.21Å; Y146-A150 PolarHBondContact O-N 3.34Å
147	I	78.9	Confident	81.2	Confident	88 Å²	88	94.8 Å²	94.8	45%	0.451	49%	0.494	S	S	.	.	H	α-helix	trans	-57.5	-49.3	-179.6	-72.3	179.1	0	0	0	111.5	V143 Y149 A150 I151	V143-I147 HydrophobicContact CG1-CD1 3.35Å; V143-I147 HydrophobicContact CG1-CG1 3.98Å; V143-I147 WeakPolarHBondContact O-CB 3.04Å; V143-I147 WeakPolarHBondContact O-CG1 3.32Å; V143-I147 PolarHBondContact O-N 3.14Å; I147-Y149 VanDerWaalsContact C-N 3.31Å; I147-Y149 PolarHBondContact O-N 3.13Å; I147-A150 PolarHBondContact O-N 3.11Å; I147-I151 HydrophobicContact CG2-CD1 3.68Å; I147-I151 HydrophobicContact CG2-CG1 4.42Å; I147-I151 VanDerWaalsContact O-CG1 3.26Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 3.49Å
148	P	81.9	Confident	79.7	Confident	63 Å²	63	96.4 Å²	96.4	41%	0.409	51%	0.508	S	S	.	.	H	α-helix	trans	-60.4	-41.6	176.1	-24.4	35.7	0	0	0	112.3	D144 I151 E152	D144-P148 WeakPolarHBondContact O-CD 3.32Å; D144-P148 WeakPolarHBondContact O-CG 3.39Å; P148-I151 PolarHBondContact O-N 2.82Å; P148-E152 WeakPolarHBondContact O-CG 3.33Å; P148-E152 PolarHBondContact O-N 3.31Å
149	Y	79.9	Confident	78	Confident	137 Å²	137	97.2 Å²	97.2	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-46.5	178.2	179.3	-91.4	0	0	0	112	Y146 I147 I151 E152 E153	Y146-Y149 WeakPolarHBondContact O-CB 3.48Å; Y146-Y149 PolarHBondContact O-N 2.98Å; Y146-Y149 VanDerWaalsContact O-N 3.15Å; I147-Y149 VanDerWaalsContact C-N 3.31Å; I147-Y149 PolarHBondContact O-N 3.13Å; Y149-I151 PolarHBondContact O-N 2.82Å; Y149-E152 PolarHBondContact O-N 2.79Å; Y149-E153 WeakPolarHBondContact CE1-OE2 3.34Å; Y149-E153 PolarHBondContact O-N 3.26Å
150	A	78.3	Confident	75.7	Confident	34 Å²	34	97.3 Å²	97.3	28%	0.281	52%	0.523	S	S	.	.	H	α-helix	trans	-66.6	-36	178.1	0	0	0	0	0	112.7	Y146 I147 E152 E153 S154	Y146-A150 HydrophobicContact CD1-CB 4.43Å; Y146-A150 HydrophobicContact CE1-CB 4.07Å; Y146-A150 WeakPolarHBondContact O-CB 3.21Å; Y146-A150 PolarHBondContact O-N 3.34Å; I147-A150 PolarHBondContact O-N 3.11Å; A150-E152 VanDerWaalsContact C-N 3.33Å; A150-E153 PolarHBondContact O-N 2.78Å; A150-S154 WeakPolarHBondContact O-CB 3.33Å; A150-S154 PolarHBondContact O-N 2.76Å; A150-S154 PolarHBondContact O-OG 2.69Å
151	I	79.7	Confident	73.6	Confident	78 Å²	78	99.4 Å²	99.4	40%	0.4	54%	0.543	S	S	.	.	H	α-helix	trans	-65.3	-38.3	172.9	-68	168.2	0	0	0	110.7	I147 P148 Y149 S154 K155	I147-I151 HydrophobicContact CG2-CD1 3.68Å; I147-I151 HydrophobicContact CG2-CG1 4.42Å; I147-I151 VanDerWaalsContact O-CG1 3.26Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 3.49Å; P148-I151 PolarHBondContact O-N 2.82Å; Y149-I151 PolarHBondContact O-N 2.82Å; I151-S154 WeakPolarHBondContact CA-OG 3.35Å; I151-S154 PolarHBondContact O-OG 2.91Å; I151-K155 HydrophobicContact CG2-CD 4.26Å; I151-K155 VanDerWaalsContact O-CG 3.3Å; I151-K155 WeakPolarHBondContact O-CG 3.16Å; I151-K155 PolarHBondContact O-N 3.24Å
152	E	80.4	Confident	71.4	Confident	113 Å²	113	99.8 Å²	99.8	53%	0.528	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-40.8	175.3	-74.1	-176.1	177.3	0	0	112.2	P148 Y149 A150 K155 A156	P148-E152 WeakPolarHBondContact O-CG 3.33Å; P148-E152 PolarHBondContact O-N 3.31Å; Y149-E152 PolarHBondContact O-N 2.79Å; A150-E152 VanDerWaalsContact C-N 3.33Å; E152-K155 PolarHBondContact O-N 3.49Å; E152-A156 WeakPolarHBondContact O-CB 3.27Å; E152-A156 PolarHBondContact O-N 2.84Å
153	E	77.8	Confident	69.1	Low	107 Å²	107	102.3 Å²	102.3	50%	0.5	57%	0.566	S	S	.	*	H	α-helix	trans	-67.1	-42.2	178.6	-171.3	172.9	-175.6	0	0	112.3	Y149 A150 K155 A156 S157	Y149-E153 WeakPolarHBondContact CE1-OE2 3.34Å; Y149-E153 PolarHBondContact O-N 3.26Å; A150-E153 PolarHBondContact O-N 2.78Å; E153-K155 PolarHBondContact O-N 3.36Å; E153-A156 WeakPolarHBondContact O-CB 3.24Å; E153-A156 PolarHBondContact O-N 3.36Å; E153-S157 PolarHBondContact O-N 3.46Å; E153-S157 PolarHBondContact O-OG 2.93Å
154	S	77.4	Confident	66.6	Low	64 Å²	64	106.7 Å²	106.7	45%	0.448	59%	0.588	S	S	.	*	H	α-helix	trans	-64.7	-35.9	175.4	55.5	0	0	0	0	113.1	A150 I151 S157 S158	A150-S154 WeakPolarHBondContact O-CB 3.33Å; A150-S154 PolarHBondContact O-N 2.76Å; A150-S154 PolarHBondContact O-OG 2.69Å; I151-S154 WeakPolarHBondContact CA-OG 3.35Å; I151-S154 PolarHBondContact O-OG 2.91Å; S154-S157 PolarHBondContact O-OG 2.72Å; S154-S157 VanDerWaalsContact O-OG 3.11Å; S154-S158 WeakPolarHBondContact O-CB 3.35Å; S154-S158 PolarHBondContact O-N 2.86Å
155	K	78.6	Confident	64.2	Low	140 Å²	140	111.7 Å²	111.7	61%	0.609	61%	0.605	S	S	*	*	H	α-helix	trans	-68.1	-37.6	171.9	-73.5	173.1	-177.9	174.5	0	111.9	I151 E152 E153 T159	I151-K155 HydrophobicContact CG2-CD 4.26Å; I151-K155 VanDerWaalsContact O-CG 3.3Å; I151-K155 WeakPolarHBondContact O-CG 3.16Å; I151-K155 PolarHBondContact O-N 3.24Å; E152-K155 PolarHBondContact O-N 3.49Å; E153-K155 PolarHBondContact O-N 3.36Å; K155-T159 PolarHBondContact O-OG1 3.39Å
156	A	71.8	Confident	61.9	Low	74 Å²	74	111.4 Å²	111.4	61%	0.612	61%	0.61	S	S	*	*	H	α-helix	trans	-68	-37.4	176.3	0	0	0	0	0	112.2	E152 E153	E152-A156 WeakPolarHBondContact O-CB 3.27Å; E152-A156 PolarHBondContact O-N 2.84Å; E153-A156 WeakPolarHBondContact O-CB 3.24Å; E153-A156 PolarHBondContact O-N 3.36Å
157	S	60.2	Low	59.4	Low	81 Å²	81	111.4 Å²	111.4	57%	0.566	62%	0.62	S	S	*	*	H	α-helix	trans	-78.2	-29.9	179.5	67.8	0	0	0	0	113.7	E153 S154 T159	E153-S157 PolarHBondContact O-N 3.46Å; E153-S157 PolarHBondContact O-OG 2.93Å; S154-S157 PolarHBondContact O-OG 2.72Å; S154-S157 VanDerWaalsContact O-OG 3.11Å; S157-T159 PolarHBondContact O-N 3.3Å
158	S	59.1	Low	57.4	Low	100 Å²	100	113.7 Å²	113.7	70%	0.699	64%	0.638	S	S	*	*	H	α-helix	trans	-69.2	-19.5	174	175.1	0	0	0	0	113.2	S154 K160	S154-S158 WeakPolarHBondContact O-CB 3.35Å; S154-S158 PolarHBondContact O-N 2.86Å; S158-K160 PolarHBondContact O-N 2.95Å; S158-K160 VanDerWaalsContact O-N 3.07Å
159	T	51.2	Low	55.4	Low	112 Å²	112	118 Å²	118	69%	0.687	66%	0.656	S	S	*	*			trans	-87.7	50.1	177.1	-34.1	0	0	0	0	111.6	K155 S157	K155-T159 PolarHBondContact O-OG1 3.39Å; S157-T159 PolarHBondContact O-N 3.3Å
160	K	41.2	Very low	53.6	Low	178 Å²	178	117.4 Å²	117.4	77%	0.774	67%	0.672	S	S	*	*			trans	-86.9	115.8	155	-80.9	-173.5	178.7	178	0	107	S158 V162	S158-K160 PolarHBondContact O-N 2.95Å; S158-K160 VanDerWaalsContact O-N 3.07Å; K160-V162 PolarHBondContact O-N 3.46Å
161	P	43	Very low	51.6	Low	119 Å²	119	120.8 Å²	120.8	77%	0.773	69%	0.689	S	S	*	*			trans	-67.6	103.3	-179.7	27.1	-31.8	0	0	0	109	L163	P161-L163 VanDerWaalsContact C-N 3.26Å; P161-L163 PolarHBondContact O-N 3.39Å; P161-L163 VanDerWaalsContact O-N 3.1Å
162	V	40.1	Very low	49.6	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	71%	0.709	S	S	*	*			trans	-68.6	101.6	148.8	178.3	0	0	0	0	104.4	K160 D164	K160-V162 PolarHBondContact O-N 3.46Å; V162-D164 PolarHBondContact O-N 2.96Å
163	L	35.9	Very low	48.1	Very low	162 Å²	162	123 Å²	123	85%	0.848	71%	0.709	S	S	*	*			trans	-59.5	90.7	169.2	-177	86.1	0	0	0	107	P161	P161-L163 VanDerWaalsContact C-N 3.26Å; P161-L163 PolarHBondContact O-N 3.39Å; P161-L163 VanDerWaalsContact O-N 3.1Å
164	D	33.2	Very low	47.1	Very low	145 Å²	145	122.4 Å²	122.4	78%	0.775	72%	0.717	S	S	*	*			trans	-124.8	132.7	162.4	-135.1	-17.6	0	0	0	112.2	V162	V162-D164 PolarHBondContact O-N 2.96Å
165	K	32.9	Very low	46.2	Very low	198 Å²	198	124.1 Å²	124.1	86%	0.861	73%	0.727	S	S	*	*			trans	-76.9	147.5	-167.7	-79	164.9	169	171.9	0	110.1
166	G	32.9	Very low	45.3	Very low	63 Å²	63	122.4 Å²	122.4	65%	0.649	73%	0.725	S	S	*	*			trans	129.8	106.1	144.6	0	0	0	0	0	114.7
167	N	32.8	Very low	44.9	Very low	154 Å²	154	126.7 Å²	126.7	82%	0.824	73%	0.725	S	S	*	*			trans	45.8	125	137.7	-57.5	-1.4	0	0	0	117
168	T	37.3	Very low	45.1	Very low	136 Å²	136	132.7 Å²	132.7	83%	0.834	74%	0.735	S	S	*	*				-168.6	151.2	61.3	-32.8	0	0	0	0	109.6
169	I	38.9	Very low	45.3	Very low	154 Å²	154	137.4 Å²	137.4	79%	0.79	74%	0.738	S	S	*	*			trans	-57.8	132.2	-178.8	-63.1	152.5	0	0	0	112
170	S	42.2	Very low	46.1	Very low	124 Å²	124	137.8 Å²	137.8	87%	0.867	73%	0.732	S	S	*	*			trans	-143.2	141.2	152.5	-171.3	0	0	0	0	110.7
171	T	37.6	Very low	47.3	Very low	105 Å²	105	136.4 Å²	136.4	64%	0.644	72%	0.722	S	S	*	*			trans	-105.6	123.4	-153.8	-57.5	0	0	0	0	110
172	L	38	Very low	48	Very low	156 Å²	156	133.1 Å²	133.1	82%	0.817	71%	0.705	S	S	*	*			trans	63.9	154.8	167.4	-91.3	92	0	0	0	118.9
173	P	47.6	Very low	49	Very low	82 Å²	82	129.1 Å²	129.1	53%	0.532	69%	0.685	S	S	.	*			cis	-122.5	145.1	16.5	34	-15.5	0	0	0	116.1	C175	P173-C175 VanDerWaalsContact C-N 3.31Å; P173-C175 PolarHBondContact O-N 2.92Å
174	S	58	Low	50.4	Low	94 Å²	94	126.5 Å²	126.5	66%	0.657	67%	0.669	S	S	*	*	H	α-helix	trans	-69.7	-16.6	-172.9	-173.9	0	0	0	0	115.2	R178	S174-R178 PolarHBondContact O-N 3.25Å
175	C	57.3	Low	51.5	Low	99 Å²	99	127.6 Å²	127.6	67%	0.669	67%	0.667	S	S	*	*	H	α-helix	trans	-68.9	-42.1	-175.2	-158.7	0	0	0	0	112.1	P173 R177 R178 R179	P173-C175 VanDerWaalsContact C-N 3.31Å; P173-C175 PolarHBondContact O-N 2.92Å; C175-R177 PolarHBondContact O-N 3.2Å; C175-R178 PolarHBondContact O-N 3.39Å; C175-R179 PolarHBondContact O-N 3.48Å; C175-R179 VanDerWaalsContact O-N 3.11Å
176	D	60.6	Low	52.5	Low	104 Å²	104	124.9 Å²	124.9	56%	0.556	66%	0.661	S	S	*	*	H	α-helix	trans	-67.5	-38.3	-179.1	-73.5	-44.3	0	0	0	112.3	R178 R179 Q180	D176-R178 VanDerWaalsContact C-N 3.31Å; D176-R178 PolarHBondContact O-N 2.9Å; D176-R179 PolarHBondContact O-N 3.27Å; D176-Q180 WeakPolarHBondContact O-CB 3.19Å; D176-Q180 PolarHBondContact O-N 3.43Å
177	R	62.8	Low	53.6	Low	165 Å²	165	127.8 Å²	127.8	62%	0.623	66%	0.661	S	S	*	*	H	α-helix	trans	-63.6	-36.3	176.6	-81.7	-170.1	117.4	-172	5.9	112.5	C175 R181	C175-R177 PolarHBondContact O-N 3.2Å; R177-R181 VanDerWaalsContact O-CB 3.3Å; R177-R181 WeakPolarHBondContact O-CB 3.38Å; R177-R181 WeakPolarHBondContact O-CG 3.5Å; R177-R181 PolarHBondContact O-N 3.3Å
178	R	63.8	Low	54.5	Low	206 Å²	206	129.5 Å²	129.5	78%	0.777	66%	0.656	S	S	*	*	H	α-helix	trans	-72.3	-40.4	178.8	-161.4	-177.7	-99.6	-167.7	-3.9	110.7	S174 C175 D176 R181 A182	S174-R178 PolarHBondContact O-N 3.25Å; C175-R178 PolarHBondContact O-N 3.39Å; D176-R178 VanDerWaalsContact C-N 3.31Å; D176-R178 PolarHBondContact O-N 2.9Å; R178-R181 PolarHBondContact O-N 3.1Å; R178-A182 WeakPolarHBondContact O-CB 3.27Å; R178-A182 PolarHBondContact O-N 3.13Å
179	R	64.5	Low	55.7	Low	200 Å²	200	127.5 Å²	127.5	76%	0.755	64%	0.637	S	S	*	*	H	α-helix	trans	-66.6	-42.3	175.9	-145.9	178.1	-165.6	-153.7	2.9	112	C175 D176 A182 A183	C175-R179 PolarHBondContact O-N 3.48Å; C175-R179 VanDerWaalsContact O-N 3.11Å; D176-R179 PolarHBondContact O-N 3.27Å; R179-A182 PolarHBondContact O-N 2.72Å; R179-A183 WeakPolarHBondContact O-CB 3.4Å; R179-A183 PolarHBondContact O-N 2.89Å
180	Q	68.5	Low	57.3	Low	120 Å²	120	122.9 Å²	122.9	56%	0.561	62%	0.618	S	S	*	*	H	α-helix	trans	-66.8	-38.1	176.7	-159.5	173.2	29.1	0	0	111.7	D176 Q184	D176-Q180 WeakPolarHBondContact O-CB 3.19Å; D176-Q180 PolarHBondContact O-N 3.43Å; Q180-Q184 WeakPolarHBondContact O-CB 3.49Å; Q180-Q184 WeakPolarHBondContact O-CG 3.39Å; Q180-Q184 PolarHBondContact O-N 3.02Å
181	R	65.2	Low	58.9	Low	148 Å²	148	122.3 Å²	122.3	56%	0.558	61%	0.609	S	S	*	*	H	α-helix	trans	-66.5	-37.5	171.4	-76.6	175.4	-173.6	-173.1	2.7	112.8	R177 R178 K185	R177-R181 VanDerWaalsContact O-CB 3.3Å; R177-R181 WeakPolarHBondContact O-CB 3.38Å; R177-R181 WeakPolarHBondContact O-CG 3.5Å; R177-R181 PolarHBondContact O-N 3.3Å; R178-R181 PolarHBondContact O-N 3.1Å; R181-K185 WeakPolarHBondContact O-CG 3.47Å; R181-K185 PolarHBondContact O-N 2.93Å
182	A	57.7	Low	60.7	Low	50 Å²	50	125.8 Å²	125.8	41%	0.413	62%	0.615	S	S	.	*	H	α-helix	trans	-67.8	-43.7	176.4	0	0	0	0	0	111.6	R178 R179 K185 L186	R178-A182 WeakPolarHBondContact O-CB 3.27Å; R178-A182 PolarHBondContact O-N 3.13Å; R179-A182 PolarHBondContact O-N 2.72Å; A182-K185 PolarHBondContact O-N 3.04Å; A182-K185 VanDerWaalsContact O-N 3.17Å; A182-L186 PolarHBondContact O-N 3.36Å
183	A	62.5	Low	62.5	Low	46 Å²	46	120.5 Å²	120.5	38%	0.38	59%	0.59	S	S	.	*	H	α-helix	trans	-61.6	-43.5	173.8	0	0	0	0	0	111.9	R179 K185 L186 L187	R179-A183 WeakPolarHBondContact O-CB 3.4Å; R179-A183 PolarHBondContact O-N 2.89Å; A183-K185 VanDerWaalsContact C-N 3.26Å; A183-K185 PolarHBondContact O-N 3.33Å; A183-L186 PolarHBondContact O-N 3.47Å; A183-L187 PolarHBondContact O-N 2.85Å
184	Q	63.7	Low	63.8	Low	107 Å²	107	118.9 Å²	118.9	50%	0.5	58%	0.583	S	S	.	*	H	α-helix	trans	-61.7	-31.6	174.5	-77.3	176	-3.8	0	0	113	Q180 R188	Q180-Q184 WeakPolarHBondContact O-CB 3.49Å; Q180-Q184 WeakPolarHBondContact O-CG 3.39Å; Q180-Q184 PolarHBondContact O-N 3.02Å; Q184-R188 VanDerWaalsContact O-CG 3.31Å; Q184-R188 WeakPolarHBondContact O-CG 3.29Å; Q184-R188 PolarHBondContact O-N 3.26Å
185	K	57.9	Low	64.7	Low	169 Å²	169	118.8 Å²	118.8	74%	0.735	58%	0.575	S	S	*	*	H	α-helix	trans	-78.8	-29.4	175.4	-75.6	-176.8	178.7	-172.5	0	113.4	R181 A182 A183	R181-K185 WeakPolarHBondContact O-CG 3.47Å; R181-K185 PolarHBondContact O-N 2.93Å; A182-K185 PolarHBondContact O-N 3.04Å; A182-K185 VanDerWaalsContact O-N 3.17Å; A183-K185 VanDerWaalsContact C-N 3.26Å; A183-K185 PolarHBondContact O-N 3.33Å
186	L	53.5	Low	65.7	Low	141 Å²	141	120.7 Å²	120.7	74%	0.738	57%	0.574	S	S	*	*	H	α-helix	trans	-73.6	-35	175.2	-80.6	159	0	0	0	112.5	A182 A183	A182-L186 PolarHBondContact O-N 3.36Å; A183-L186 PolarHBondContact O-N 3.47Å
187	L	55	Low	66.6	Low	123 Å²	123	122.1 Å²	122.1	64%	0.644	57%	0.572	S	S	*	*	H	α-helix	trans	-80.9	-24.4	178.8	-82.4	148.3	0	0	0	113.9	A183 H189	A183-L187 PolarHBondContact O-N 2.85Å; L187-H189 PolarHBondContact O-N 2.65Å
188	R	51.5	Low	67.1	Low	191 Å²	191	120.1 Å²	120.1	72%	0.721	57%	0.569	S	S	*	*	S	Bend	trans	-71.7	82.7	167.2	-75.1	-177.1	-176.8	-158.5	0.8	108.5	Q184 S190	Q184-R188 VanDerWaalsContact O-CG 3.31Å; Q184-R188 WeakPolarHBondContact O-CG 3.29Å; Q184-R188 PolarHBondContact O-N 3.26Å; R188-S190 PolarHBondContact O-N 3.08Å
189	H	62.1	Low	67.7	Low	94 Å²	94	115.7 Å²	115.7	44%	0.435	56%	0.561	S	S	.	*			trans	-49.6	112.2	157.7	-65.2	-45.8	0	0	0	106.2	L187 T193 R197	L187-H189 PolarHBondContact O-N 2.65Å; H189-T193 HydrophobicContact CB-CG2 4.23Å; H189-R197 PolarHBondContact CD2-NH1 3.12Å; H189-R197 PolarHBondContact CE1-NH2 3.28Å; H189-R197 PolarHBondContact NE2-NH1 3.27Å; H189-R197 PolarHBondContact NE2-NH2 2.74Å; H189-R197 VanDerWaalsContact NE2-NH2 3.2Å
190	S	73	Confident	68.3	Low	57 Å²	57	108.2 Å²	108.2	40%	0.399	54%	0.542	S	S	.	.			trans	-52.8	151.1	-178.2	71.5	0	0	0	0	108.8	R188 K192 T193 A194	R188-S190 PolarHBondContact O-N 3.08Å; S190-K192 CarbonylContact O-C 3.34Å; S190-K192 PolarHBondContact O-N 3.22Å; S190-T193 WeakPolarHBondContact O-CA 3.38Å; S190-T193 WeakPolarHBondContact O-CB 3.42Å; S190-T193 PolarHBondContact O-N 2.86Å; S190-T193 PolarHBondContact OG-N 3.09Å; S190-T193 VanDerWaalsContact OG-N 3.17Å; S190-T193 PolarHBondContact OG-OG1 3.46Å; S190-A194 PolarHBondContact O-N 3.34Å
191	V	75.8	Confident	68.6	Low	112 Å²	112	106.4 Å²	106.4	68%	0.679	54%	0.541	S	S	*	.	H	α-helix	trans	-49.3	-32.7	175.2	176.9	0	0	0	0	111	N195	V191-N195 VanDerWaalsContact O-CB 3.27Å; V191-N195 WeakPolarHBondContact O-CB 3.48Å; V191-N195 VanDerWaalsContact O-CG 3.28Å; V191-N195 PolarHBondContact O-N 3.32Å
192	K	76.7	Confident	68.7	Low	177 Å²	177	102.8 Å²	102.8	77%	0.77	54%	0.535	S	S	*	.	H	α-helix	trans	-62.3	-46.4	172.3	-61.9	-176.5	177.8	-177.5	0	112.9	S190 N195 Q196	S190-K192 CarbonylContact O-C 3.34Å; S190-K192 PolarHBondContact O-N 3.22Å; K192-N195 PolarHBondContact O-N 2.94Å; K192-Q196 VanDerWaalsContact O-CB 3.29Å; K192-Q196 WeakPolarHBondContact O-CB 3.28Å; K192-Q196 PolarHBondContact O-N 2.91Å
193	T	75.7	Confident	69.3	Low	46 Å²	46	103.1 Å²	103.1	28%	0.282	53%	0.534	S	S	.	.	H	α-helix	trans	-65.8	-41.9	177.5	-48.3	0	0	0	0	111.9	H189 S190 Q196 R197	H189-T193 HydrophobicContact CB-CG2 4.23Å; S190-T193 WeakPolarHBondContact O-CA 3.38Å; S190-T193 WeakPolarHBondContact O-CB 3.42Å; S190-T193 PolarHBondContact O-N 2.86Å; S190-T193 PolarHBondContact OG-N 3.09Å; S190-T193 VanDerWaalsContact OG-N 3.17Å; S190-T193 PolarHBondContact OG-OG1 3.46Å; T193-Q196 PolarHBondContact O-N 3.39Å; T193-R197 WeakPolarHBondContact O-CG 3.46Å; T193-R197 PolarHBondContact O-N 2.91Å
194	A	74.4	Confident	69.5	Low	47 Å²	47	107.7 Å²	107.7	39%	0.388	55%	0.546	S	S	.	.	H	α-helix	trans	-64	-45.7	175.6	0	0	0	0	0	111.3	S190 Q196 R197 H198	S190-A194 PolarHBondContact O-N 3.34Å; A194-Q196 VanDerWaalsContact C-N 3.32Å; A194-Q196 PolarHBondContact O-N 3.3Å; A194-R197 PolarHBondContact O-N 2.9Å; A194-H198 PolarHBondContact O-N 3.02Å
195	N	76.9	Confident	69.6	Low	93 Å²	93	108.8 Å²	108.8	50%	0.497	55%	0.549	S	S	.	.	H	α-helix	trans	-62.3	-38.4	174.3	-77.9	-8.5	0	0	0	112.2	V191 K192 H198 L199	V191-N195 VanDerWaalsContact O-CB 3.27Å; V191-N195 WeakPolarHBondContact O-CB 3.48Å; V191-N195 VanDerWaalsContact O-CG 3.28Å; V191-N195 PolarHBondContact O-N 3.32Å; K192-N195 PolarHBondContact O-N 2.94Å; N195-H198 PolarHBondContact O-N 2.92Å; N195-L199 WeakPolarHBondContact O-CB 3.21Å; N195-L199 VanDerWaalsContact O-CG 3.3Å; N195-L199 WeakPolarHBondContact O-CG 3.45Å; N195-L199 PolarHBondContact O-N 3Å
196	Q	78.8	Confident	70	Confident	138 Å²	138	102.4 Å²	102.4	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-65.6	-39.6	175.6	-172.1	178.4	6.1	0	0	111.9	K192 T193 A194 A200	K192-Q196 VanDerWaalsContact O-CB 3.29Å; K192-Q196 WeakPolarHBondContact O-CB 3.28Å; K192-Q196 PolarHBondContact O-N 2.91Å; T193-Q196 PolarHBondContact O-N 3.39Å; A194-Q196 VanDerWaalsContact C-N 3.32Å; A194-Q196 PolarHBondContact O-N 3.3Å; Q196-A200 VanDerWaalsContact O-CB 3.31Å; Q196-A200 WeakPolarHBondContact O-CB 3.44Å; Q196-A200 PolarHBondContact O-N 3.39Å
197	R	77.9	Confident	70.3	Confident	135 Å²	135	100 Å²	100	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-44.2	172.8	-74.4	179.7	-180	174.8	2.3	111.6	H189 T193 A194 A200 C201	H189-R197 PolarHBondContact CD2-NH1 3.12Å; H189-R197 PolarHBondContact CE1-NH2 3.28Å; H189-R197 PolarHBondContact NE2-NH1 3.27Å; H189-R197 PolarHBondContact NE2-NH2 2.74Å; H189-R197 VanDerWaalsContact NE2-NH2 3.2Å; T193-R197 WeakPolarHBondContact O-CG 3.46Å; T193-R197 PolarHBondContact O-N 2.91Å; A194-R197 PolarHBondContact O-N 2.9Å; R197-A200 WeakPolarHBondContact O-CB 3.36Å; R197-A200 PolarHBondContact O-N 3.29Å; R197-C201 PolarHBondContact O-N 3.36Å; R197-C201 PolarHBondContact O-SG 3.46Å; R197-C201 VanDerWaalsContact O-SG 3.42Å
198	H	73.7	Confident	70.7	Confident	122 Å²	122	97.9 Å²	97.9	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-60.2	-48.1	175.7	-178.5	73.7	0	0	0	111.2	A194 N195 A200 C201 V202	A194-H198 PolarHBondContact O-N 3.02Å; N195-H198 PolarHBondContact O-N 2.92Å; H198-A200 VanDerWaalsContact C-N 3.32Å; H198-A200 PolarHBondContact O-N 3.41Å; H198-C201 PolarHBondContact O-N 2.93Å; H198-V202 WeakPolarHBondContact O-CB 3.21Å; H198-V202 WeakPolarHBondContact O-CG2 3.12Å; H198-V202 PolarHBondContact O-N 3.31Å
199	L	77.4	Confident	70.7	Confident	114 Å²	114	90.7 Å²	90.7	60%	0.597	49%	0.486	S	S	*	.	H	α-helix	trans	-60.1	-39.7	174.3	-76.8	163.9	0	0	0	112.1	N195 V202 S203	N195-L199 WeakPolarHBondContact O-CB 3.21Å; N195-L199 VanDerWaalsContact O-CG 3.3Å; N195-L199 WeakPolarHBondContact O-CG 3.45Å; N195-L199 PolarHBondContact O-N 3Å; L199-V202 PolarHBondContact O-N 3.22Å; L199-S203 VanDerWaalsContact O-CB 3.22Å; L199-S203 WeakPolarHBondContact O-CB 3.48Å; L199-S203 PolarHBondContact O-N 3.33Å; L199-S203 PolarHBondContact O-OG 3.49Å; L199-S203 VanDerWaalsContact O-OG 3.07Å
200	A	76.9	Confident	70.3	Confident	43 Å²	43	90.1 Å²	90.1	36%	0.355	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-44.4	174.3	0	0	0	0	0	111.4	Q196 R197 H198 S203 K204	Q196-A200 VanDerWaalsContact O-CB 3.31Å; Q196-A200 WeakPolarHBondContact O-CB 3.44Å; Q196-A200 PolarHBondContact O-N 3.39Å; R197-A200 WeakPolarHBondContact O-CB 3.36Å; R197-A200 PolarHBondContact O-N 3.29Å; H198-A200 VanDerWaalsContact C-N 3.32Å; H198-A200 PolarHBondContact O-N 3.41Å; A200-S203 WeakPolarHBondContact CA-OG 3.43Å; A200-S203 PolarHBondContact O-N 3.12Å; A200-S203 PolarHBondContact O-OG 3.03Å; A200-K204 WeakPolarHBondContact O-CB 3.49Å; A200-K204 VanDerWaalsContact O-CG 3.32Å; A200-K204 WeakPolarHBondContact O-CG 3.36Å; A200-K204 PolarHBondContact O-N 3.31Å
201	C	73.7	Confident	69.2	Low	82 Å²	82	96 Å²	96	55%	0.554	50%	0.5	S	S	*	.	H	α-helix	trans	-65.3	-44.8	176	-70.4	0	0	0	0	112.5	R197 H198 S203 K204 F205	R197-C201 PolarHBondContact O-N 3.36Å; R197-C201 PolarHBondContact O-SG 3.46Å; R197-C201 VanDerWaalsContact O-SG 3.42Å; H198-C201 PolarHBondContact O-N 2.93Å; C201-S203 PolarHBondContact O-N 2.95Å; C201-K204 PolarHBondContact O-N 3.04Å; C201-F205 WeakPolarHBondContact O-CB 3.35Å; C201-F205 PolarHBondContact O-N 3.29Å
202	V	69	Low	67.8	Low	71 Å²	71	95 Å²	95	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-40.6	177.1	172.8	0	0	0	0	110.8	H198 L199 F205 A206	H198-V202 WeakPolarHBondContact O-CB 3.21Å; H198-V202 WeakPolarHBondContact O-CG2 3.12Å; H198-V202 PolarHBondContact O-N 3.31Å; L199-V202 PolarHBondContact O-N 3.22Å; V202-F205 PolarHBondContact O-N 3.49Å; V202-A206 VanDerWaalsContact O-CB 3.27Å; V202-A206 WeakPolarHBondContact O-CB 3.41Å; V202-A206 PolarHBondContact O-N 3.26Å
203	S	69.3	Low	66.2	Low	57 Å²	57	89.6 Å²	89.6	40%	0.399	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-40.5	175.2	69.8	0	0	0	0	112.1	L199 A200 C201 A206 I207	L199-S203 VanDerWaalsContact O-CB 3.22Å; L199-S203 WeakPolarHBondContact O-CB 3.48Å; L199-S203 PolarHBondContact O-N 3.33Å; L199-S203 PolarHBondContact O-OG 3.49Å; L199-S203 VanDerWaalsContact O-OG 3.07Å; A200-S203 WeakPolarHBondContact CA-OG 3.43Å; A200-S203 PolarHBondContact O-N 3.12Å; A200-S203 PolarHBondContact O-OG 3.03Å; C201-S203 PolarHBondContact O-N 2.95Å; S203-A206 CarbonylContact O-C 3.54Å; S203-A206 PolarHBondContact O-N 3.37Å; S203-I207 WeakPolarHBondContact O-CD1 3.48Å; S203-I207 WeakPolarHBondContact O-CG1 3.36Å; S203-I207 PolarHBondContact O-N 3.23Å
204	K	66.9	Low	64.8	Low	143 Å²	143	95.2 Å²	95.2	62%	0.622	50%	0.498	S	S	*	.	H	α-helix	trans	-61	-46.4	172.2	-76.4	179.7	179.9	-170.8	0	111.4	A200 C201 A206 I207 V208	A200-K204 WeakPolarHBondContact O-CB 3.49Å; A200-K204 VanDerWaalsContact O-CG 3.32Å; A200-K204 WeakPolarHBondContact O-CG 3.36Å; A200-K204 PolarHBondContact O-N 3.31Å; C201-K204 PolarHBondContact O-N 3.04Å; K204-A206 VanDerWaalsContact C-N 3.32Å; K204-A206 PolarHBondContact O-N 3.47Å; K204-I207 PolarHBondContact O-N 2.92Å; K204-V208 WeakPolarHBondContact O-CG2 3.42Å; K204-V208 PolarHBondContact O-N 3.24Å
205	F	66.5	Low	63.3	Low	129 Å²	129	99.4 Å²	99.4	57%	0.566	50%	0.504	S	S	*	.	H	α-helix	trans	-61	-41.8	174.9	-177.6	-96.6	0	0	0	111.2	C201 V202 I207 V208 S209 L384	C201-F205 WeakPolarHBondContact O-CB 3.35Å; C201-F205 PolarHBondContact O-N 3.29Å; V202-F205 PolarHBondContact O-N 3.49Å; F205-I207 PolarHBondContact O-N 3.31Å; F205-V208 PolarHBondContact O-N 3.47Å; F205-S209 WeakPolarHBondContact O-CB 3.35Å; F205-S209 PolarHBondContact O-N 3.45Å; F205-S209 PolarHBondContact O-OG 3.24Å; F205-S209 VanDerWaalsContact O-OG 3.09Å; F205-L384 HydrophobicContact CZ-CD2 4.42Å
206	A	64.7	Low	61.4	Low	35 Å²	35	99.9 Å²	99.9	29%	0.289	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-34.5	176.5	0	0	0	0	0	112.8	V202 S203 K204 S209 N210	V202-A206 VanDerWaalsContact O-CB 3.27Å; V202-A206 WeakPolarHBondContact O-CB 3.41Å; V202-A206 PolarHBondContact O-N 3.26Å; S203-A206 CarbonylContact O-C 3.54Å; S203-A206 PolarHBondContact O-N 3.37Å; K204-A206 VanDerWaalsContact C-N 3.32Å; K204-A206 PolarHBondContact O-N 3.47Å; A206-S209 WeakPolarHBondContact CA-OG 3.32Å; A206-S209 PolarHBondContact O-OG 3.34Å; A206-N210 WeakPolarHBondContact O-CB 3.42Å; A206-N210 PolarHBondContact O-N 2.95Å; A206-N210 PolarHBondContact O-ND2 2.82Å
207	I	59.8	Low	59.6	Low	90 Å²	90	102.6 Å²	102.6	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-68.1	-47.7	174.3	-69.7	161.6	0	0	0	109.6	S203 K204 F205 N210 R211	S203-I207 WeakPolarHBondContact O-CD1 3.48Å; S203-I207 WeakPolarHBondContact O-CG1 3.36Å; S203-I207 PolarHBondContact O-N 3.23Å; K204-I207 PolarHBondContact O-N 2.92Å; F205-I207 PolarHBondContact O-N 3.31Å; I207-N210 PolarHBondContact O-N 3.47Å; I207-R211 WeakPolarHBondContact O-CB 3.47Å; I207-R211 VanDerWaalsContact O-CG 3.24Å; I207-R211 WeakPolarHBondContact O-CG 3.45Å; I207-R211 PolarHBondContact O-N 2.88Å
208	V	63.1	Low	58	Low	80 Å²	80	100 Å²	100	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-45.2	177.3	174.3	0	0	0	0	110.3	K204 F205 R211 I212	K204-V208 WeakPolarHBondContact O-CG2 3.42Å; K204-V208 PolarHBondContact O-N 3.24Å; F205-V208 PolarHBondContact O-N 3.47Å; V208-R211 CarbonylContact O-C 3.19Å; V208-R211 WeakPolarHBondContact O-CB 3.49Å; V208-R211 PolarHBondContact O-N 2.95Å; V208-I212 HydrophobicContact CG1-CD1 3.79Å; V208-I212 WeakPolarHBondContact O-CD1 3Å; V208-I212 WeakPolarHBondContact O-CG1 3.35Å; V208-I212 PolarHBondContact O-N 3.03Å
209	S	52.2	Low	57	Low	40 Å²	40	100.1 Å²	100.1	28%	0.28	53%	0.53	S	S	.	.	H	α-helix	trans	-70.3	-33.8	179.8	74.3	0	0	0	0	112.5	F205 A206 I212 A213	F205-S209 WeakPolarHBondContact O-CB 3.35Å; F205-S209 PolarHBondContact O-N 3.45Å; F205-S209 PolarHBondContact O-OG 3.24Å; F205-S209 VanDerWaalsContact O-OG 3.09Å; A206-S209 WeakPolarHBondContact CA-OG 3.32Å; A206-S209 PolarHBondContact O-OG 3.34Å; S209-I212 CarbonylContact O-C 3.6Å; S209-I212 WeakPolarHBondContact O-CA 3.33Å; S209-I212 PolarHBondContact O-N 2.96Å; S209-I212 VanDerWaalsContact O-N 3.08Å; S209-A213 VanDerWaalsContact O-CB 3.28Å; S209-A213 WeakPolarHBondContact O-CB 3.43Å; S209-A213 PolarHBondContact O-N 3.23Å
210	N	53.2	Low	55.6	Low	81 Å²	81	102.3 Å²	102.3	43%	0.433	54%	0.542	S	S	.	.	H	α-helix	trans	-70	-36	171.1	-85	-54.1	0	0	0	112.1	A206 I207 I212 A213 K214	A206-N210 WeakPolarHBondContact O-CB 3.42Å; A206-N210 PolarHBondContact O-N 2.95Å; A206-N210 PolarHBondContact O-ND2 2.82Å; I207-N210 PolarHBondContact O-N 3.47Å; N210-I212 PolarHBondContact O-N 3.36Å; N210-A213 PolarHBondContact O-N 3.02Å; N210-K214 WeakPolarHBondContact O-CB 3.46Å; N210-K214 WeakPolarHBondContact O-CG 3.25Å; N210-K214 PolarHBondContact O-N 3.07Å
211	R	50.5	Low	54.4	Low	182 Å²	182	103.1 Å²	103.1	69%	0.687	55%	0.549	S	S	*	.	H	α-helix	trans	-62.8	-24.6	168.4	-72.5	175.4	-177.9	-166	0.7	111.4	I207 V208 W215	I207-R211 WeakPolarHBondContact O-CB 3.47Å; I207-R211 VanDerWaalsContact O-CG 3.24Å; I207-R211 WeakPolarHBondContact O-CG 3.45Å; I207-R211 PolarHBondContact O-N 2.88Å; V208-R211 CarbonylContact O-C 3.19Å; V208-R211 WeakPolarHBondContact O-CB 3.49Å; V208-R211 PolarHBondContact O-N 2.95Å; R211-W215 PolarHBondContact O-NE1 3.28Å
212	I	47.4	Very low	53.6	Low	90 Å²	90	103.6 Å²	103.6	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-88.5	-33.5	173.5	-59.9	161.1	0	0	0	113.4	V208 S209 N210 W215	V208-I212 HydrophobicContact CG1-CD1 3.79Å; V208-I212 WeakPolarHBondContact O-CD1 3Å; V208-I212 WeakPolarHBondContact O-CG1 3.35Å; V208-I212 PolarHBondContact O-N 3.03Å; S209-I212 CarbonylContact O-C 3.6Å; S209-I212 WeakPolarHBondContact O-CA 3.33Å; S209-I212 PolarHBondContact O-N 2.96Å; S209-I212 VanDerWaalsContact O-N 3.08Å; N210-I212 PolarHBondContact O-N 3.36Å; I212-W215 VanDerWaalsContact CA-NE1 3.35Å; I212-W215 WeakPolarHBondContact O-CB 3.31Å; I212-W215 PolarHBondContact O-N 3.43Å
213	A	43.1	Very low	53.2	Low	63 Å²	63	104.7 Å²	104.7	52%	0.521	55%	0.553	S	S	.	*	H	α-helix	trans	-79.8	-29.5	-176.5	0	0	0	0	0	111.8	S209 N210 W215 C216	S209-A213 VanDerWaalsContact O-CB 3.28Å; S209-A213 WeakPolarHBondContact O-CB 3.43Å; S209-A213 PolarHBondContact O-N 3.23Å; N210-A213 PolarHBondContact O-N 3.02Å; A213-W215 PolarHBondContact O-N 3.23Å; A213-C216 PolarHBondContact O-N 2.86Å
214	K	45.6	Very low	53	Low	165 Å²	165	106 Å²	106	72%	0.717	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	10.4	167.1	-69.9	-176.3	179.9	-177.3	0	113.4	N210 C216	N210-K214 WeakPolarHBondContact O-CB 3.46Å; N210-K214 WeakPolarHBondContact O-CG 3.25Å; N210-K214 PolarHBondContact O-N 3.07Å; K214-C216 PolarHBondContact O-N 3.38Å; K214-C216 VanDerWaalsContact O-O 3.04Å
215	W	42	Very low	53.3	Low	135 Å²	135	99.5 Å²	99.5	51%	0.511	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-6.5	165.5	-69	45.4	0	0	0	112.1	R211 I212 A213 R217 P245 L246	R211-W215 PolarHBondContact O-NE1 3.28Å; I212-W215 VanDerWaalsContact CA-NE1 3.35Å; I212-W215 WeakPolarHBondContact O-CB 3.31Å; I212-W215 PolarHBondContact O-N 3.43Å; A213-W215 PolarHBondContact O-N 3.23Å; W215-R217 PolarHBondContact O-N 3.18Å; W215-P245 HydrophobicContact CE3-CB 3.73Å; W215-P245 HydrophobicContact CH2-CB 4.48Å; W215-P245 HydrophobicContact CZ3-CB 3.62Å; W215-P245 HydrophobicContact CZ3-CG 4.47Å; W215-L246 HydrophobicContact CD2-CG 4.45Å; W215-L246 HydrophobicContact CH2-CD1 3.88Å; W215-L246 HydrophobicContact CH2-CG 4.07Å; W215-L246 HydrophobicContact CZ2-CD1 3.11Å; W215-L246 HydrophobicContact CZ2-CD2 4.35Å; W215-L246 HydrophobicContact CZ2-CG 3.55Å
216	C	36.9	Very low	53.4	Low	103 Å²	103	102.4 Å²	102.4	70%	0.696	53%	0.533	S	S	*	.	S	Bend	trans	-61.7	119.6	154.1	-67.3	0	0	0	0	108.7	A213 K214 P218	A213-C216 PolarHBondContact O-N 2.86Å; K214-C216 PolarHBondContact O-N 3.38Å; K214-C216 VanDerWaalsContact O-O 3.04Å; C216-P218 VanDerWaalsContact O-N 3.15Å
217	R	41.4	Very low	53.5	Low	195 Å²	195	102.2 Å²	102.2	74%	0.736	53%	0.526	S	S	*	.			trans	-30.1	119.8	172.1	-81.8	-172.5	-175.5	167	2.1	111	W215 P219	W215-R217 PolarHBondContact O-N 3.18Å; R217-P219 WeakPolarHBondContact O-CD 3.49Å
218	P	44.9	Very low	53.7	Low	80 Å²	80	105.4 Å²	105.4	52%	0.519	53%	0.532	S	S	.	.			trans	-59.4	126.1	159.5	-15.9	28.4	0	0	0	107.1	C216 N220 A221	C216-P218 VanDerWaalsContact O-N 3.15Å; P218-N220 PolarHBondContact O-N 3.47Å; P218-A221 HydrophobicContact CB-CB 4.09Å; P218-A221 HydrophobicContact CG-CB 4.38Å
219	P	51.9	Low	53.7	Low	125 Å²	125	105.1 Å²	105.1	81%	0.812	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.2	-170.9	-26.9	32.5	0	0	0	114.5	R217	R217-P219 WeakPolarHBondContact O-CD 3.49Å
220	N	48.2	Very low	54	Low	160 Å²	160	108.8 Å²	108.8	86%	0.856	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.8	13.6	-169.7	-70.5	-9	0	0	0	115.5	P218 S222	P218-N220 PolarHBondContact O-N 3.47Å; N220-S222 PolarHBondContact O-N 3.06Å
221	A	52.7	Low	54.3	Low	60 Å²	60	110.4 Å²	110.4	50%	0.496	56%	0.563	S	S	.	*			trans	-84.4	106.4	171.1	0	0	0	0	0	108.7	P218 Q223	P218-A221 HydrophobicContact CB-CB 4.09Å; P218-A221 HydrophobicContact CG-CB 4.38Å; A221-Q223 PolarHBondContact O-N 2.92Å
222	S	56.6	Low	54.5	Low	91 Å²	91	105.5 Å²	105.5	64%	0.636	55%	0.554	S	S	*	*			trans	-50.8	110.4	174.3	56.7	0	0	0	0	109.7	N220 Q224	N220-S222 PolarHBondContact O-N 3.06Å; S222-Q224 PolarHBondContact O-N 2.91Å
223	Q	59.5	Low	54.8	Low	94 Å²	94	107.8 Å²	107.8	44%	0.439	57%	0.572	S	S	.	*			trans	-72.9	25.7	-176.5	-62	-165.2	-27.9	0	0	113.4	A221 A242 C243	A221-Q223 PolarHBondContact O-N 2.92Å; Q223-A242 WeakPolarHBondContact O-CA 3.48Å; Q223-C243 PolarHBondContact O-N 3.48Å
224	Q	66.7	Low	54.9	Low	86 Å²	86	108.7 Å²	108.7	40%	0.402	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	130.3	-178.4	-71.6	179.9	-0.6	0	0	109.8	S222 R226 C243	S222-Q224 PolarHBondContact O-N 2.91Å; Q224-R226 PolarHBondContact O-N 3.46Å; Q224-C243 VanDerWaalsContact C-SG 3.57Å; Q224-C243 PolarHBondContact O-SG 3.35Å
225	C	73.2	Confident	54.9	Low	5 Å²	5	109.9 Å²	109.9	3%	0.034	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-57.1	122.7	175.8	167.8	0	0	0	0	111.1	F227 C239 N241 C243 C250 H253	C225-F227 PolarHBondContact O-N 3Å; C225-F227 WeakPolarHBondContact SG-CB 3.39Å; C225-F227 PolarHBondContact SG-N 3.26Å; C225-F227 VanDerWaalsContact SG-N 3.42Å; C225-C239 HydrophobicContact CB-CB 3.63Å; C225-C239 PolarHBondContact N-O 2.84Å; C225-N241 WeakPolarHBondContact CB-O 3.15Å; C225-N241 PolarHBondContact N-O 3.46Å; C225-C243 WeakPolarHBondContact CA-SG 3.5Å; C225-C250 HydrophobicContact CB-CB 3.74Å; C225-C250 PolarHBondContact SG-N 2.88Å; C225-H253 PolarHBondContact SG-ND1 3.48Å
226	R	67.8	Low	55.5	Low	190 Å²	190	110.9 Å²	110.9	72%	0.717	58%	0.582	S	S	*	*			trans	-86.7	14.9	179.9	-62.1	-172.3	173.6	-167.6	-2.6	113.7	Q224 R228 P248	Q224-R226 PolarHBondContact O-N 3.46Å; R226-R228 PolarHBondContact O-N 3.09Å; R226-P248 WeakPolarHBondContact CB-O 3.48Å; R226-P248 PolarHBondContact N-O 3.39Å
227	F	66.6	Low	56.5	Low	31 Å²	31	115.4 Å²	115.4	14%	0.136	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-63	126.9	177.5	-179.5	-100.8	0	0	0	109.2	C225 D229 V249 H253 Q256 I257	C225-F227 PolarHBondContact O-N 3Å; C225-F227 WeakPolarHBondContact SG-CB 3.39Å; C225-F227 PolarHBondContact SG-N 3.26Å; C225-F227 VanDerWaalsContact SG-N 3.42Å; F227-D229 HydrophobicContact CE1-CB 4.44Å; F227-V249 HydrophobicContact CB-CG1 3.96Å; F227-H253 HydrophobicContact CB-CB 3.49Å; F227-H253 VanDerWaalsContact CB-CB 3.49Å; F227-H253 VanDerWaalsContact CB-ND1 3.33Å; F227-H253 WeakPolarHBondContact CB-ND1 3.44Å; F227-H253 HydrophobicContact CD1-CB 4.03Å; F227-H253 AromaticContact CD1-CD2 3Å; F227-H253 WeakPolarHBondContact CD1-CD2 3.34Å; F227-H253 AromaticContact CD1-CE1 3.65Å; F227-H253 AromaticContact CD1-CG 3.35Å; F227-H253 AromaticContact CD1-ND1 3.75Å; F227-H253 AromaticContact CD1-NE2 3.25Å; F227-H253 WeakPolarHBondContact CD1-NE2 3.36Å; F227-H253 HydrophobicContact CD2-CB 3.64Å; F227-H253 AromaticContact CD2-CG 3.94Å; F227-H253 AromaticContact CE1-CD2 3.31Å; F227-H253 WeakPolarHBondContact CE1-CD2 3.48Å; F227-H253 AromaticContact CE1-NE2 3.7Å; F227-H253 HydrophobicContact CE2-CB 4.32Å; F227-H253 HydrophobicContact CG-CB 3.45Å; F227-H253 VanDerWaalsContact CG-CB 3.45Å; F227-H253 AromaticContact CG-CD2 3.43Å; F227-H253 VanDerWaalsContact CG-CD2 3.43Å; F227-H253 WeakPolarHBondContact CG-CD2 3.36Å; F227-H253 AromaticContact CG-CG 3.25Å; F227-H253 AromaticContact CG-ND1 3.73Å; F227-H253 AromaticContact CG-NE2 3.99Å; F227-Q256 HydrophobicContact CE2-CB 4.45Å; F227-Q256 HydrophobicContact CZ-CB 4.18Å; F227-I257 HydrophobicContact CD2-CD1 3.85Å; F227-I257 HydrophobicContact CD2-CG1 3.92Å; F227-I257 HydrophobicContact CE2-CD1 4.13Å; F227-I257 HydrophobicContact CE2-CG1 3.65Å
228	R	65.1	Low	57.6	Low	158 Å²	158	115.7 Å²	115.7	60%	0.596	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-101	126.9	168	-72.8	-169.8	-179.5	-142.3	1	107.2	R226 P230	R226-R228 PolarHBondContact O-N 3.09Å; R228-P230 WeakPolarHBondContact O-CD 3.39Å
229	D	61.3	Low	58.9	Low	73 Å²	73	112.7 Å²	112.7	39%	0.39	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-64.1	119.7	170	-172.2	-23.9	0	0	0	108.2	F227 T231 T232	F227-D229 HydrophobicContact CE1-CB 4.44Å; D229-T231 VanDerWaalsContact CG-OG1 3.28Å; D229-T231 PolarHBondContact O-N 3.21Å; D229-T231 VanDerWaalsContact O-N 3.12Å; D229-T231 WeakPolarHBondContact OD1-CB 3.36Å; D229-T231 PolarHBondContact OD1-N 3.28Å; D229-T231 PolarHBondContact OD1-OG1 2.95Å; D229-T231 PolarHBondContact OD2-OG1 3.22Å; D229-T232 PolarHBondContact O-N 3.42Å
230	P	58.7	Low	59.8	Low	118 Å²	118	112.5 Å²	112.5	77%	0.766	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-15.9	-179.5	24.2	-32.1	0	0	0	113.2	R228	R228-P230 WeakPolarHBondContact O-CD 3.39Å
231	T	60.3	Low	61	Low	114 Å²	114	108.7 Å²	108.7	70%	0.699	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.5	-176.9	65.8	0	0	0	0	114.6	D229	D229-T231 VanDerWaalsContact CG-OG1 3.28Å; D229-T231 PolarHBondContact O-N 3.21Å; D229-T231 VanDerWaalsContact O-N 3.12Å; D229-T231 WeakPolarHBondContact OD1-CB 3.36Å; D229-T231 PolarHBondContact OD1-N 3.28Å; D229-T231 PolarHBondContact OD1-OG1 2.95Å; D229-T231 PolarHBondContact OD2-OG1 3.22Å
232	T	54.3	Low	61.9	Low	79 Å²	79	108.8 Å²	108.8	49%	0.485	55%	0.548	S	S	.	.			trans	-116.5	115.5	-178.2	56.9	0	0	0	0	111.2	D229 T234	D229-T232 PolarHBondContact O-N 3.42Å; T232-T234 VanDerWaalsContact C-N 3.26Å; T232-T234 PolarHBondContact O-N 3Å
233	T	53.8	Low	62.6	Low	139 Å²	139	105.9 Å²	105.9	85%	0.853	53%	0.528	S	S	*	.			trans	-81.2	-4.2	177.5	55.8	0	0	0	0	113.1
234	T	45	Very low	62.9	Low	81 Å²	81	103.5 Å²	103.5	50%	0.497	52%	0.52	S	S	.	.	S	Bend	trans	-103.2	136.3	-176.1	56.8	0	0	0	0	111.8	T232 E236	T232-T234 VanDerWaalsContact C-N 3.26Å; T232-T234 PolarHBondContact O-N 3Å; T234-E236 PolarHBondContact O-N 3.41Å
235	W	46.2	Very low	62.5	Low	191 Å²	191	103.5 Å²	103.5	72%	0.723	53%	0.527	S	S	*	.	S	Bend	trans	-71.5	29.4	-164.2	-70.7	85.5	0	0	0	116.6	W44	W44-W235 HydrophobicContact CZ3-CH2 4.48Å
236	E	55.1	Low	61.7	Low	155 Å²	155	109.4 Å²	109.4	72%	0.724	56%	0.558	S	S	*	*			trans	-100.7	-24.6	-151.9	-68.6	-175.4	174.2	0	0	116.8	T234	T234-E236 PolarHBondContact O-N 3.41Å
237	K	58.3	Low	61.5	Low	198 Å²	198	103.6 Å²	103.6	86%	0.861	54%	0.54	S	S	*	.			trans	-122.7	90.2	-174.9	-66.2	-174	-177.1	177.2	0	113	C239	K237-C239 PolarHBondContact O-N 2.69Å
238	R	63.2	Low	61.6	Low	202 Å²	202	105.9 Å²	105.9	76%	0.762	56%	0.558	S	S	*	*			trans	-67.9	129	165.2	-65.7	-174.3	-175.6	177.8	3.6	109.1	T240	R238-T240 PolarHBondContact O-N 3.42Å
239	C	72	Confident	62	Low	16 Å²	16	98.9 Å²	98.9	11%	0.108	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122	173.3	-176	0	0	0	0	110.1	C225 K237 N241 C250 H253	C225-C239 HydrophobicContact CB-CB 3.63Å; C225-C239 PolarHBondContact N-O 2.84Å; K237-C239 PolarHBondContact O-N 2.69Å; C239-N241 VanDerWaalsContact C-N 3.25Å; C239-N241 PolarHBondContact O-N 3.34Å; C239-N241 VanDerWaalsContact SG-CB 3.57Å; C239-C250 VanDerWaalsContact SG-SG 3.68Å; C239-H253 VanDerWaalsContact CB-CE1 3.5Å; C239-H253 WeakPolarHBondContact CB-CE1 3.43Å; C239-H253 PolarHBondContact SG-CE1 2.79Å; C239-H253 PolarHBondContact SG-ND1 2.92Å
240	T	71.5	Confident	62.9	Low	122 Å²	122	95.4 Å²	95.4	75%	0.748	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	-11.4	177.7	53	0	0	0	0	113.2	R238	R238-T240 PolarHBondContact O-N 3.42Å
241	N	72.2	Confident	63.6	Low	79 Å²	79	93.6 Å²	93.6	42%	0.422	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	139.7	-178.9	-64.4	-33.3	0	0	0	111	C225 C239 C243 C250	C225-N241 WeakPolarHBondContact CB-O 3.15Å; C225-N241 PolarHBondContact N-O 3.46Å; C239-N241 VanDerWaalsContact C-N 3.25Å; C239-N241 PolarHBondContact O-N 3.34Å; C239-N241 VanDerWaalsContact SG-CB 3.57Å; N241-C243 PolarHBondContact O-N 3.39Å; N241-C250 HydrophobicContact CB-CB 3.51Å
242	A	71.9	Confident	64.3	Low	62 Å²	62	93.2 Å²	93.2	51%	0.512	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	135.5	173.8	0	0	0	0	0	110.8	Q223 C250	Q223-A242 WeakPolarHBondContact O-CA 3.48Å; A242-C250 WeakPolarHBondContact O-CA 3.28Å; A242-C250 WeakPolarHBondContact O-CB 3.45Å
243	C	71.2	Confident	65.4	Low	30 Å²	30	90.7 Å²	90.7	20%	0.203	48%	0.477	C	S	.	.	B	Isolated β-bridge	trans	-60.7	146.1	170.9	-64.9	0	0	0	0	111.7	Q223 Q224 C225 N241 L247 P248	Q223-C243 PolarHBondContact O-N 3.48Å; Q224-C243 VanDerWaalsContact C-SG 3.57Å; Q224-C243 PolarHBondContact O-SG 3.35Å; C225-C243 WeakPolarHBondContact CA-SG 3.5Å; N241-C243 PolarHBondContact O-N 3.39Å; C243-L247 WeakPolarHBondContact CB-O 3.46Å; C243-P248 PolarHBondContact SG-O 3.44Å; C243-P248 VanDerWaalsContact SG-O 3.41Å
244	V	67.5	Low	66.4	Low	45 Å²	45	86.7 Å²	86.7	27%	0.273	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-63.8	138.4	165.2	-179.2	0	0	0	0	107.9	L246 L247 V249	V244-L246 PolarHBondContact O-N 3.03Å; V244-L247 HydrophobicContact CB-CB 4.17Å; V244-L247 HydrophobicContact CB-CD1 3.96Å; V244-L247 HydrophobicContact CG1-CD1 3.99Å; V244-L247 PolarHBondContact O-N 3.39Å; V244-V249 PolarHBondContact N-O 2.96Å
245	P	57.1	Low	67.6	Low	86 Å²	86	87.3 Å²	87.3	56%	0.558	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	133.2	175.9	-28.2	35.5	0	0	0	111.8	W215 L247	W215-P245 HydrophobicContact CE3-CB 3.73Å; W215-P245 HydrophobicContact CH2-CB 4.48Å; W215-P245 HydrophobicContact CZ3-CB 3.62Å; W215-P245 HydrophobicContact CZ3-CG 4.47Å; P245-L247 VanDerWaalsContact C-N 3.25Å; P245-L247 PolarHBondContact O-N 3.23Å
246	L	57.2	Low	68.8	Low	129 Å²	129	82.8 Å²	82.8	68%	0.675	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	-1.3	-172.9	-54.3	-174.1	0	0	0	117.6	W215 V244	W215-L246 HydrophobicContact CD2-CG 4.45Å; W215-L246 HydrophobicContact CH2-CD1 3.88Å; W215-L246 HydrophobicContact CH2-CG 4.07Å; W215-L246 HydrophobicContact CZ2-CD1 3.11Å; W215-L246 HydrophobicContact CZ2-CD2 4.35Å; W215-L246 HydrophobicContact CZ2-CG 3.55Å; V244-L246 PolarHBondContact O-N 3.03Å
247	L	62.8	Low	69.5	Low	67 Å²	67	79.8 Å²	79.8	35%	0.351	43%	0.429	S	S	.	.	S	Bend	trans	-111.8	146.9	177.7	-67.1	170.8	0	0	0	110.8	C243 V244 P245 V249 L254	C243-L247 WeakPolarHBondContact CB-O 3.46Å; V244-L247 HydrophobicContact CB-CB 4.17Å; V244-L247 HydrophobicContact CB-CD1 3.96Å; V244-L247 HydrophobicContact CG1-CD1 3.99Å; V244-L247 PolarHBondContact O-N 3.39Å; P245-L247 VanDerWaalsContact C-N 3.25Å; P245-L247 PolarHBondContact O-N 3.23Å; L247-V249 HydrophobicContact CB-CG2 4.5Å; L247-V249 PolarHBondContact O-N 3.39Å; L247-L254 HydrophobicContact CD1-CD1 3.92Å; L247-L254 HydrophobicContact CD1-CD2 3.66Å; L247-L254 HydrophobicContact CD1-CG 4.39Å
248	P	69.9	Low	69.7	Low	79 Å²	79	79.9 Å²	79.9	51%	0.513	42%	0.424	S	S	.	.	S	Bend	trans	-75.9	-4	176.8	30.9	-34.3	0	0	0	113.1	R226 C243	R226-P248 WeakPolarHBondContact CB-O 3.48Å; R226-P248 PolarHBondContact N-O 3.39Å; C243-P248 PolarHBondContact SG-O 3.44Å; C243-P248 VanDerWaalsContact SG-O 3.41Å
249	V	72.4	Confident	69.6	Low	11 Å²	11	75 Å²	75	7%	0.067	42%	0.418	C	S	.	.	S	Bend	trans	-126.4	153.5	-172.8	-64.4	0	0	0	0	111.7	F227 V244 L247 H253 L254 I257	F227-V249 HydrophobicContact CB-CG1 3.96Å; V244-V249 PolarHBondContact N-O 2.96Å; L247-V249 HydrophobicContact CB-CG2 4.5Å; L247-V249 PolarHBondContact O-N 3.39Å; V249-H253 HydrophobicContact CB-CB 4.18Å; V249-L254 HydrophobicContact CG2-CB 4.16Å; V249-L254 HydrophobicContact CG2-CD1 4.1Å; V249-I257 HydrophobicContact CB-CD1 4.46Å; V249-I257 HydrophobicContact CG1-CD1 3.94Å; V249-I257 HydrophobicContact CG2-CD1 4.08Å
250	C	79.8	Confident	68.7	Low	1 Å²	1	78.4 Å²	78.4	1%	0.007	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-72	165.8	171.7	66	0	0	0	0	110.9	C225 C239 N241 A242 H252 H253 L254	C225-C250 HydrophobicContact CB-CB 3.74Å; C225-C250 PolarHBondContact SG-N 2.88Å; C239-C250 VanDerWaalsContact SG-SG 3.68Å; N241-C250 HydrophobicContact CB-CB 3.51Å; A242-C250 WeakPolarHBondContact O-CA 3.28Å; A242-C250 WeakPolarHBondContact O-CB 3.45Å; C250-H252 PolarHBondContact O-N 3.31Å; C250-H253 PolarHBondContact O-N 3.48Å; C250-H253 PolarHBondContact SG-ND1 3.29Å; C250-L254 PolarHBondContact O-N 3.29Å
251	S	74.1	Confident	67.8	Low	79 Å²	79	78 Å²	78	55%	0.552	45%	0.446	S	S	*	.	H	α-helix	trans	-57	-38.7	179.2	49.5	0	0	0	0	112	L254 V255	S251-L254 PolarHBondContact O-N 3.32Å; S251-V255 WeakPolarHBondContact O-CG2 3.28Å; S251-V255 PolarHBondContact O-N 2.96Å
252	H	74.5	Confident	66.8	Low	107 Å²	107	79.9 Å²	79.9	50%	0.495	46%	0.457	S	S	.	.	H	α-helix	trans	-59.8	-48.4	178	-172.6	79.6	0	0	0	112.1	C250 V255 Q256	C250-H252 PolarHBondContact O-N 3.31Å; H252-V255 PolarHBondContact O-N 3.07Å; H252-Q256 PolarHBondContact NE2-NE2 3.29Å
253	H	77.9	Confident	65.7	Low	26 Å²	26	87.5 Å²	87.5	12%	0.12	47%	0.474	C	S	.	.	H	α-helix	trans	-77.3	-23.8	-179.5	-71.4	135.5	0	0	0	113.9	C225 F227 C239 V249 C250 V255 Q256 I257	C225-H253 PolarHBondContact SG-ND1 3.48Å; F227-H253 HydrophobicContact CB-CB 3.49Å; F227-H253 VanDerWaalsContact CB-CB 3.49Å; F227-H253 VanDerWaalsContact CB-ND1 3.33Å; F227-H253 WeakPolarHBondContact CB-ND1 3.44Å; F227-H253 HydrophobicContact CD1-CB 4.03Å; F227-H253 AromaticContact CD1-CD2 3Å; F227-H253 WeakPolarHBondContact CD1-CD2 3.34Å; F227-H253 AromaticContact CD1-CE1 3.65Å; F227-H253 AromaticContact CD1-CG 3.35Å; F227-H253 AromaticContact CD1-ND1 3.75Å; F227-H253 AromaticContact CD1-NE2 3.25Å; F227-H253 WeakPolarHBondContact CD1-NE2 3.36Å; F227-H253 HydrophobicContact CD2-CB 3.64Å; F227-H253 AromaticContact CD2-CG 3.94Å; F227-H253 AromaticContact CE1-CD2 3.31Å; F227-H253 WeakPolarHBondContact CE1-CD2 3.48Å; F227-H253 AromaticContact CE1-NE2 3.7Å; F227-H253 HydrophobicContact CE2-CB 4.32Å; F227-H253 HydrophobicContact CG-CB 3.45Å; F227-H253 VanDerWaalsContact CG-CB 3.45Å; F227-H253 AromaticContact CG-CD2 3.43Å; F227-H253 VanDerWaalsContact CG-CD2 3.43Å; F227-H253 WeakPolarHBondContact CG-CD2 3.36Å; F227-H253 AromaticContact CG-CG 3.25Å; F227-H253 AromaticContact CG-ND1 3.73Å; F227-H253 AromaticContact CG-NE2 3.99Å; C239-H253 VanDerWaalsContact CB-CE1 3.5Å; C239-H253 WeakPolarHBondContact CB-CE1 3.43Å; C239-H253 PolarHBondContact SG-CE1 2.79Å; C239-H253 PolarHBondContact SG-ND1 2.92Å; V249-H253 HydrophobicContact CB-CB 4.18Å; C250-H253 PolarHBondContact O-N 3.48Å; C250-H253 PolarHBondContact SG-ND1 3.29Å; H253-V255 VanDerWaalsContact C-N 3.26Å; H253-V255 PolarHBondContact O-N 3.45Å; H253-Q256 PolarHBondContact CD2-OE1 3.45Å; H253-Q256 PolarHBondContact O-N 3.47Å; H253-I257 WeakPolarHBondContact O-CG1 3.34Å; H253-I257 PolarHBondContact O-N 3.41Å
254	L	74	Confident	64.3	Low	55 Å²	55	93.3 Å²	93.3	29%	0.288	50%	0.503	S	S	.	.	H	α-helix	trans	-60.9	-39	171.1	-172.3	67.1	0	0	0	111.6	L247 V249 C250 S251 Q256 I257 R258	L247-L254 HydrophobicContact CD1-CD1 3.92Å; L247-L254 HydrophobicContact CD1-CD2 3.66Å; L247-L254 HydrophobicContact CD1-CG 4.39Å; V249-L254 HydrophobicContact CG2-CB 4.16Å; V249-L254 HydrophobicContact CG2-CD1 4.1Å; C250-L254 PolarHBondContact O-N 3.29Å; S251-L254 PolarHBondContact O-N 3.32Å; L254-Q256 VanDerWaalsContact C-N 3.33Å; L254-I257 PolarHBondContact O-N 2.97Å; L254-R258 PolarHBondContact O-N 3.09Å
255	V	71.2	Confident	63	Low	93 Å²	93	100.8 Å²	100.8	56%	0.564	53%	0.532	S	S	*	.	H	α-helix	trans	-65.6	-37.9	176.6	176.5	0	0	0	0	111.1	S251 H252 H253 R258	S251-V255 WeakPolarHBondContact O-CG2 3.28Å; S251-V255 PolarHBondContact O-N 2.96Å; H252-V255 PolarHBondContact O-N 3.07Å; H253-V255 VanDerWaalsContact C-N 3.26Å; H253-V255 PolarHBondContact O-N 3.45Å; V255-R258 CarbonylContact O-C 3.54Å; V255-R258 PolarHBondContact O-N 3.43Å
256	Q	71.7	Confident	62.2	Low	97 Å²	97	103.9 Å²	103.9	45%	0.453	54%	0.543	S	S	.	.	H	α-helix	trans	-69.4	-35.3	176.7	-65.6	-176.3	-1.9	0	0	112.9	F227 H252 H253 L254	F227-Q256 HydrophobicContact CE2-CB 4.45Å; F227-Q256 HydrophobicContact CZ-CB 4.18Å; H252-Q256 PolarHBondContact NE2-NE2 3.29Å; H253-Q256 PolarHBondContact CD2-OE1 3.45Å; H253-Q256 PolarHBondContact O-N 3.47Å; L254-Q256 VanDerWaalsContact C-N 3.33Å
257	I	68.2	Low	61.1	Low	91 Å²	91	102.2 Å²	102.2	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-72.6	-34.9	176.6	-63.9	162.5	0	0	0	111.6	F227 V249 H253 L254 P259	F227-I257 HydrophobicContact CD2-CD1 3.85Å; F227-I257 HydrophobicContact CD2-CG1 3.92Å; F227-I257 HydrophobicContact CE2-CD1 4.13Å; F227-I257 HydrophobicContact CE2-CG1 3.65Å; V249-I257 HydrophobicContact CB-CD1 4.46Å; V249-I257 HydrophobicContact CG1-CD1 3.94Å; V249-I257 HydrophobicContact CG2-CD1 4.08Å; H253-I257 WeakPolarHBondContact O-CG1 3.34Å; H253-I257 PolarHBondContact O-N 3.41Å; L254-I257 PolarHBondContact O-N 2.97Å; I257-P259 VanDerWaalsContact C-CD 3.45Å; I257-P259 WeakPolarHBondContact O-CD 3.48Å
258	R	62.6	Low	59.8	Low	201 Å²	201	104.5 Å²	104.5	76%	0.758	56%	0.564	S	S	*	*	S	Bend	trans	-122.2	73.4	179.5	-69.2	-171.7	178	174.4	-0.8	110.5	L254 V255	L254-R258 PolarHBondContact O-N 3.09Å; V255-R258 CarbonylContact O-C 3.54Å; V255-R258 PolarHBondContact O-N 3.43Å
259	P	61.6	Low	58	Low	100 Å²	100	108.8 Å²	108.8	65%	0.649	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-61	142.1	172	25.4	-31.1	0	0	0	109.6	I257	I257-P259 VanDerWaalsContact C-CD 3.45Å; I257-P259 WeakPolarHBondContact O-CD 3.48Å
260	A	54.4	Low	56	Low	86 Å²	86	117.6 Å²	117.6	71%	0.711	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-63	150	176.8	0	0	0	0	0	110.5	D262	A260-D262 PolarHBondContact O-N 3.29Å
261	P	52.5	Low	53.7	Low	113 Å²	113	126.4 Å²	126.4	73%	0.734	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.8	179.8	-18.8	29.3	0	0	0	112.1	Y263	P261-Y263 PolarHBondContact O-N 3.15Å
262	D	51.3	Low	51.5	Low	120 Å²	120	131.5 Å²	131.5	64%	0.642	68%	0.677	S	S	*	*			trans	-70.4	114.5	172.2	-79.4	-58.2	0	0	0	110.4	K106 A260 N264	K106-D262 IonicContact NZ-OD1 3.07Å; K106-D262 PolarHBondContact NZ-OD1 3.47Å; K106-D262 VanDerWaalsContact NZ-OD1 3.07Å; A260-D262 PolarHBondContact O-N 3.29Å; D262-N264 PolarHBondContact O-N 2.92Å
263	Y	48.3	Very low	49.6	Very low	221 Å²	221	135.2 Å²	135.2	87%	0.867	70%	0.699	S	S	*	*			trans	-77.5	101.3	170.7	-89.1	-91.8	0	0	0	110.1	P261 K265	P261-Y263 PolarHBondContact O-N 3.15Å; Y263-K265 PolarHBondContact O-N 3.31Å
264	N	41.5	Very low	47.2	Very low	153 Å²	153	138.2 Å²	138.2	82%	0.818	72%	0.723	S	S	*	*			trans	-72	119.8	169.3	-83.4	-29.9	0	0	0	110.7	D262	D262-N264 PolarHBondContact O-N 2.92Å
265	K	40.5	Very low	45	Very low	201 Å²	201	142.5 Å²	142.5	87%	0.874	75%	0.745	S	S	*	*			trans	-83.9	108.7	168.6	-77.4	-178.4	175.1	-177.4	0	109.6	Y263	Y263-K265 PolarHBondContact O-N 3.31Å
266	N	39.6	Very low	43	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	76%	0.76	S	S	*	*			trans	-102.5	94.7	153.1	-72.9	5.1	0	0	0	106.7
267	S	34.6	Very low	40.9	Very low	95 Å²	95	150 Å²	150	66%	0.664	78%	0.779	S	S	*	*				80.1	101.2	110.7	71.7	0	0	0	0	113.9
268	S	34.5	Very low	39	Very low	114 Å²	114	150.3 Å²	150.3	80%	0.797	79%	0.789	S	S	*	*				89.7	87.4	94.1	-58.4	0	0	0	0	112.7
269	N	32.5	Very low	37.4	Very low	169 Å²	169	147.7 Å²	147.7	90%	0.904	79%	0.79	S	S	*	*			trans	-154.8	58.3	149.1	-119.7	-7.5	0	0	0	109.6
270	E	31.1	Very low	35.6	Very low	196 Å²	196	147.6 Å²	147.6	92%	0.916	79%	0.792	S	S	*	*			trans	-110.9	81.1	165	-72.2	-175.5	145.2	0	0	107.5
271	Q	31.1	Very low	34.1	Very low	186 Å²	186	151 Å²	151	87%	0.869	80%	0.798	S	S	*	*			trans	-134.9	119.6	156	-89.8	-170.1	-9.5	0	0	109.3
272	K	28.5	Very low	33.2	Very low	187 Å²	187	153 Å²	153	81%	0.813	80%	0.801	S	S	*	*			trans	87.5	94.4	148.6	-145.5	179.6	-170.9	-168.1	0	116.7
273	L	33.2	Very low	32	Very low	184 Å²	184	154 Å²	154	96%	0.963	81%	0.806	S	S	*	*			trans	-150.9	77.2	138.8	-100.9	146.5	0	0	0	107.7
274	S	28.8	Very low	30.9	Very low	90 Å²	90	148.8 Å²	148.8	63%	0.629	80%	0.803	S	S	*	*			trans	-78.2	119.6	159.7	57.4	0	0	0	0	107.9
275	I	27.8	Very low	30.3	Very low	144 Å²	144	150.3 Å²	150.3	74%	0.738	81%	0.805	S	S	*	*			trans	48.3	105.7	136.9	-50.1	167	0	0	0	115.4
276	D	28	Very low	29.5	Very low	164 Å²	164	149.8 Å²	149.8	88%	0.877	81%	0.805	S	S	*	*			trans	-146.8	104.9	131.5	-104.8	-27.1	0	0	0	109.3
277	E	27.9	Very low	29.1	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	80%	0.798	S	S	*	*			trans	-87	100.7	169.8	-171.4	178.1	-176.1	0	0	106
278	S	29.2	Very low	28.6	Very low	97 Å²	97	150.5 Å²	150.5	68%	0.678	81%	0.805	S	S	*	*			trans	-160.5	122.8	170.1	-79	0	0	0	0	112.2
279	N	27.7	Very low	28.6	Very low	146 Å²	146	151.4 Å²	151.4	78%	0.781	80%	0.8	S	S	*	*			trans	86.3	93.9	150.9	-61.8	-19.9	0	0	0	120.2
280	S	25	Very low	28.4	Very low	99 Å²	99	152 Å²	152	69%	0.692	79%	0.794	S	S	*	*				57.5	116	113.6	69.3	0	0	0	0	120.6
281	N	22.1	Very low	28.6	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	79%	0.787	S	S	*	*				58.1	95.4	118.4	-147.3	18.2	0	0	0	118
282	I	33.7	Very low	28.6	Very low	157 Å²	157	146.9 Å²	146.9	81%	0.805	78%	0.782	S	S	*	*			trans	-136.9	105.6	153.5	-56.1	177.7	0	0	0	108.7
283	D	26.1	Very low	28.8	Very low	139 Å²	139	145 Å²	145	74%	0.743	78%	0.781	S	S	*	*			trans	34.8	123.5	142.6	-67.5	-43.2	0	0	0	123.2
284	S	25.6	Very low	28.6	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	77%	0.769	S	S	*	*			trans	-6.4	131.1	138.1	-57.7	0	0	0	0	118.7
285	E	28.8	Very low	28.7	Very low	184 Å²	184	144.6 Å²	144.6	86%	0.86	78%	0.775	S	S	*	*				-159.8	132.6	120.3	-130.2	-178	167.2	0	0	112.6
286	H	24.6	Very low	28.9	Very low	190 Å²	190	143.4 Å²	143.4	88%	0.88	77%	0.769	S	S	*	*			trans	-64.2	125.5	170.2	-94.8	-96.1	0	0	0	110.9
287	V	31.3	Very low	28.9	Very low	110 Å²	110	144.3 Å²	144.3	67%	0.667	77%	0.768	S	S	*	*			trans	-128.8	101.6	162.7	178.5	0	0	0	0	109.7	I289	V287-I289 HydrophobicContact CG1-CD1 3.45Å; V287-I289 VanDerWaalsContact CG1-CD1 3.45Å; V287-I289 HydrophobicContact CG1-CG1 3.61Å
288	N	23.4	Very low	28.8	Very low	152 Å²	152	145.2 Å²	145.2	81%	0.813	77%	0.765	S	S	*	*			trans	-78.7	108	166.9	177.7	3.8	0	0	0	108.5
289	I	33.6	Very low	28.7	Very low	132 Å²	132	148.4 Å²	148.4	68%	0.677	77%	0.769	S	S	*	*			trans	-120.2	104.6	168.8	-67.3	164.1	0	0	0	108.8	V287 S291	V287-I289 HydrophobicContact CG1-CD1 3.45Å; V287-I289 VanDerWaalsContact CG1-CD1 3.45Å; V287-I289 HydrophobicContact CG1-CG1 3.61Å; I289-S291 PolarHBondContact O-N 3.47Å
290	K	28.8	Very low	28.6	Very low	181 Å²	181	147.8 Å²	147.8	79%	0.787	77%	0.77	S	S	*	*			trans	-36.4	120.1	157	-98.5	174	165.2	-176	0	111
291	S	36.2	Very low	28.9	Very low	109 Å²	109	149.3 Å²	149.3	76%	0.762	77%	0.771	S	S	*	*			trans	-106.4	105.4	162.5	-5.9	0	0	0	0	107.9	I289 N293	I289-S291 PolarHBondContact O-N 3.47Å; S291-N293 PolarHBondContact O-N 3.49Å
292	E	30.3	Very low	29	Very low	166 Å²	166	144.7 Å²	144.7	78%	0.776	76%	0.76	S	S	*	*			trans	-88.3	93.4	-176.7	-164.9	167.9	-141.8	0	0	108.2	T294	E292-T294 PolarHBondContact O-N 2.67Å
293	N	33.2	Very low	28.9	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	76%	0.761	S	S	*	*			trans	-94.2	89.9	173.6	-79	4.1	0	0	0	109.4	S291 I295	S291-N293 PolarHBondContact O-N 3.49Å; N293-I295 PolarHBondContact O-N 3.24Å
294	T	29.1	Very low	29.2	Very low	113 Å²	113	144.8 Å²	144.8	69%	0.693	77%	0.768	S	S	*	*			trans	-65.6	110.5	172.1	-53.4	0	0	0	0	110.1	E292 I296	E292-T294 PolarHBondContact O-N 2.67Å; T294-I296 HydrophobicContact CG2-CG1 4.35Å; T294-I296 PolarHBondContact O-N 3.35Å
295	I	30.1	Very low	29.3	Very low	151 Å²	151	145.2 Å²	145.2	77%	0.774	77%	0.766	S	S	*	*			trans	-80.2	110.1	168.7	-62.5	171.3	0	0	0	107.2	N293 E297	N293-I295 PolarHBondContact O-N 3.24Å; I295-E297 PolarHBondContact O-N 3.27Å
296	I	31.5	Very low	29.1	Very low	119 Å²	119	142.5 Å²	142.5	61%	0.61	76%	0.762	S	S	*	*			trans	-84	100.7	172.6	-59.5	173.2	0	0	0	107.4	T294 Y298	T294-I296 HydrophobicContact CG2-CG1 4.35Å; T294-I296 PolarHBondContact O-N 3.35Å; I296-Y298 HydrophobicContact CG2-CE2 4.29Å
297	E	28	Very low	29.3	Very low	183 Å²	183	139.4 Å²	139.4	86%	0.855	76%	0.756	S	S	*	*			trans	-79.5	120.8	167.5	-112.8	-178.1	173.1	0	0	109.5	I295 H299	I295-E297 PolarHBondContact O-N 3.27Å; E297-H299 PolarHBondContact O-N 3.5Å
298	Y	26.9	Very low	28.8	Very low	203 Å²	203	140.9 Å²	140.9	80%	0.796	76%	0.761	S	S	*	*			trans	-83.2	107.3	174.3	-66.6	-89.6	0	0	0	109.7	I296	I296-Y298 HydrophobicContact CG2-CE2 4.29Å
299	H	26.5	Very low	29	Very low	164 Å²	164	139.7 Å²	139.7	76%	0.759	76%	0.758	S	S	*	*			trans	-99.4	106.6	164.9	-149.1	-79.4	0	0	0	108.8	E297 N301	E297-H299 PolarHBondContact O-N 3.5Å; H299-N301 PolarHBondContact CE1-OD1 3.46Å; H299-N301 VanDerWaalsContact CE1-OD1 3.3Å; H299-N301 PolarHBondContact ND1-OD1 2.74Å; H299-N301 VanDerWaalsContact ND1-OD1 3.1Å; H299-N301 PolarHBondContact O-N 3.18Å
300	V	26.4	Very low	28.5	Very low	133 Å²	133	142.1 Å²	142.1	81%	0.806	76%	0.764	S	S	*	*			trans	-87.2	93.8	175.9	-179.9	0	0	0	0	108.1
301	N	30.8	Very low	28.5	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	77%	0.768	S	S	*	*			trans	-94	126.2	159.8	-80.7	8.7	0	0	0	108.4	H299	H299-N301 PolarHBondContact CE1-OD1 3.46Å; H299-N301 VanDerWaalsContact CE1-OD1 3.3Å; H299-N301 PolarHBondContact ND1-OD1 2.74Å; H299-N301 VanDerWaalsContact ND1-OD1 3.1Å; H299-N301 PolarHBondContact O-N 3.18Å
302	G	25.2	Very low	28.1	Very low	60 Å²	60	139 Å²	139	62%	0.619	77%	0.765	S	S	*	*			trans	-64.9	157.6	177.3	0	0	0	0	0	112.6
303	D	31.2	Very low	27.9	Very low	152 Å²	152	139 Å²	139	81%	0.813	77%	0.77	S	S	*	*			trans	78.7	82.2	167.4	-47.9	-25.9	0	0	0	116
304	T	32.4	Very low	27.8	Very low	146 Å²	146	137.9 Å²	137.9	90%	0.896	77%	0.768	S	S	*	*				170.9	146.8	110.2	35.5	0	0	0	0	112
305	T	28	Very low	27.6	Very low	121 Å²	121	138 Å²	138	74%	0.742	77%	0.774	S	S	*	*			trans	-70.8	140.2	179.8	45.8	0	0	0	0	112.8
306	T	24.4	Very low	27.6	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	77%	0.769	S	S	*	*			trans	79.2	124.8	146.8	58.5	0	0	0	0	120.5
307	V	28.5	Very low	27.2	Very low	125 Å²	125	137.9 Å²	137.9	76%	0.758	78%	0.782	S	S	*	*			trans	100.6	118.7	143.6	-152.6	0	0	0	0	119.1
308	D	21.2	Very low	27.3	Very low	141 Å²	141	133.9 Å²	133.9	75%	0.754	77%	0.77	S	S	*	*			trans	2.2	139.3	155.8	-62.5	-69.6	0	0	0	120.4
309	V	26.4	Very low	27.2	Very low	126 Å²	126	130.8 Å²	130.8	76%	0.764	77%	0.772	S	S	*	*				162.9	135.7	106.9	159.3	0	0	0	0	111.6
310	K	24.1	Very low	27.3	Very low	184 Å²	184	128.9 Å²	128.9	80%	0.8	77%	0.766	S	S	*	*			trans	48.1	112	155.5	-87.2	171.5	160.7	169.8	0	120.3	S312	K310-S312 PolarHBondContact O-N 3.32Å; K310-S312 VanDerWaalsContact O-N 3.13Å
311	S	27.3	Very low	27.2	Very low	124 Å²	124	127.6 Å²	127.6	87%	0.867	76%	0.764	S	S	*	*			trans	-51.5	108.2	149.6	-45.2	0	0	0	0	111.3
312	S	28.1	Very low	26.9	Very low	99 Å²	99	128.1 Å²	128.1	69%	0.692	77%	0.766	S	S	*	*			trans	-107.9	117.2	159.6	-65	0	0	0	0	108	K310 V314	K310-S312 PolarHBondContact O-N 3.32Å; K310-S312 VanDerWaalsContact O-N 3.13Å; S312-V314 PolarHBondContact O-N 2.87Å; S312-V314 VanDerWaalsContact O-N 3.12Å
313	N	26.7	Very low	26.9	Very low	167 Å²	167	135.7 Å²	135.7	89%	0.893	78%	0.776	S	S	*	*			trans	-60.6	106	171.8	-69.8	-33.7	0	0	0	109.4
314	V	30.2	Very low	26.5	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	77%	0.771	S	S	*	*			trans	-115.7	102.9	163	-177.3	0	0	0	0	107.3	S312 P316	S312-V314 PolarHBondContact O-N 2.87Å; S312-V314 VanDerWaalsContact O-N 3.12Å; V314-P316 WeakPolarHBondContact O-CD 3.49Å
315	S	25.1	Very low	26.2	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	77%	0.768	S	S	*	*			trans	-53.1	133.7	164.9	-117.3	0	0	0	0	110.3
316	P	30.2	Very low	25.9	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	77%	0.769	S	S	*	*			trans	-126.4	89.4	149.1	28.8	-9.5	0	0	0	108.6	V314 T318	V314-P316 WeakPolarHBondContact O-CD 3.49Å; P316-T318 PolarHBondContact O-N 3.06Å; P316-T318 VanDerWaalsContact O-N 3.09Å
317	N	24.9	Very low	26.1	Very low	163 Å²	163	133.4 Å²	133.4	87%	0.872	77%	0.773	S	S	*	*			trans	-65.1	89.7	134.4	-102.4	-9.2	0	0	0	106.1
318	T	29.7	Very low	25.9	Very low	99 Å²	99	132.2 Å²	132.2	61%	0.607	77%	0.77	S	S	*	*			trans	-140	92.7	160.3	-46.7	0	0	0	0	107.8	P316 I320	P316-T318 PolarHBondContact O-N 3.06Å; P316-T318 VanDerWaalsContact O-N 3.09Å; T318-I320 HydrophobicContact CG2-CG1 4.04Å; T318-I320 PolarHBondContact O-N 2.87Å
319	T	25.2	Very low	26.2	Very low	138 Å²	138	133.2 Å²	133.2	85%	0.847	77%	0.774	S	S	*	*			trans	-50.1	101.1	160.2	-54	0	0	0	0	108.9
320	I	28.4	Very low	26.2	Very low	124 Å²	124	137.7 Å²	137.7	64%	0.636	78%	0.779	S	S	*	*			trans	-106.5	96.7	162.2	-57.4	-179.4	0	0	0	106.6	T318 N322	T318-I320 HydrophobicContact CG2-CG1 4.04Å; T318-I320 PolarHBondContact O-N 2.87Å; I320-N322 HydrophobicContact CG2-CB 4.39Å; I320-N322 WeakPolarHBondContact CG2-ND2 3.15Å; I320-N322 PolarHBondContact O-N 3.32Å
321	S	23.1	Very low	26.3	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	77%	0.774	S	S	*	*			trans	-63	110.2	158.9	178.2	0	0	0	0	107.8
322	N	25.4	Very low	26.2	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	77%	0.772	S	S	*	*			trans	-127	93.9	167.8	-90.9	-17.1	0	0	0	110.3	I320	I320-N322 HydrophobicContact CG2-CB 4.39Å; I320-N322 WeakPolarHBondContact CG2-ND2 3.15Å; I320-N322 PolarHBondContact O-N 3.32Å
323	R	23.7	Very low	26.3	Very low	219 Å²	219	138 Å²	138	83%	0.826	78%	0.781	S	S	*	*			trans	-14.2	124.5	142.4	-175.3	-178.3	-83.2	-154.4	-3.5	113.3	C325	R323-C325 PolarHBondContact O-N 3.36Å
324	S	23.3	Very low	26.4	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	77%	0.771	S	S	*	*			trans	0.3	108.1	152.9	59.8	0	0	0	0	116.4
325	C	25.8	Very low	26.3	Very low	124 Å²	124	136 Å²	136	84%	0.838	78%	0.779	S	S	*	*			trans	-114.1	107	152.2	-78.7	0	0	0	0	107.9	R323 P327	R323-C325 PolarHBondContact O-N 3.36Å; C325-P327 WeakPolarHBondContact O-CD 3.31Å
326	N	21.8	Very low	26.4	Very low	144 Å²	144	134.6 Å²	134.6	77%	0.77	77%	0.77	S	S	*	*			trans	-60.9	130.3	163.8	-74.1	-37.5	0	0	0	109.3	S328	N326-S328 PolarHBondContact O-N 3.38Å
327	P	28.7	Very low	26.2	Very low	132 Å²	132	135.9 Å²	135.9	86%	0.857	77%	0.771	S	S	*	*			trans	-87.8	84.6	151.5	24.4	-9.9	0	0	0	107.6	C325	C325-P327 WeakPolarHBondContact O-CD 3.31Å
328	S	24.2	Very low	26.6	Very low	100 Å²	100	138.5 Å²	138.5	70%	0.699	78%	0.775	S	S	*	*			trans	-92	99.6	152.2	65.3	0	0	0	0	107.4	N326	N326-S328 PolarHBondContact O-N 3.38Å
329	L	28.7	Very low	26.5	Very low	161 Å²	161	141.2 Å²	141.2	84%	0.843	79%	0.786	S	S	*	*			trans	-160.7	90.1	155.5	-109	153.9	0	0	0	108.7
330	Y	26	Very low	26.6	Very low	221 Å²	221	144.1 Å²	144.1	87%	0.867	79%	0.787	S	S	*	*			trans	41.8	112.1	138.4	-84.4	-97.1	0	0	0	118.8
331	G	26.8	Very low	26.4	Very low	67 Å²	67	143.9 Å²	143.9	69%	0.691	80%	0.796	S	S	*	*			trans	-173.4	44.9	159.9	0	0	0	0	0	111.4	L333	G331-L333 VanDerWaalsContact C-N 3.26Å; G331-L333 PolarHBondContact O-N 3.38Å
332	E	24.5	Very low	26.7	Very low	176 Å²	176	147.1 Å²	147.1	82%	0.822	80%	0.801	S	S	*	*			trans	-61.2	89.2	166.2	-76.2	-177.9	136.7	0	0	109.2	S334	E332-S334 VanDerWaalsContact C-N 3.31Å; E332-S334 PolarHBondContact O-N 2.93Å
333	L	30.8	Very low	26.6	Very low	170 Å²	170	149 Å²	149	89%	0.89	80%	0.803	S	S	*	*			trans	-81.3	92.6	156.6	-87.3	131.9	0	0	0	106.9	G331 T335	G331-L333 VanDerWaalsContact C-N 3.26Å; G331-L333 PolarHBondContact O-N 3.38Å; L333-T335 PolarHBondContact O-N 3.08Å
334	S	28.1	Very low	27	Very low	98 Å²	98	148 Å²	148	69%	0.685	81%	0.805	S	S	*	*			trans	-44.5	123.2	179.4	-51.3	0	0	0	0	112.5	E332 S336	E332-S334 VanDerWaalsContact C-N 3.31Å; E332-S334 PolarHBondContact O-N 2.93Å; S334-S336 VanDerWaalsContact C-N 3.33Å; S334-S336 PolarHBondContact O-N 3.41Å
335	T	26.9	Very low	27.1	Very low	151 Å²	151	149.6 Å²	149.6	93%	0.926	81%	0.805	S	S	*	*			trans	-65.2	91.9	155.3	38.3	0	0	0	0	108.7	L333	L333-T335 PolarHBondContact O-N 3.08Å
336	S	27.2	Very low	27.2	Very low	86 Å²	86	150.7 Å²	150.7	60%	0.601	80%	0.803	S	S	*	*			trans	-143.6	125.5	160.5	80.8	0	0	0	0	112.6	S334	S334-S336 VanDerWaalsContact C-N 3.33Å; S334-S336 PolarHBondContact O-N 3.41Å
337	N	26.8	Very low	27.8	Very low	132 Å²	132	152 Å²	152	71%	0.706	80%	0.804	S	S	*	*			trans	70.8	78.9	152.5	-60.7	-39	0	0	0	119.7
338	F	33.2	Very low	27.8	Very low	219 Å²	219	152 Å²	152	96%	0.961	80%	0.802	S	S	*	*			trans	-99.2	35.8	144.8	-84.2	-75.4	0	0	0	112.6
339	N	27.9	Very low	28.2	Very low	155 Å²	155	153.6 Å²	153.6	83%	0.829	81%	0.808	S	S	*	*			trans	-113.4	70.5	162.7	-87	-20.8	0	0	0	109
340	K	27	Very low	28.1	Very low	200 Å²	200	155.5 Å²	155.5	87%	0.87	81%	0.809	S	S	*	*			trans	-125.1	106.7	159.4	-98.6	-179.2	178.6	177.8	0	108.9	M342	K340-M342 PolarHBondContact O-N 2.96Å
341	S	25.3	Very low	28.4	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	81%	0.809	S	S	*	*			trans	-49.4	118.8	165.1	-167.7	0	0	0	0	108.9	K343	S341-K343 PolarHBondContact O-N 3.3Å
342	M	28.8	Very low	28.4	Very low	175 Å²	175	157.2 Å²	157.2	86%	0.862	82%	0.821	S	S	*	*			trans	-79.3	102.4	178.4	-153.6	177.1	174.5	0	0	107.2	K340 F344	K340-M342 PolarHBondContact O-N 2.96Å; M342-F344 PolarHBondContact O-N 2.89Å
343	K	23.5	Very low	28.7	Very low	181 Å²	181	154.7 Å²	154.7	79%	0.787	82%	0.823	S	S	*	*			trans	-65.6	122.8	168.7	-79.8	-175.4	170.9	-174.5	0	108.3	S341 D345	S341-K343 PolarHBondContact O-N 3.3Å; K343-D345 PolarHBondContact O-N 2.85Å
344	F	31	Very low	28.7	Very low	197 Å²	197	151.1 Å²	151.1	86%	0.864	81%	0.812	S	S	*	*			trans	-78.1	108.3	162.9	-106.8	-94.4	0	0	0	107	M342	M342-F344 PolarHBondContact O-N 2.89Å
345	D	27.2	Very low	28.8	Very low	133 Å²	133	157.4 Å²	157.4	71%	0.711	82%	0.821	S	S	*	*			trans	-81.1	132.6	165.8	-83.6	-52.1	0	0	0	109.5	K343 H347	K343-D345 PolarHBondContact O-N 2.85Å; D345-H347 PolarHBondContact O-N 2.63Å
346	D	26.6	Very low	29.3	Very low	148 Å²	148	158.7 Å²	158.7	79%	0.791	82%	0.821	S	S	*	*			trans	-64.3	109.8	-179.9	-82.8	-51.5	0	0	0	111.9
347	H	34.3	Very low	29.3	Very low	172 Å²	172	162.1 Å²	162.1	80%	0.796	83%	0.833	S	S	*	*			trans	-120.2	83	156.7	-72.6	-28	0	0	0	110.1	D345 T349	D345-H347 PolarHBondContact O-N 2.63Å; H347-T349 PolarHBondContact O-N 3.27Å; H347-T349 VanDerWaalsContact O-N 3.11Å
348	T	28.3	Very low	29.4	Very low	131 Å²	131	167.4 Å²	167.4	80%	0.804	84%	0.842	S	S	*	*			trans	-37.2	108.1	149	19.5	0	0	0	0	111.5
349	T	32.3	Very low	29.3	Very low	134 Å²	134	161.7 Å²	161.7	82%	0.822	83%	0.83	S	S	*	*			trans	-123.4	117.6	152	39.8	0	0	0	0	109	H347	H347-T349 PolarHBondContact O-N 3.27Å; H347-T349 VanDerWaalsContact O-N 3.11Å
350	K	27.1	Very low	29.6	Very low	200 Å²	200	159.9 Å²	159.9	87%	0.87	83%	0.83	S	S	*	*			trans	-59.9	131.5	-179.9	-68.7	165.8	175	173.6	0	110.2
351	S	32.4	Very low	29.7	Very low	125 Å²	125	158.7 Å²	158.7	87%	0.874	82%	0.824	S	S	*	*			trans	-141.3	86.2	147	-81.8	0	0	0	0	107.6	S353	S351-S353 PolarHBondContact O-N 2.73Å
352	Q	27.6	Very low	30	Very low	199 Å²	199	156.8 Å²	156.8	93%	0.93	82%	0.823	S	S	*	*			trans	-67.1	114.8	158.5	-89	-179	-26.3	0	0	107.4
353	S	31.1	Very low	29.9	Very low	124 Å²	124	156.2 Å²	156.2	87%	0.867	82%	0.818	S	S	*	*			trans	-132.6	147.9	145.5	-153.7	0	0	0	0	108.7	S351	S351-S353 PolarHBondContact O-N 2.73Å
354	S	29.9	Very low	30.3	Very low	95 Å²	95	152.4 Å²	152.4	66%	0.664	81%	0.814	S	S	*	*			trans	-99.2	152.1	-138.9	58	0	0	0	0	114.5
355	R	31.3	Very low	30.2	Very low	230 Å²	230	149.7 Å²	149.7	87%	0.868	81%	0.809	S	S	*	*			trans	67.3	106.8	145.2	-69.8	170.1	177.6	-174.6	-0.6	117.8
356	L	36.8	Very low	30.2	Very low	177 Å²	177	152.1 Å²	152.1	93%	0.927	82%	0.816	S	S	*	*				-156.2	101	114.6	-99.3	160.1	0	0	0	108.8	R358	L356-R358 PolarHBondContact O-N 3.45Å
357	N	26.4	Very low	30.6	Very low	159 Å²	159	149.2 Å²	149.2	85%	0.85	81%	0.805	S	S	*	*			trans	-63.1	120.9	167.8	-86.2	-32	0	0	0	109.2
358	R	29.6	Very low	30.2	Very low	242 Å²	242	146.8 Å²	146.8	91%	0.913	81%	0.807	S	S	*	*			trans	-115.8	89.3	146.7	-143.1	178.4	-156.8	-145.5	4.5	107.1	L356 S360	L356-R358 PolarHBondContact O-N 3.45Å; R358-S360 PolarHBondContact O-N 2.75Å
359	S	30.6	Very low	30.4	Very low	99 Å²	99	146.5 Å²	146.5	69%	0.692	81%	0.805	S	S	*	*			trans	-76.5	108.1	171.1	-167.3	0	0	0	0	107.5
360	S	34.9	Very low	30.1	Very low	118 Å²	118	145.2 Å²	145.2	83%	0.825	80%	0.802	S	S	*	*			trans	-101.1	99.3	153.8	-68.7	0	0	0	0	106.2	R358 G362	R358-S360 PolarHBondContact O-N 2.75Å; S360-G362 PolarHBondContact O-N 3.42Å
361	K	29.3	Very low	30.2	Very low	175 Å²	175	142.8 Å²	142.8	76%	0.761	80%	0.798	S	S	*	*			trans	-77.4	104.9	174.9	-175.1	154	-179.8	168.3	0	108.1
362	G	31.2	Very low	30.4	Very low	78 Å²	78	142 Å²	142	80%	0.804	79%	0.79	S	S	*	*			trans	-119.7	106.8	163.8	0	0	0	0	0	107.7	S360	S360-G362 PolarHBondContact O-N 3.42Å
363	H	26.9	Very low	30.7	Very low	163 Å²	163	140 Å²	140	76%	0.755	78%	0.784	S	S	*	*			trans	-79.7	160.7	175.9	-123.1	-92.7	0	0	0	110.3
364	S	30.9	Very low	30.7	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	77%	0.774	S	S	*	*			trans	104.9	93.4	155.8	-135.2	0	0	0	0	117.1
365	D	30.6	Very low	30.8	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	78%	0.776	S	S	*	*				41.2	107.7	123.2	-53.9	-40.1	0	0	0	120.4
366	Q	25.9	Very low	30.8	Very low	184 Å²	184	133.8 Å²	133.8	86%	0.86	77%	0.769	S	S	*	*			trans	59.7	155.8	143	-91	-131	-22.3	0	0	121.8
367	P	35.7	Very low	30.9	Very low	87 Å²	87	131.4 Å²	131.4	57%	0.565	76%	0.756	S	S	*	*			cis	-116.4	161.2	-29.2	30.4	-13.4	0	0	0	111.8	V369	P367-V369 PolarHBondContact O-N 2.99Å
368	S	26.1	Very low	31.2	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	76%	0.756	S	S	*	*			trans	-44.4	98.1	164.4	45.7	0	0	0	0	112.8	S370	S368-S370 PolarHBondContact O-N 3.32Å
369	V	32.2	Very low	31.7	Very low	124 Å²	124	127.7 Å²	127.7	75%	0.752	75%	0.747	S	S	*	*			trans	-80.7	100.2	158.9	-177.4	0	0	0	0	106.6	P367 N371	P367-V369 PolarHBondContact O-N 2.99Å; V369-N371 PolarHBondContact O-N 2.8Å
370	S	25.9	Very low	31.9	Very low	108 Å²	108	125.1 Å²	125.1	76%	0.755	73%	0.729	S	S	*	*			trans	-46.7	115.5	163.9	48.4	0	0	0	0	110.6	S368	S368-S370 PolarHBondContact O-N 3.32Å
371	N	29.3	Very low	32.2	Very low	149 Å²	149	125.3 Å²	125.3	80%	0.797	73%	0.728	S	S	*	*			trans	-102.2	148.1	163.4	-105.8	-2	0	0	0	109.9	V369	V369-N371 PolarHBondContact O-N 2.8Å
372	P	36.7	Very low	32.9	Very low	108 Å²	108	122.4 Å²	122.4	70%	0.701	72%	0.717	S	S	*	*				-79.6	140.3	-127.9	28	-34.6	0	0	0	111.9	S374	P372-S374 PolarHBondContact O-N 3.17Å
373	I	34.1	Very low	33.7	Very low	156 Å²	156	125.2 Å²	125.2	80%	0.8	70%	0.704	S	S	*	*			trans	-48.6	105.7	162.5	-63.9	160.4	0	0	0	106.8	P375	I373-P375 VanDerWaalsContact O-N 3.16Å
374	S	30.3	Very low	35.1	Very low	95 Å²	95	121.5 Å²	121.5	66%	0.664	69%	0.689	S	S	*	*			trans	-42.9	123.9	160.3	-57.1	0	0	0	0	106.5	P372 T376	P372-S374 PolarHBondContact O-N 3.17Å; S374-T376 VanDerWaalsContact C-N 3.26Å; S374-T376 PolarHBondContact O-N 2.82Å
375	P	32.6	Very low	36.2	Very low	108 Å²	108	123.2 Å²	123.2	70%	0.701	68%	0.684	S	S	*	*			trans	-61.6	102.5	-177.9	25	-31.1	0	0	0	105.4	I373 L377	I373-P375 VanDerWaalsContact O-N 3.16Å; P375-L377 PolarHBondContact O-N 3.2Å
376	T	31.6	Very low	37.5	Very low	117 Å²	117	121 Å²	121	72%	0.718	67%	0.666	S	S	*	*			trans	-64.5	90.8	161.2	-64.1	0	0	0	0	101.3	S374 Q378	S374-T376 VanDerWaalsContact C-N 3.26Å; S374-T376 PolarHBondContact O-N 2.82Å; T376-Q378 PolarHBondContact O-N 3.36Å
377	L	38.3	Very low	39.2	Very low	126 Å²	126	122 Å²	122	66%	0.66	66%	0.661	S	S	*	*			trans	-56.9	91.6	165.4	-71.5	172.6	0	0	0	103.3	P375 I379	P375-L377 PolarHBondContact O-N 3.2Å; L377-I379 HydrophobicContact CB-CG1 4.27Å; L377-I379 PolarHBondContact O-N 3.36Å
378	Q	32.5	Very low	40.8	Very low	182 Å²	182	118.1 Å²	118.1	85%	0.85	64%	0.636	S	S	*	*			trans	-65.6	76.7	167	-120.6	-168.8	-32.8	0	0	103.9	T376 S380	T376-Q378 PolarHBondContact O-N 3.36Å; Q378-S380 PolarHBondContact O-N 2.64Å
379	I	39.8	Very low	42.4	Very low	141 Å²	141	114.7 Å²	114.7	72%	0.723	62%	0.62	S	S	*	*			trans	-65	98.7	165	-59	168.8	0	0	0	102.1	L377 P381	L377-I379 HydrophobicContact CB-CG1 4.27Å; L377-I379 PolarHBondContact O-N 3.36Å; I379-P381 VanDerWaalsContact O-CD 3.29Å; I379-P381 WeakPolarHBondContact O-CD 3.31Å
380	S	35.9	Very low	43.7	Very low	46 Å²	46	109 Å²	109	32%	0.322	59%	0.586	S	S	.	*			trans	-48.5	120	173	179.8	0	0	0	0	106	Q378 Q382	Q378-S380 PolarHBondContact O-N 2.64Å; S380-Q382 PolarHBondContact O-N 3.47Å; S380-Q382 WeakPolarHBondContact OG-CG 3.45Å; S380-Q382 PolarHBondContact OG-OE1 3.15Å
381	P	41.3	Very low	45.2	Very low	122 Å²	122	104.7 Å²	104.7	79%	0.792	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-63.2	7.3	-176	17.8	-25.9	0	0	0	113.6	I379 Y383	I379-P381 VanDerWaalsContact O-CD 3.29Å; I379-P381 WeakPolarHBondContact O-CD 3.31Å; P381-Y383 VanDerWaalsContact C-N 3.3Å; P381-Y383 PolarHBondContact O-N 2.94Å
382	Q	44	Very low	46.6	Very low	113 Å²	113	104.5 Å²	104.5	53%	0.528	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-71.4	-7.3	-175	-70.9	175.4	-1.3	0	0	115.6	S380 R386	S380-Q382 PolarHBondContact O-N 3.47Å; S380-Q382 WeakPolarHBondContact OG-CG 3.45Å; S380-Q382 PolarHBondContact OG-OE1 3.15Å; Q382-R386 PolarHBondContact O-NE 3.23Å; Q382-R386 PolarHBondContact O-NH2 3.26Å
383	Y	47.7	Very low	47.6	Very low	137 Å²	137	104.2 Å²	104.2	54%	0.537	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-118.1	-9.1	-168.8	-70.6	-74.1	0	0	0	118.1	P381	P381-Y383 VanDerWaalsContact C-N 3.3Å; P381-Y383 PolarHBondContact O-N 2.94Å
384	L	55.8	Low	49	Very low	85 Å²	85	103.4 Å²	103.4	45%	0.445	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.9	-36.2	-175	-126	86.5	0	0	0	115.2	F205 I401	F205-L384 HydrophobicContact CZ-CD2 4.42Å; L384-I401 WeakPolarHBondContact O-CA 3.35Å
385	F	54.8	Low	50.6	Low	137 Å²	137	106.4 Å²	106.4	60%	0.601	57%	0.568	S	S	*	*			trans	-138.6	104.5	178.2	-64.8	-76.4	0	0	0	109.1	P399 V400 I401	F385-P399 HydrophobicContact CD1-CB 4.23Å; F385-V400 WeakPolarHBondContact CA-O 3.3Å; F385-I401 HydrophobicContact CD1-CG1 4.35Å; F385-I401 HydrophobicContact CE1-CG1 3.95Å
386	R	57.3	Low	52.4	Low	96 Å²	96	102 Å²	102	36%	0.362	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	156.2	169.5	-65.8	-166.9	170	-143.6	-0.5	109.4	Q382 C388 V400 A402	Q382-R386 PolarHBondContact O-NE 3.23Å; Q382-R386 PolarHBondContact O-NH2 3.26Å; R386-C388 PolarHBondContact O-N 3.16Å; R386-V400 PolarHBondContact N-O 3.44Å; R386-V400 PolarHBondContact O-N 3.1Å; R386-A402 HydrophobicContact CB-CB 3.92Å; R386-A402 HydrophobicContact CG-CB 4.25Å
387	R	62	Low	54	Low	203 Å²	203	101.5 Å²	101.5	77%	0.766	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	136.2	164.1	-67.4	-174	-179.4	-164.7	-0.6	107.9	G389	R387-G389 PolarHBondContact O-N 3.44Å
388	C	67.7	Low	55	Low	6 Å²	6	99.7 Å²	99.7	4%	0.041	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-48.1	134.8	168.8	168	0	0	0	0	109.6	R386 G390 C396 E398 V400 C409 H412	R386-C388 PolarHBondContact O-N 3.16Å; C388-G390 PolarHBondContact O-N 2.93Å; C388-C396 HydrophobicContact CB-CB 3.64Å; C388-E398 PolarHBondContact N-O 3.09Å; C388-V400 HydrophobicContact CB-CG2 3.57Å; C388-C409 HydrophobicContact CB-CB 3.95Å; C388-C409 PolarHBondContact SG-N 3.41Å; C388-C409 PolarHBondContact SG-SG 3.23Å; C388-H412 PolarHBondContact SG-ND1 2.89Å
389	G	60.8	Low	56.4	Low	49 Å²	49	95 Å²	95	51%	0.505	51%	0.514	S	S	.	.			trans	-61.7	11.7	-179	0	0	0	0	0	116.3	R387	R387-G389 PolarHBondContact O-N 3.44Å
390	G	60.2	Low	57.4	Low	4 Å²	4	89 Å²	89	4%	0.041	48%	0.484	C	S	.	.			trans	67.9	158.7	176.2	0	0	0	0	0	114.4	C388 Q394 R408	C388-G390 PolarHBondContact O-N 2.93Å; G390-Q394 VanDerWaalsContact CA-O 3.31Å; G390-Q394 WeakPolarHBondContact CA-O 3.09Å; G390-R408 PolarHBondContact O-NH1 2.97Å
391	G	56.9	Low	58.6	Low	19 Å²	19	91.4 Å²	91.4	20%	0.196	49%	0.493	C	S	.	.	B	Isolated β-bridge	trans	-80	175	162.7	0	0	0	0	0	111	S393 Q394 H412	G391-S393 PolarHBondContact O-N 2.78Å; G391-Q394 PolarHBondContact N-O 2.91Å; G391-H412 PolarHBondContact N-CD2 2.71Å; G391-H412 PolarHBondContact N-NE2 2.96Å
392	P	59.3	Low	59.1	Low	145 Å²	145	85.8 Å²	85.8	94%	0.942	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-12.7	-179	20.9	-31.1	0	0	0	115
393	S	57.6	Low	59.5	Low	101 Å²	101	89.8 Å²	89.8	71%	0.706	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	2.1	-177.7	57.5	0	0	0	0	116.7	G391	G391-S393 PolarHBondContact O-N 2.78Å
394	Q	61.8	Low	59.9	Low	140 Å²	140	87 Å²	87	65%	0.654	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-148.2	137.6	178.8	-68.3	-62.6	-13	0	0	113.9	G390 G391 C396	G390-Q394 VanDerWaalsContact CA-O 3.31Å; G390-Q394 WeakPolarHBondContact CA-O 3.09Å; G391-Q394 PolarHBondContact N-O 2.91Å; Q394-C396 PolarHBondContact O-N 2.94Å
395	N	64	Low	59.9	Low	157 Å²	157	87.1 Å²	87.1	84%	0.84	47%	0.467	S	S	*	.			trans	-69.6	123.8	168.2	-73.4	-37.9	0	0	0	109.5
396	C	71.4	Confident	60.2	Low	17 Å²	17	88.2 Å²	88.2	12%	0.115	47%	0.472	C	S	.	.			trans	-96.2	125.7	-179.9	-170.7	0	0	0	0	110.8	C388 Q394 E398 H412	C388-C396 HydrophobicContact CB-CB 3.64Å; Q394-C396 PolarHBondContact O-N 2.94Å; C396-E398 VanDerWaalsContact C-N 3.34Å; C396-H412 WeakPolarHBondContact CB-CE1 3.26Å; C396-H412 WeakPolarHBondContact CB-ND1 3.49Å; C396-H412 PolarHBondContact SG-CE1 3.45Å; C396-H412 PolarHBondContact SG-ND1 2.77Å; C396-H412 VanDerWaalsContact SG-ND1 3.38Å
397	S	65.7	Low	60.6	Low	105 Å²	105	85.4 Å²	85.4	73%	0.734	47%	0.466	S	S	*	.			trans	-84.6	-4.8	177.2	47.4	0	0	0	0	113.9
398	E	58.9	Low	60.8	Low	88 Å²	88	80.3 Å²	80.3	41%	0.411	45%	0.446	S	S	.	.			trans	-64.7	125.8	177.4	-79.8	-74.8	147.5	0	0	110.8	C388 C396 C409 Y411	C388-E398 PolarHBondContact N-O 3.09Å; C396-E398 VanDerWaalsContact C-N 3.34Å; E398-C409 HydrophobicContact CB-CB 3.86Å; E398-C409 HydrophobicContact CG-CB 4.47Å; E398-Y411 HydrophobicContact CG-CD2 4.29Å; E398-Y411 HydrophobicContact CG-CE2 4.37Å
399	P	62	Low	61.1	Low	83 Å²	83	80.5 Å²	80.5	54%	0.539	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.3	173.2	30.1	-32.3	0	0	0	109.7	F385	F385-P399 HydrophobicContact CD1-CB 4.23Å
400	V	60.2	Low	61.5	Low	15 Å²	15	86.3 Å²	86.3	9%	0.091	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.3	175.6	-174	0	0	0	0	108.3	F385 R386 C388 A402 T407 C409	F385-V400 WeakPolarHBondContact CA-O 3.3Å; R386-V400 PolarHBondContact N-O 3.44Å; R386-V400 PolarHBondContact O-N 3.1Å; C388-V400 HydrophobicContact CB-CG2 3.57Å; V400-A402 HydrophobicContact CB-CB 4.45Å; V400-A402 HydrophobicContact CG1-CB 4.38Å; V400-A402 PolarHBondContact O-N 3.46Å; V400-T407 HydrophobicContact CG1-CG2 3.48Å; V400-T407 VanDerWaalsContact CG1-CG2 3.48Å; V400-C409 HydrophobicContact CG2-CB 3.73Å
401	I	60.4	Low	61.7	Low	98 Å²	98	95.1 Å²	95.1	50%	0.503	50%	0.497	S	S	.	.			trans	-72.1	87.3	165.4	-55.5	174.4	0	0	0	106.6	L384 F385	L384-I401 WeakPolarHBondContact O-CA 3.35Å; F385-I401 HydrophobicContact CD1-CG1 4.35Å; F385-I401 HydrophobicContact CE1-CG1 3.95Å
402	A	53	Low	62.4	Low	4 Å²	4	96.3 Å²	96.3	3%	0.033	50%	0.497	C	S	.	.			trans	-104.1	105.6	-169.6	0	0	0	0	0	110.4	R386 V400 N404 T407	R386-A402 HydrophobicContact CB-CB 3.92Å; R386-A402 HydrophobicContact CG-CB 4.25Å; V400-A402 HydrophobicContact CB-CB 4.45Å; V400-A402 HydrophobicContact CG1-CB 4.38Å; V400-A402 PolarHBondContact O-N 3.46Å; A402-N404 VanDerWaalsContact C-N 3.27Å; A402-T407 WeakPolarHBondContact CA-OG1 3.44Å; A402-T407 HydrophobicContact CB-CG2 4.39Å
403	W	52.5	Low	62.7	Low	196 Å²	196	92.2 Å²	92.2	74%	0.742	47%	0.472	S	S	*	.	S	Bend	trans	-76.5	-18.9	170	-56.2	97.3	0	0	0	112
404	N	54.9	Low	62.6	Low	78 Å²	78	91.6 Å²	91.6	42%	0.417	46%	0.464	S	S	.	.	S	Bend	trans	-134.2	157.3	178.1	69.4	32.6	0	0	0	111	A402 F406 T407	A402-N404 VanDerWaalsContact C-N 3.27Å; N404-F406 PolarHBondContact O-N 3.41Å; N404-F406 VanDerWaalsContact O-N 3.15Å; N404-F406 VanDerWaalsContact OD1-C 3.32Å; N404-F406 PolarHBondContact OD1-N 2.99Å; N404-F406 VanDerWaalsContact OD1-N 3.17Å; N404-T407 PolarHBondContact N-OG1 2.93Å; N404-T407 PolarHBondContact O-N 3.36Å; N404-T407 PolarHBondContact O-OG1 3.32Å; N404-T407 PolarHBondContact OD1-N 3Å; N404-T407 PolarHBondContact OD1-OG1 2.74Å
405	P	57.7	Low	62.1	Low	88 Å²	88	92.9 Å²	92.9	57%	0.571	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-10.9	-179.8	24.8	-32.2	0	0	0	114.1
406	F	61	Low	61.2	Low	160 Å²	160	90.8 Å²	90.8	70%	0.702	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	2	-179.6	-50.2	-70.9	0	0	0	113.1	N404 R408	N404-F406 PolarHBondContact O-N 3.41Å; N404-F406 VanDerWaalsContact O-N 3.15Å; N404-F406 VanDerWaalsContact OD1-C 3.32Å; N404-F406 PolarHBondContact OD1-N 2.99Å; N404-F406 VanDerWaalsContact OD1-N 3.17Å; F406-R408 WeakPolarHBondContact O-CG 3.5Å; F406-R408 PolarHBondContact O-N 2.8Å
407	T	65.1	Low	59.8	Low	37 Å²	37	94.2 Å²	94.2	23%	0.227	49%	0.491	C	S	.	.			trans	-70.1	121.6	-178.5	-39.2	0	0	0	0	108.3	V400 A402 N404	V400-T407 HydrophobicContact CG1-CG2 3.48Å; V400-T407 VanDerWaalsContact CG1-CG2 3.48Å; A402-T407 WeakPolarHBondContact CA-OG1 3.44Å; A402-T407 HydrophobicContact CB-CG2 4.39Å; N404-T407 PolarHBondContact N-OG1 2.93Å; N404-T407 PolarHBondContact O-N 3.36Å; N404-T407 PolarHBondContact O-OG1 3.32Å; N404-T407 PolarHBondContact OD1-N 3Å; N404-T407 PolarHBondContact OD1-OG1 2.74Å
408	R	66.3	Low	58.5	Low	97 Å²	97	95.5 Å²	95.5	37%	0.366	49%	0.494	S	S	.	.			trans	-107.5	148.4	-177	-70.1	171.6	-173.5	-101	-9.6	109.3	G390 F406 H412	G390-R408 PolarHBondContact O-NH1 2.97Å; F406-R408 WeakPolarHBondContact O-CG 3.5Å; F406-R408 PolarHBondContact O-N 2.8Å; R408-H412 HydrophobicContact CB-CB 3.83Å; R408-H412 WeakPolarHBondContact CD-O 3.41Å; R408-H412 HydrophobicContact CG-CB 4.16Å
409	C	74.7	Confident	57.4	Low	10 Å²	10	96.8 Å²	96.8	7%	0.068	51%	0.511	C	S	.	.			trans	-67.7	167.7	169.8	68.6	0	0	0	0	109.6	C388 E398 V400 Y411 H412 S413	C388-C409 HydrophobicContact CB-CB 3.95Å; C388-C409 PolarHBondContact SG-N 3.41Å; C388-C409 PolarHBondContact SG-SG 3.23Å; E398-C409 HydrophobicContact CB-CB 3.86Å; E398-C409 HydrophobicContact CG-CB 4.47Å; V400-C409 HydrophobicContact CG2-CB 3.73Å; C409-Y411 PolarHBondContact O-N 3.43Å; C409-H412 CarbonylContact O-C 3.57Å; C409-H412 PolarHBondContact O-N 3.1Å; C409-H412 PolarHBondContact SG-ND1 2.99Å; C409-S413 PolarHBondContact O-N 3.33Å
410	M	68.5	Low	56	Low	170 Å²	170	97.9 Å²	97.9	84%	0.837	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-29.2	179.4	-72.7	-145	72.2	0	0	113.8	H412 S413	M410-H412 VanDerWaalsContact C-N 3.3Å; M410-H412 PolarHBondContact O-N 3.2Å; M410-S413 WeakPolarHBondContact CA-OG 3.19Å; M410-S413 PolarHBondContact O-OG 3.22Å
411	Y	64.5	Low	54.5	Low	190 Å²	190	105.2 Å²	105.2	75%	0.745	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-20.8	177.1	-56.6	-72.3	0	0	0	113.7	E398 C409	E398-Y411 HydrophobicContact CG-CD2 4.29Å; E398-Y411 HydrophobicContact CG-CE2 4.37Å; C409-Y411 PolarHBondContact O-N 3.43Å
412	H	71	Confident	53.2	Low	44 Å²	44	106.6 Å²	106.6	20%	0.204	57%	0.569	C	S	.	*	T	Hydrogen-bonded Turn	trans	-115.7	-8.3	-177.9	-67.6	118.3	0	0	0	113.6	C388 G391 C396 R408 C409 M410 T414	C388-H412 PolarHBondContact SG-ND1 2.89Å; G391-H412 PolarHBondContact N-CD2 2.71Å; G391-H412 PolarHBondContact N-NE2 2.96Å; C396-H412 WeakPolarHBondContact CB-CE1 3.26Å; C396-H412 WeakPolarHBondContact CB-ND1 3.49Å; C396-H412 PolarHBondContact SG-CE1 3.45Å; C396-H412 PolarHBondContact SG-ND1 2.77Å; C396-H412 VanDerWaalsContact SG-ND1 3.38Å; R408-H412 HydrophobicContact CB-CB 3.83Å; R408-H412 WeakPolarHBondContact CD-O 3.41Å; R408-H412 HydrophobicContact CG-CB 4.16Å; C409-H412 CarbonylContact O-C 3.57Å; C409-H412 PolarHBondContact O-N 3.1Å; C409-H412 PolarHBondContact SG-ND1 2.99Å; M410-H412 VanDerWaalsContact C-N 3.3Å; M410-H412 PolarHBondContact O-N 3.2Å; H412-T414 PolarHBondContact O-N 3.07Å; H412-T414 VanDerWaalsContact O-N 3.15Å
413	S	65.4	Low	52.3	Low	58 Å²	58	112.6 Å²	112.6	41%	0.406	61%	0.605	S	S	.	*			trans	-73.5	102.1	174.1	58.3	0	0	0	0	109.8	C409 M410	C409-S413 PolarHBondContact O-N 3.33Å; M410-S413 WeakPolarHBondContact CA-OG 3.19Å; M410-S413 PolarHBondContact O-OG 3.22Å
414	T	56.1	Low	51.3	Low	89 Å²	89	108.8 Å²	108.8	55%	0.546	61%	0.609	S	S	.	*			trans	-81.7	134.8	162.9	46.1	0	0	0	0	109.4	H412 T416 S417	H412-T414 PolarHBondContact O-N 3.07Å; H412-T414 VanDerWaalsContact O-N 3.15Å; T414-T416 PolarHBondContact O-N 3.18Å; T414-S417 PolarHBondContact O-N 3.04Å; T414-S417 PolarHBondContact O-OG 3.45Å
415	I	52	Low	50.2	Low	166 Å²	166	112.4 Å²	112.4	85%	0.851	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-57	-18.5	-177.4	-65	168.4	0	0	0	112.3	S417	I415-S417 VanDerWaalsContact C-N 3.33Å; I415-S417 PolarHBondContact O-N 2.99Å
416	T	44.7	Very low	49	Very low	114 Å²	114	116.3 Å²	116.3	70%	0.699	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-72.9	-11	-177.2	27.1	0	0	0	0	115.9	T414	T414-T416 PolarHBondContact O-N 3.18Å
417	S	41.4	Very low	47.6	Very low	88 Å²	88	116.3 Å²	116.3	62%	0.615	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-88.2	2.3	-176.4	63	0	0	0	0	116.2	T414 I415	T414-S417 PolarHBondContact O-N 3.04Å; T414-S417 PolarHBondContact O-OG 3.45Å; I415-S417 VanDerWaalsContact C-N 3.33Å; I415-S417 PolarHBondContact O-N 2.99Å
418	V	39.2	Very low	46.1	Very low	133 Å²	133	121.5 Å²	121.5	81%	0.806	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-101.2	-1.7	178.8	-175.7	0	0	0	0	112.6
419	C	34.3	Very low	44.3	Very low	114 Å²	114	127.3 Å²	127.3	77%	0.77	71%	0.706	S	S	*	*			trans	-123.9	61.8	-175	-136.6	0	0	0	0	112.5
420	T	32.3	Very low	42.2	Very low	107 Å²	107	130.5 Å²	130.5	66%	0.656	73%	0.733	S	S	*	*			trans	-143.8	78.9	160.2	56.1	0	0	0	0	110
421	D	30.2	Very low	40.4	Very low	168 Å²	168	129 Å²	129	90%	0.898	73%	0.734	S	S	*	*			trans	-122.4	53	146.2	-82.5	-29.1	0	0	0	107.7	T423	D421-T423 VanDerWaalsContact C-N 3.27Å; D421-T423 PolarHBondContact O-N 3.04Å
422	T	33.4	Very low	39	Very low	127 Å²	127	124.8 Å²	124.8	78%	0.779	74%	0.738	S	S	*	*			trans	-77.5	90.7	155.2	19.2	0	0	0	0	106.7	S424	T422-S424 PolarHBondContact O-N 2.87Å
423	T	33.3	Very low	37	Very low	130 Å²	130	131.8 Å²	131.8	80%	0.798	77%	0.768	S	S	*	*			trans	-33.8	110.1	159.7	11.7	0	0	0	0	110.4	D421 L425	D421-T423 VanDerWaalsContact C-N 3.27Å; D421-T423 PolarHBondContact O-N 3.04Å; T423-L425 PolarHBondContact O-N 3.06Å
424	S	31.4	Very low	35.5	Very low	117 Å²	117	136.2 Å²	136.2	82%	0.818	79%	0.787	S	S	*	*			trans	-69	82.7	166.4	60.9	0	0	0	0	108.5	T422 M426	T422-S424 PolarHBondContact O-N 2.87Å; S424-M426 PolarHBondContact O-N 3.41Å
425	L	32	Very low	34.4	Very low	154 Å²	154	137.7 Å²	137.7	81%	0.806	80%	0.796	S	S	*	*			trans	-78.4	66.2	169.4	-169.7	102.9	0	0	0	109.2	T423	T423-L425 PolarHBondContact O-N 3.06Å
426	M	31.7	Very low	33.5	Very low	170 Å²	170	134.8 Å²	134.8	84%	0.837	79%	0.79	S	S	*	*			trans	-145	65.3	171.5	-75.2	-71.4	153.4	0	0	108.6	S424	S424-M426 PolarHBondContact O-N 3.41Å
427	D	31.3	Very low	33.3	Very low	160 Å²	160	139.4 Å²	139.4	86%	0.856	82%	0.819	S	S	*	*			trans	-168.6	56.3	160.2	-101.8	-23.7	0	0	0	112.2
428	V	34.9	Very low	32.9	Very low	146 Å²	146	142 Å²	142	89%	0.885	83%	0.829	S	S	*	*			trans	-145	70.5	155.3	-167.8	0	0	0	0	108.8
429	K	27.8	Very low	32.6	Very low	219 Å²	219	142.4 Å²	142.4	95%	0.952	83%	0.83	S	S	*	*			trans	-132.6	58.4	163.4	-122.5	-176.7	-174	-179.7	0	108.9
430	A	31.1	Very low	32.5	Very low	77 Å²	77	144 Å²	144	64%	0.636	83%	0.833	S	S	*	*	S	Bend	trans	-145	120	166.9	0	0	0	0	0	109.8
431	T	29.6	Very low	32.5	Very low	139 Å²	139	146.2 Å²	146.2	85%	0.853	84%	0.844	S	S	*	*			trans	68.7	93.6	152.8	60	0	0	0	0	119.6
432	A	36.8	Very low	32.6	Very low	101 Å²	101	144.8 Å²	144.8	84%	0.835	84%	0.84	S	S	*	*				-145.7	82	128.5	0	0	0	0	0	109.1
433	K	28.6	Very low	32.6	Very low	190 Å²	190	146 Å²	146	83%	0.826	84%	0.844	S	S	*	*			trans	-66	156.1	139.6	-83.5	178.4	171.2	178.6	0	107.4
434	D	33.9	Very low	32.5	Very low	151 Å²	151	147.1 Å²	147.1	81%	0.807	85%	0.848	S	S	*	*			trans	97	125.7	-179.9	-54.1	-23	0	0	0	112.1
435	V	33.4	Very low	32.6	Very low	121 Å²	121	149.5 Å²	149.5	73%	0.733	85%	0.85	S	S	*	*			cis	-171.2	151.1	15.7	113.3	0	0	0	0	109.2
436	S	32.9	Very low	32.7	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	85%	0.854	S	S	*	*			trans	64.4	131.5	157.1	-65.2	0	0	0	0	119.5
437	T	40	Very low	32.8	Very low	211 Å²	211	147.2 Å²	147.2	100%	1.294	86%	0.855	S	S	*	*			cis	-151.6	0	37	-38	0	0	0	0	110.6

Retrieved 437 of 437 residues in 100 ms (Link to these results)

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