A0A087Y1P7_POEFO Loading...

Eukaryotic elongation factor 2 kinase

AlphaFold DB , UniProt , Accession A0A087Y1P7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 775 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	33	Very low	28.3	Very low	235 Å²	235	160 Å²	160	100%	1.158	81%	0.809	S	S	*	*				0	81.8	0	-103.4	-169.5	176.4	0	0	104.1
2	D	31.7	Very low	28	Very low	144 Å²	144	160.2 Å²	160.2	77%	0.77	81%	0.805	S	S	*	*			trans	-94.9	164.9	-172.9	-49	-98.5	0	0	0	105.6
3	D	33	Very low	27.7	Very low	151 Å²	151	151.7 Å²	151.7	81%	0.807	78%	0.783	S	S	*	*			trans	149.2	88.7	145.9	-73.9	-2.7	0	0	0	105
4	D	32.8	Very low	27.4	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	78%	0.782	S	S	*	*				75.8	140.6	70.6	-161.5	22.9	0	0	0	111.6
5	L	28.2	Very low	27.2	Very low	146 Å²	146	144.5 Å²	144.5	76%	0.764	78%	0.776	S	S	*	*			trans	172.9	89.8	157.6	-100.4	175.3	0	0	0	110.3	F7	L5-F7 HydrophobicContact CD2-CD2 4.21Å; L5-F7 HydrophobicContact CD2-CE2 3.73Å
6	M	27.9	Very low	27.1	Very low	166 Å²	166	147.6 Å²	147.6	82%	0.818	79%	0.785	S	S	*	*			trans	-76.4	151.1	160	-70.3	-127.7	-63.4	0	0	111.4
7	F	22.8	Very low	26.9	Very low	193 Å²	193	152.9 Å²	152.9	85%	0.846	79%	0.791	S	S	*	*			trans	-146.4	122.5	159	-93.7	-70.5	0	0	0	111.8	L5	L5-F7 HydrophobicContact CD2-CD2 4.21Å; L5-F7 HydrophobicContact CD2-CE2 3.73Å
8	S	26.8	Very low	27.3	Very low	91 Å²	91	150.4 Å²	150.4	64%	0.636	79%	0.786	S	S	*	*			trans	-106.2	173.1	163.4	63.6	0	0	0	0	110.1	E10	S8-E10 WeakPolarHBondContact CB-OE2 3.33Å
9	M	24.1	Very low	27.2	Very low	178 Å²	178	148.4 Å²	148.4	88%	0.877	79%	0.786	S	S	*	*			trans	-162.7	128	176.2	-125.6	-167.7	76.3	0	0	114.4
10	E	23.9	Very low	27.2	Very low	149 Å²	149	146.3 Å²	146.3	70%	0.696	79%	0.79	S	S	*	*			trans	-149.2	159.6	-178.3	-47.1	77.8	44.7	0	0	110.3	S8	S8-E10 WeakPolarHBondContact CB-OE2 3.33Å
11	E	26.8	Very low	27.2	Very low	169 Å²	169	147.4 Å²	147.4	79%	0.79	79%	0.79	S	S	*	*			cis	-112.2	-140.1	-13.3	-144.2	-157.8	117.6	0	0	108.9
12	E	24.6	Very low	26.8	Very low	162 Å²	162	146.6 Å²	146.6	76%	0.757	78%	0.775	S	S	*	*			cis	-143.6	175.2	1.8	-137.8	-140.7	117.9	0	0	106.5
13	G	24.9	Very low	26.5	Very low	50 Å²	50	147.3 Å²	147.3	52%	0.515	78%	0.779	S	S	.	*			cis	169.6	161.4	5.4	0	0	0	0	0	114.7
14	S	23.7	Very low	26.1	Very low	111 Å²	111	145 Å²	145	78%	0.776	77%	0.774	S	S	*	*			trans	52	115.4	156.4	-155	0	0	0	0	121.7
15	A	24.1	Very low	25.8	Very low	84 Å²	84	146.7 Å²	146.7	69%	0.694	78%	0.781	S	S	*	*				155.3	126.2	106.5	0	0	0	0	0	117.2
16	Q	25.1	Very low	25.8	Very low	195 Å²	195	148.8 Å²	148.8	91%	0.911	78%	0.784	S	S	*	*			trans	74.4	140.9	148	-63.4	-178.6	7.7	0	0	123.1
17	R	23.5	Very low	25.8	Very low	238 Å²	238	150 Å²	150	90%	0.898	79%	0.787	S	S	*	*			trans	-106.3	-170.9	169.4	-53.2	174.6	167.2	174.8	-5.2	108.5
18	P	34.4	Very low	25.9	Very low	107 Å²	107	152.2 Å²	152.2	70%	0.695	79%	0.79	S	S	*	*			cis	-141.5	173	-2.8	41.3	-21.9	0	0	0	117.8
19	S	26.4	Very low	26	Very low	113 Å²	113	151.9 Å²	151.9	79%	0.79	79%	0.793	S	S	*	*			trans	50.5	129.6	141.9	66	0	0	0	0	123.4
20	A	25.8	Very low	26.1	Very low	105 Å²	105	152.4 Å²	152.4	87%	0.868	79%	0.793	S	S	*	*			trans	-145.1	154.3	149	0	0	0	0	0	111.1
21	Q	27	Very low	26.2	Very low	170 Å²	170	150.5 Å²	150.5	79%	0.794	80%	0.796	S	S	*	*			trans	-111.9	164	-179.1	-74.4	-173.2	-25.4	0	0	112.6
22	R	25.5	Very low	26.4	Very low	218 Å²	218	150 Å²	150	82%	0.823	80%	0.798	S	S	*	*			trans	61.2	124.7	154.1	-76.8	173.4	169.8	173	-2.8	118.2
23	N	25.1	Very low	26.7	Very low	160 Å²	160	146.1 Å²	146.1	86%	0.856	79%	0.789	S	S	*	*				-163	156.7	92.2	-99.9	-36.1	0	0	0	113.1
24	S	25.2	Very low	26.9	Very low	101 Å²	101	151 Å²	151	71%	0.706	80%	0.803	S	S	*	*			trans	-104.6	152.5	176.6	53	0	0	0	0	111.6
25	I	27.2	Very low	27.3	Very low	174 Å²	174	149.6 Å²	149.6	89%	0.892	80%	0.798	S	S	*	*			trans	-126.3	149.5	169.1	-64.2	-176.5	0	0	0	108.4
26	K	27.5	Very low	27.6	Very low	190 Å²	190	153.2 Å²	153.2	83%	0.826	81%	0.806	S	S	*	*			trans	-103.8	161.4	-157.9	-64.7	177.5	176.9	179.1	0	114.2
27	H	28.2	Very low	27.9	Very low	192 Å²	192	147.4 Å²	147.4	89%	0.889	79%	0.792	S	S	*	*			trans	-48.5	158.9	164.5	-56.3	-98.7	0	0	0	113.9
28	R	25.1	Very low	28.1	Very low	239 Å²	239	141 Å²	141	90%	0.902	78%	0.783	S	S	*	*			trans	-139.9	137.7	137.6	-155.3	172.6	-168.6	167.6	3.5	110
29	A	27.7	Very low	28	Very low	85 Å²	85	142.4 Å²	142.4	70%	0.702	79%	0.785	S	S	*	*			trans	-108.1	169.1	178	0	0	0	0	0	111
30	H	25.6	Very low	28.3	Very low	188 Å²	188	144.8 Å²	144.8	87%	0.87	79%	0.789	S	S	*	*			trans	-130.5	145.6	161.8	-89.9	-88.5	0	0	0	109.6
31	S	27.6	Very low	28.8	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	79%	0.785	S	S	*	*			trans	-151.8	139.8	-176.9	176.3	0	0	0	0	109.7
32	L	29.5	Very low	29.1	Very low	159 Å²	159	147.4 Å²	147.4	83%	0.832	79%	0.788	S	S	*	*			trans	-153.5	121.9	161.7	-68.3	-178.6	0	0	0	104.6
33	S	30.7	Very low	29.4	Very low	80 Å²	80	144.4 Å²	144.4	56%	0.559	79%	0.788	S	S	*	*				67.5	130.6	59.4	77.8	0	0	0	0	112.8
34	D	29.8	Very low	29.7	Very low	153 Å²	153	145 Å²	145	82%	0.818	79%	0.786	S	S	*	*			cis	-167.3	163.6	3.5	-112.6	-23.2	0	0	0	111.4
35	A	32.1	Very low	29.9	Very low	81 Å²	81	148.4 Å²	148.4	67%	0.669	79%	0.791	S	S	*	*			trans	60.7	157.4	150.1	0	0	0	0	0	119.8
36	N	31	Very low	29.8	Very low	159 Å²	159	147.1 Å²	147.1	85%	0.85	78%	0.78	S	S	*	*			cis	-167.1	168	-13.7	-105.3	15.7	0	0	0	106.5
37	A	31	Very low	29.6	Very low	74 Å²	74	147.5 Å²	147.5	61%	0.612	78%	0.782	S	S	*	*			cis	-175.7	-167.6	-21.3	0	0	0	0	0	107.8
38	S	28.2	Very low	29.5	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	78%	0.776	S	S	*	*			trans	73.5	144.4	168.9	69.6	0	0	0	0	120.4
39	D	32.5	Very low	29.5	Very low	137 Å²	137	138.9 Å²	138.9	73%	0.733	77%	0.767	S	S	*	*			cis	-172.3	146.6	-35.2	-93.8	-20.7	0	0	0	106.8
40	D	32.8	Very low	29.4	Very low	163 Å²	163	140.9 Å²	140.9	87%	0.872	77%	0.773	S	S	*	*			trans	161.6	126.9	140.4	-88.8	-12.7	0	0	0	109.1
41	D	35.1	Very low	29.5	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	77%	0.769	S	S	*	*			trans	-95.6	162.9	-168.6	-55.6	-75.8	0	0	0	113.6
42	E	33.3	Very low	29.6	Very low	180 Å²	180	142 Å²	142	84%	0.841	77%	0.774	S	S	*	*				-176.2	148.1	104.3	-96.2	179.3	168.9	0	0	113.1
43	D	32.6	Very low	29.6	Very low	155 Å²	155	140.3 Å²	140.3	83%	0.829	78%	0.775	S	S	*	*			trans	68.2	114.9	165.1	-63.6	-12.8	0	0	0	122.8
44	E	31.2	Very low	29.5	Very low	173 Å²	173	140.7 Å²	140.7	81%	0.808	77%	0.77	S	S	*	*			trans	-81.3	178.5	165.2	-43.1	-176	103.7	0	0	110.4
45	E	28.9	Very low	29.6	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	76%	0.762	S	S	*	*				-159.5	123.6	52.9	-163.2	-178.2	-175.6	0	0	113.4
46	H	25.2	Very low	29.6	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.676	76%	0.76	S	S	*	*			trans	35.3	114.1	151.6	-61.9	82.9	0	0	0	122.3
47	F	24.5	Very low	29.7	Very low	198 Å²	198	136 Å²	136	87%	0.868	75%	0.746	S	S	*	*			trans	-140.9	138.6	135.6	-148.9	-92.2	0	0	0	111.9
48	I	24.8	Very low	29.8	Very low	148 Å²	148	139.2 Å²	139.2	76%	0.759	75%	0.748	S	S	*	*			trans	-85.6	114.3	-179.1	-62.4	174.2	0	0	0	109.4
49	S	25.8	Very low	30.2	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-87.2	125.6	175.2	-63.5	0	0	0	0	111.7
50	P	25.4	Very low	30.2	Very low	126 Å²	126	135.3 Å²	135.3	82%	0.818	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-66	143.3	170.7	-20.3	33.3	0	0	0	112.3
51	I	28.3	Very low	30.1	Very low	155 Å²	155	131.8 Å²	131.8	80%	0.795	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-79	158	172.2	-59	168.1	0	0	0	109
52	L	28.1	Very low	30.2	Very low	167 Å²	167	132.5 Å²	132.5	87%	0.874	70%	0.7	S	S	*	*			trans	94.2	86.6	171.8	-52.2	176.1	0	0	0	117.4
53	C	29.9	Very low	30.3	Very low	124 Å²	124	128.3 Å²	128.3	84%	0.838	68%	0.683	S	S	*	*			trans	-161.2	80.2	147.6	-162.2	0	0	0	0	112.9
54	D	28.1	Very low	30.2	Very low	88 Å²	88	127 Å²	127	47%	0.471	67%	0.67	S	S	.	*			trans	-150.1	1	173.2	-114.9	-32.6	0	0	0	117.7	A56 K57 E58	D54-A56 VanDerWaalsContact C-N 3.26Å; D54-A56 PolarHBondContact O-N 2.91Å; D54-A56 VanDerWaalsContact O-N 3.12Å; D54-K57 PolarHBondContact O-N 3.46Å; D54-K57 WeakPolarHBondContact OD1-CD 3.38Å; D54-K57 WeakPolarHBondContact OD1-CE 3.43Å; D54-K57 IonicContact OD1-NZ 3.7Å; D54-K57 PolarHBondContact OD1-NZ 2.83Å; D54-K57 IonicContact OD2-NZ 2.82Å; D54-E58 PolarHBondContact O-N 2.92Å
55	S	33	Very low	30.2	Very low	93 Å²	93	124.1 Å²	124.1	65%	0.65	66%	0.661	S	S	*	*	H	α-helix	trans	-57.7	-32.2	-175.2	53.8	0	0	0	0	114.6	K57 E58 V59	S55-K57 PolarHBondContact O-N 3.46Å; S55-E58 PolarHBondContact O-N 3.03Å; S55-V59 WeakPolarHBondContact O-CG2 3.4Å; S55-V59 PolarHBondContact O-N 3.42Å
56	A	32.6	Very low	30.6	Very low	75 Å²	75	119.3 Å²	119.3	62%	0.62	64%	0.64	S	S	*	*	H	α-helix	trans	-66.9	-33.1	178.8	0	0	0	0	0	113.3	D54 C60	D54-A56 VanDerWaalsContact C-N 3.26Å; D54-A56 PolarHBondContact O-N 2.91Å; D54-A56 VanDerWaalsContact O-N 3.12Å; A56-C60 PolarHBondContact O-N 3.5Å; A56-C60 PolarHBondContact O-SG 3Å
57	K	32.8	Very low	31.2	Very low	127 Å²	127	116.3 Å²	116.3	55%	0.552	63%	0.632	S	S	*	*	H	α-helix	trans	-76.7	-37.9	178.5	-61.7	-165.9	-159.2	105.9	0	111.4	D54 S55 C60 N61	D54-K57 PolarHBondContact O-N 3.46Å; D54-K57 WeakPolarHBondContact OD1-CD 3.38Å; D54-K57 WeakPolarHBondContact OD1-CE 3.43Å; D54-K57 IonicContact OD1-NZ 3.7Å; D54-K57 PolarHBondContact OD1-NZ 2.83Å; D54-K57 IonicContact OD2-NZ 2.82Å; S55-K57 PolarHBondContact O-N 3.46Å; K57-C60 PolarHBondContact O-N 3.13Å; K57-N61 WeakPolarHBondContact O-CB 3.03Å; K57-N61 VanDerWaalsContact O-CG 3.27Å; K57-N61 PolarHBondContact O-N 2.92Å; K57-N61 PolarHBondContact O-ND2 3.11Å
58	E	32.5	Very low	31.5	Very low	141 Å²	141	115.6 Å²	115.6	66%	0.659	62%	0.624	S	S	*	*	H	α-helix	trans	-64.6	-41.5	178.1	-65.8	-168.5	136.5	0	0	111.8	D54 S55 N61 Y62	D54-E58 PolarHBondContact O-N 2.92Å; S55-E58 PolarHBondContact O-N 3.03Å; E58-N61 PolarHBondContact O-N 3.31Å; E58-Y62 VanDerWaalsContact O-CB 3.29Å; E58-Y62 WeakPolarHBondContact O-CB 3.15Å; E58-Y62 PolarHBondContact O-N 3.48Å
59	V	36.5	Very low	31.9	Very low	88 Å²	88	114.2 Å²	114.2	53%	0.533	62%	0.623	S	S	.	*	H	α-helix	trans	-61.3	-46.4	172.9	173.8	0	0	0	0	111.4	S55 N61 Y62 L63	S55-V59 WeakPolarHBondContact O-CG2 3.4Å; S55-V59 PolarHBondContact O-N 3.42Å; V59-N61 VanDerWaalsContact C-N 3.29Å; V59-N61 PolarHBondContact O-N 3.27Å; V59-Y62 PolarHBondContact O-N 3.09Å; V59-L63 HydrophobicContact CG1-CD1 3.98Å; V59-L63 WeakPolarHBondContact O-CB 3.4Å; V59-L63 VanDerWaalsContact O-CG 3.3Å; V59-L63 WeakPolarHBondContact O-CG 3Å; V59-L63 PolarHBondContact O-N 3Å
60	C	31.8	Very low	32.4	Very low	69 Å²	69	117.3 Å²	117.3	47%	0.466	62%	0.619	S	S	.	*	H	α-helix	trans	-62.9	-32.6	176.5	-73.6	0	0	0	0	113.5	A56 K57 K64	A56-C60 PolarHBondContact O-N 3.5Å; A56-C60 PolarHBondContact O-SG 3Å; K57-C60 PolarHBondContact O-N 3.13Å; C60-K64 WeakPolarHBondContact O-CB 3.06Å; C60-K64 WeakPolarHBondContact O-CD 3.44Å; C60-K64 WeakPolarHBondContact O-CG 3.35Å; C60-K64 PolarHBondContact O-N 2.87Å
61	N	32	Very low	32.5	Very low	89 Å²	89	119.6 Å²	119.6	48%	0.476	62%	0.619	S	S	.	*	H	α-helix	trans	-81	-37.7	178.7	-70.7	-16.7	0	0	0	112.1	K57 E58 V59 L63 K64 D65	K57-N61 WeakPolarHBondContact O-CB 3.03Å; K57-N61 VanDerWaalsContact O-CG 3.27Å; K57-N61 PolarHBondContact O-N 2.92Å; K57-N61 PolarHBondContact O-ND2 3.11Å; E58-N61 PolarHBondContact O-N 3.31Å; V59-N61 VanDerWaalsContact C-N 3.29Å; V59-N61 PolarHBondContact O-N 3.27Å; N61-L63 PolarHBondContact O-N 2.89Å; N61-K64 PolarHBondContact O-N 2.92Å; N61-D65 PolarHBondContact O-N 2.98Å
62	Y	35.9	Very low	32.7	Very low	164 Å²	164	118.9 Å²	118.9	64%	0.643	62%	0.616	S	S	*	*	H	α-helix	trans	-58.7	-46.2	171.6	178.5	-100.8	0	0	0	111.3	E58 V59 K64 D65 L66	E58-Y62 VanDerWaalsContact O-CB 3.29Å; E58-Y62 WeakPolarHBondContact O-CB 3.15Å; E58-Y62 PolarHBondContact O-N 3.48Å; V59-Y62 PolarHBondContact O-N 3.09Å; Y62-K64 PolarHBondContact O-N 3.34Å; Y62-D65 PolarHBondContact O-N 3.2Å; Y62-L66 HydrophobicContact CD1-CD1 4.28Å; Y62-L66 HydrophobicContact CE1-CD1 3.63Å; Y62-L66 WeakPolarHBondContact O-CB 3.5Å; Y62-L66 PolarHBondContact O-N 3.09Å
63	L	36	Very low	32.7	Very low	92 Å²	92	115.6 Å²	115.6	48%	0.482	61%	0.607	S	S	.	*	H	α-helix	trans	-62.7	-40.9	174.6	-69.4	170.2	0	0	0	111.9	V59 N61 L66 V67	V59-L63 HydrophobicContact CG1-CD1 3.98Å; V59-L63 WeakPolarHBondContact O-CB 3.4Å; V59-L63 VanDerWaalsContact O-CG 3.3Å; V59-L63 WeakPolarHBondContact O-CG 3Å; V59-L63 PolarHBondContact O-N 3Å; N61-L63 PolarHBondContact O-N 2.89Å; L63-L66 PolarHBondContact O-N 2.72Å; L63-V67 WeakPolarHBondContact O-CG2 3.38Å; L63-V67 PolarHBondContact O-N 3.03Å; L63-V67 VanDerWaalsContact O-N 3.09Å
64	K	31.8	Very low	32.7	Very low	127 Å²	127	117.6 Å²	117.6	55%	0.552	61%	0.609	S	S	*	*	H	α-helix	trans	-63.2	-42.1	175	-78.5	168.4	-175.3	171.4	0	113.1	C60 N61 Y62 L66 V67 Y68	C60-K64 WeakPolarHBondContact O-CB 3.06Å; C60-K64 WeakPolarHBondContact O-CD 3.44Å; C60-K64 WeakPolarHBondContact O-CG 3.35Å; C60-K64 PolarHBondContact O-N 2.87Å; N61-K64 PolarHBondContact O-N 2.92Å; Y62-K64 PolarHBondContact O-N 3.34Å; K64-L66 VanDerWaalsContact C-N 3.32Å; K64-L66 PolarHBondContact O-N 2.96Å; K64-V67 CarbonylContact O-C 3.42Å; K64-V67 PolarHBondContact O-N 3.34Å; K64-Y68 WeakPolarHBondContact O-CB 3.33Å; K64-Y68 PolarHBondContact O-N 2.83Å
65	D	31.3	Very low	32.7	Very low	114 Å²	114	116 Å²	116	61%	0.61	61%	0.605	S	S	*	*	H	α-helix	trans	-68.2	-33	177.5	-94.8	7.6	0	0	0	112.1	N61 Y62 V67 Y68 T69	N61-D65 PolarHBondContact O-N 2.98Å; Y62-D65 PolarHBondContact O-N 3.2Å; D65-V67 VanDerWaalsContact C-N 3.29Å; D65-V67 PolarHBondContact O-N 2.78Å; D65-Y68 PolarHBondContact O-N 2.81Å; D65-T69 WeakPolarHBondContact O-CB 3.48Å; D65-T69 PolarHBondContact O-N 2.97Å; D65-T69 PolarHBondContact O-OG1 2.82Å
66	L	35.8	Very low	32.7	Very low	71 Å²	71	119.2 Å²	119.2	37%	0.372	61%	0.614	S	S	.	*	H	α-helix	trans	-65.5	-32.3	172.5	-127.8	143.9	0	0	0	112.2	Y62 L63 K64 R70	Y62-L66 HydrophobicContact CD1-CD1 4.28Å; Y62-L66 HydrophobicContact CE1-CD1 3.63Å; Y62-L66 WeakPolarHBondContact O-CB 3.5Å; Y62-L66 PolarHBondContact O-N 3.09Å; L63-L66 PolarHBondContact O-N 2.72Å; K64-L66 VanDerWaalsContact C-N 3.32Å; K64-L66 PolarHBondContact O-N 2.96Å; L66-R70 WeakPolarHBondContact O-CB 3.47Å; L66-R70 PolarHBondContact O-N 3.22Å
67	V	37.3	Very low	32.5	Very low	83 Å²	83	121.3 Å²	121.3	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-77.3	-41.4	170.6	172.4	0	0	0	0	111.5	L63 K64 D65 T69 R70	L63-V67 WeakPolarHBondContact O-CG2 3.38Å; L63-V67 PolarHBondContact O-N 3.03Å; L63-V67 VanDerWaalsContact O-N 3.09Å; K64-V67 CarbonylContact O-C 3.42Å; K64-V67 PolarHBondContact O-N 3.34Å; D65-V67 VanDerWaalsContact C-N 3.29Å; D65-V67 PolarHBondContact O-N 2.78Å; V67-T69 PolarHBondContact O-N 2.84Å; V67-R70 CarbonylContact O-C 3.22Å; V67-R70 WeakPolarHBondContact O-CA 3.42Å; V67-R70 PolarHBondContact O-N 2.86Å
68	Y	31.6	Very low	32.3	Very low	183 Å²	183	123.3 Å²	123.3	72%	0.718	63%	0.63	S	S	*	*	H	α-helix	trans	-70.1	-33.9	-177.7	-125.8	-87.8	0	0	0	113	K64 D65 R70	K64-Y68 WeakPolarHBondContact O-CB 3.33Å; K64-Y68 PolarHBondContact O-N 2.83Å; D65-Y68 PolarHBondContact O-N 2.81Å; Y68-R70 VanDerWaalsContact C-N 3.27Å
69	T	33	Very low	32.1	Very low	119 Å²	119	121 Å²	121	73%	0.73	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-12.1	170.5	53.3	0	0	0	0	113.3	D65 V67	D65-T69 WeakPolarHBondContact O-CB 3.48Å; D65-T69 PolarHBondContact O-N 2.97Å; D65-T69 PolarHBondContact O-OG1 2.82Å; V67-T69 PolarHBondContact O-N 2.84Å
70	R	37.6	Very low	31.5	Very low	169 Å²	169	123.8 Å²	123.8	64%	0.638	64%	0.641	S	S	*	*			trans	-116.2	73.8	169.8	-69.8	-172.7	175.1	-172.5	2.8	111.3	L66 V67 Y68 L72	L66-R70 WeakPolarHBondContact O-CB 3.47Å; L66-R70 PolarHBondContact O-N 3.22Å; V67-R70 CarbonylContact O-C 3.22Å; V67-R70 WeakPolarHBondContact O-CA 3.42Å; V67-R70 PolarHBondContact O-N 2.86Å; Y68-R70 VanDerWaalsContact C-N 3.27Å; R70-L72 PolarHBondContact O-N 2.84Å
71	Q	26.9	Very low	31.3	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	66%	0.658	S	S	*	*			trans	-60.2	87.6	156.1	-74.1	-168.5	-10.5	0	0	109.6	S73	Q71-S73 PolarHBondContact O-N 3.02Å; Q71-S73 VanDerWaalsContact O-N 3.1Å
72	L	33	Very low	30.9	Very low	140 Å²	140	133.1 Å²	133.1	73%	0.733	68%	0.677	S	S	*	*			trans	-58.6	113.1	169.7	-76	169.2	0	0	0	107.6	R70 N74	R70-L72 PolarHBondContact O-N 2.84Å; L72-N74 VanDerWaalsContact C-N 3.31Å; L72-N74 PolarHBondContact O-N 3.07Å
73	S	27.3	Very low	30.3	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	68%	0.683	S	S	*	*			trans	-72.1	89.9	178.2	44.2	0	0	0	0	109.4	Q71 S75	Q71-S73 PolarHBondContact O-N 3.02Å; Q71-S73 VanDerWaalsContact O-N 3.1Å; S73-S75 PolarHBondContact O-N 2.8Å
74	N	30.8	Very low	29.8	Very low	167 Å²	167	139.6 Å²	139.6	89%	0.893	70%	0.696	S	S	*	*			trans	-65	28.6	168.1	-72.5	-14.2	0	0	0	113.1	L72	L72-N74 VanDerWaalsContact C-N 3.31Å; L72-N74 PolarHBondContact O-N 3.07Å
75	S	26.3	Very low	29.6	Very low	55 Å²	55	140.4 Å²	140.4	39%	0.385	70%	0.701	S	S	.	*	S	Bend	trans	-123	124.5	171.6	63	0	0	0	0	109.1	S73	S73-S75 PolarHBondContact O-N 2.8Å
76	L	34.8	Very low	29.4	Very low	159 Å²	159	141.8 Å²	141.8	83%	0.832	70%	0.704	S	S	*	*			trans	-40.1	141.1	149.6	-71.4	161.6	0	0	0	109.4	K78	L76-K78 PolarHBondContact O-N 2.77Å
77	P	26.6	Very low	29.2	Very low	120 Å²	120	144.7 Å²	144.7	78%	0.779	72%	0.72	S	S	*	*			trans	-55.4	112.5	-178.6	22.3	-33.2	0	0	0	109.6	S79	P77-S79 PolarHBondContact O-N 2.76Å
78	K	29	Very low	29	Very low	169 Å²	169	149.6 Å²	149.6	74%	0.735	74%	0.737	S	S	*	*			trans	-63.3	92.6	-171.7	-71.9	-176.1	179.6	177.2	0	110.6	L76 N80	L76-K78 PolarHBondContact O-N 2.77Å; K78-N80 PolarHBondContact O-N 3.27Å
79	S	28.3	Very low	29.4	Very low	93 Å²	93	146.1 Å²	146.1	65%	0.65	75%	0.746	S	S	*	*			trans	-74	80.1	174.3	52	0	0	0	0	109.6	P77 F81	P77-S79 PolarHBondContact O-N 2.76Å; S79-F81 PolarHBondContact O-N 3.17Å
80	N	25.3	Very low	29.4	Very low	146 Å²	146	149 Å²	149	78%	0.781	75%	0.751	S	S	*	*			trans	-66.3	67.6	170.7	-79.7	-1.3	0	0	0	110.9	K78 L82	K78-N80 PolarHBondContact O-N 3.27Å; N80-L82 VanDerWaalsContact C-N 3.27Å; N80-L82 PolarHBondContact O-N 3.13Å
81	F	26.1	Very low	29.4	Very low	185 Å²	185	150.4 Å²	150.4	81%	0.811	77%	0.765	S	S	*	*			trans	-73	86.8	164.5	-87.8	-77.8	0	0	0	108.6	S79 Y83	S79-F81 PolarHBondContact O-N 3.17Å; F81-Y83 PolarHBondContact O-N 2.94Å
82	L	24.2	Very low	29.7	Very low	169 Å²	169	153.8 Å²	153.8	89%	0.885	77%	0.77	S	S	*	*			trans	-58.5	102.6	159.2	-88.8	164.3	0	0	0	108.1	N80 R84	N80-L82 VanDerWaalsContact C-N 3.27Å; N80-L82 PolarHBondContact O-N 3.13Å; L82-R84 PolarHBondContact O-N 3.07Å
83	Y	24.3	Very low	29.9	Very low	195 Å²	195	152 Å²	152	77%	0.765	77%	0.77	S	S	*	*			trans	-72.5	92.8	-179.9	-160.5	-82.9	0	0	0	109	F81 H85	F81-Y83 PolarHBondContact O-N 2.94Å; Y83-H85 PolarHBondContact O-N 3.24Å
84	R	25.6	Very low	30.3	Very low	197 Å²	197	158 Å²	158	74%	0.743	78%	0.779	S	S	*	*			trans	-68.3	119.3	173.9	-169.8	-168.9	-91.4	-174.3	-6.6	108.7	L82 E86	L82-R84 PolarHBondContact O-N 3.07Å; R84-E86 WeakPolarHBondContact CD-OE1 3.46Å; R84-E86 HydrophobicContact CG-CG 4.22Å; R84-E86 IonicContact CZ-OE1 3.47Å; R84-E86 IonicContact NE-OE1 2.7Å; R84-E86 IonicContact NH1-OE1 3.65Å; R84-E86 PolarHBondContact NH1-OE1 2.83Å; R84-E86 PolarHBondContact O-N 3.43Å
85	H	25.8	Very low	31.1	Very low	144 Å²	144	156 Å²	156	67%	0.667	77%	0.772	S	S	*	*			trans	-77.1	86.9	-180	-129.4	-64.4	0	0	0	110.1	Y83 N87	Y83-H85 PolarHBondContact O-N 3.24Å; H85-N87 PolarHBondContact CE1-OD1 3.31Å; H85-N87 VanDerWaalsContact CE1-OD1 3.31Å; H85-N87 PolarHBondContact ND1-OD1 2.83Å
86	E	28.1	Very low	32.6	Very low	143 Å²	143	159.7 Å²	159.7	67%	0.668	79%	0.792	S	S	*	*			trans	-98.6	95.1	170.6	-74.5	173.7	-176	0	0	108.4	R84 E88	R84-E86 WeakPolarHBondContact CD-OE1 3.46Å; R84-E86 HydrophobicContact CG-CG 4.22Å; R84-E86 IonicContact CZ-OE1 3.47Å; R84-E86 IonicContact NE-OE1 2.7Å; R84-E86 IonicContact NH1-OE1 3.65Å; R84-E86 PolarHBondContact NH1-OE1 2.83Å; R84-E86 PolarHBondContact O-N 3.43Å; E86-E88 PolarHBondContact O-N 3.06Å
87	N	31.8	Very low	33.7	Very low	131 Å²	131	157.3 Å²	157.3	70%	0.701	78%	0.779	S	S	*	*			trans	-84.5	80.6	179.3	-76.2	-2.9	0	0	0	110.9	H85	H85-N87 PolarHBondContact CE1-OD1 3.31Å; H85-N87 VanDerWaalsContact CE1-OD1 3.31Å; H85-N87 PolarHBondContact ND1-OD1 2.83Å
88	E	31.9	Very low	36.3	Very low	187 Å²	187	155.2 Å²	155.2	87%	0.874	77%	0.767	S	S	*	*			trans	-150.6	143	163.4	-118.6	153.7	-141.3	0	0	111.9	E86 E90	E86-E88 PolarHBondContact O-N 3.06Å; E88-E90 PolarHBondContact O-N 3.44Å
89	A	40.1	Very low	38.8	Very low	110 Å²	110	155.5 Å²	155.5	91%	0.909	77%	0.772	S	S	*	*			trans	-99.3	70.2	-162.6	0	0	0	0	0	112.7
90	E	33.5	Very low	41.4	Very low	179 Å²	179	155.7 Å²	155.7	84%	0.836	77%	0.773	S	S	*	*			trans	-83.7	145.9	174.2	-68.3	-154.8	132.4	0	0	113.7	E88 R92	E88-E90 PolarHBondContact O-N 3.44Å; E90-R92 PolarHBondContact O-N 3.43Å
91	H	37.1	Very low	43.9	Very low	198 Å²	198	150.3 Å²	150.3	92%	0.917	75%	0.749	S	S	*	*			trans	-62.7	99.6	177.3	-86	-86.2	0	0	0	111.7	S93	H91-S93 PolarHBondContact O-N 2.77Å
92	R	33.9	Very low	46.7	Very low	245 Å²	245	149.4 Å²	149.4	93%	0.925	74%	0.74	S	S	*	*			trans	-63.9	103.9	170.8	-74.6	-175.3	173.3	170.7	0.7	110.8	E90	E90-R92 PolarHBondContact O-N 3.43Å
93	S	36.5	Very low	49.8	Very low	103 Å²	103	144 Å²	144	72%	0.72	72%	0.72	S	S	*	*			trans	-62.6	147.7	168.4	57.3	0	0	0	0	110.9	H91 T95	H91-S93 PolarHBondContact O-N 2.77Å; S93-T95 PolarHBondContact O-N 2.72Å
94	Y	37	Very low	52.7	Low	224 Å²	224	137.7 Å²	137.7	88%	0.878	71%	0.708	S	S	*	*			trans	-61.2	126	173.6	-70.5	-91	0	0	0	109.3	V96	Y94-V96 PolarHBondContact O-N 3.2Å
95	T	47.8	Very low	55.7	Low	124 Å²	124	136.3 Å²	136.3	76%	0.761	70%	0.703	S	S	*	*			trans	-64.5	100.6	179.3	52.4	0	0	0	0	110	S93	S93-T95 PolarHBondContact O-N 2.72Å
96	V	56.5	Low	58.8	Low	132 Å²	132	133.2 Å²	133.2	80%	0.8	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-57.1	136.1	179.5	-174.7	0	0	0	0	109.5	Y94 S98	Y94-V96 PolarHBondContact O-N 3.2Å; V96-S98 PolarHBondContact O-N 3.12Å
97	I	57.7	Low	61.7	Low	110 Å²	110	132.9 Å²	132.9	56%	0.564	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-55.4	125	171	-65.9	167.3	0	0	0	107.6	A101 R102	I97-A101 HydrophobicContact CG2-CB 3.62Å; I97-R102 HydrophobicContact CG2-CB 4.33Å
98	S	80.8	Confident	64.3	Low	75 Å²	75	128.9 Å²	128.9	52%	0.524	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-54.4	145.7	-175.9	66	0	0	0	0	111.1	V96 S100 A101 R102	V96-S98 PolarHBondContact O-N 3.12Å; S98-S100 PolarHBondContact O-N 2.99Å; S98-S100 VanDerWaalsContact O-N 3.13Å; S98-A101 CarbonylContact O-C 3.57Å; S98-A101 WeakPolarHBondContact O-CA 3.34Å; S98-A101 PolarHBondContact O-N 2.9Å; S98-A101 WeakPolarHBondContact OG-CB 3.38Å; S98-A101 PolarHBondContact OG-N 2.94Å; S98-R102 PolarHBondContact O-N 2.88Å
99	E	82.3	Confident	66.9	Low	176 Å²	176	124.1 Å²	124.1	82%	0.822	65%	0.651	S	S	*	*	H	α-helix	trans	-56.5	-36.6	-174	-60.9	-175.3	138.8	0	0	112.1	R102 A103	E99-R102 PolarHBondContact O-N 2.99Å; E99-A103 VanDerWaalsContact O-CB 3.3Å; E99-A103 WeakPolarHBondContact O-CB 3.36Å; E99-A103 PolarHBondContact O-N 2.69Å
100	S	82.1	Confident	69.3	Low	97 Å²	97	124.4 Å²	124.4	68%	0.678	63%	0.634	S	S	*	*	H	α-helix	trans	-58.1	-48.9	170.8	176	0	0	0	0	112.9	S98 A103 A104	S98-S100 PolarHBondContact O-N 2.99Å; S98-S100 VanDerWaalsContact O-N 3.13Å; S100-A103 PolarHBondContact O-N 2.69Å; S100-A104 WeakPolarHBondContact O-CB 3.47Å; S100-A104 PolarHBondContact O-N 3.43Å
101	A	78.8	Confident	71.8	Confident	33 Å²	33	122.6 Å²	122.6	27%	0.273	62%	0.623	S	S	.	*	H	α-helix	trans	-68.3	-35.9	177.4	0	0	0	0	0	112.1	I97 S98 A104 W105	I97-A101 HydrophobicContact CG2-CB 3.62Å; S98-A101 CarbonylContact O-C 3.57Å; S98-A101 WeakPolarHBondContact O-CA 3.34Å; S98-A101 PolarHBondContact O-N 2.9Å; S98-A101 WeakPolarHBondContact OG-CB 3.38Å; S98-A101 PolarHBondContact OG-N 2.94Å; A101-A104 PolarHBondContact O-N 3.1Å; A101-W105 PolarHBondContact O-N 2.71Å
102	R	84.8	Confident	74	Confident	165 Å²	165	116.6 Å²	116.6	62%	0.623	61%	0.608	S	S	*	*	H	α-helix	trans	-64.7	-43.6	174.1	-173.2	179.9	179.6	-173.5	-0.2	111.4	I97 S98 E99 W105 I106	I97-R102 HydrophobicContact CG2-CB 4.33Å; S98-R102 PolarHBondContact O-N 2.88Å; E99-R102 PolarHBondContact O-N 2.99Å; R102-W105 PolarHBondContact O-N 2.69Å; R102-I106 HydrophobicContact CG-CD1 4.19Å; R102-I106 WeakPolarHBondContact O-CG1 3.12Å; R102-I106 PolarHBondContact O-N 2.69Å
103	A	89.1	Confident	76.3	Confident	57 Å²	57	115.2 Å²	115.2	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-64.8	-38.6	175.4	0	0	0	0	0	112	E99 S100 I106 K107	E99-A103 VanDerWaalsContact O-CB 3.3Å; E99-A103 WeakPolarHBondContact O-CB 3.36Å; E99-A103 PolarHBondContact O-N 2.69Å; S100-A103 PolarHBondContact O-N 2.69Å; A103-I106 PolarHBondContact O-N 3.3Å; A103-K107 WeakPolarHBondContact O-CB 3.13Å; A103-K107 PolarHBondContact O-N 3.15Å
104	A	85.6	Confident	78.6	Confident	61 Å²	61	114.2 Å²	114.2	50%	0.504	60%	0.6	S	S	.	*	H	α-helix	trans	-61.7	-43.6	173.5	0	0	0	0	0	112.1	S100 A101 K107 A108	S100-A104 WeakPolarHBondContact O-CB 3.47Å; S100-A104 PolarHBondContact O-N 3.43Å; A101-A104 PolarHBondContact O-N 3.1Å; A104-K107 PolarHBondContact O-N 3.39Å; A104-A108 WeakPolarHBondContact O-CB 3.4Å; A104-A108 PolarHBondContact O-N 2.79Å
105	W	88.4	Confident	80.8	Confident	169 Å²	169	108.3 Å²	108.3	64%	0.64	58%	0.582	S	S	*	*	H	α-helix	trans	-64.2	-42.9	174.7	-84.5	112.3	0	0	0	113.1	A101 R102 A108 I109	A101-W105 PolarHBondContact O-N 2.71Å; R102-W105 PolarHBondContact O-N 2.69Å; W105-A108 PolarHBondContact O-N 3.02Å; W105-I109 VanDerWaalsContact O-CG1 3.3Å; W105-I109 WeakPolarHBondContact O-CG1 3.44Å; W105-I109 PolarHBondContact O-N 3.28Å
106	I	90.2	Very high	82.7	Confident	78 Å²	78	107.2 Å²	107.2	40%	0.4	58%	0.577	S	S	.	*	H	α-helix	trans	-58.8	-50.6	175.2	-70	164.7	0	0	0	110	R102 A103 A108 I109 E110	R102-I106 HydrophobicContact CG-CD1 4.19Å; R102-I106 WeakPolarHBondContact O-CG1 3.12Å; R102-I106 PolarHBondContact O-N 2.69Å; A103-I106 PolarHBondContact O-N 3.3Å; I106-A108 VanDerWaalsContact C-N 3.27Å; I106-A108 PolarHBondContact O-N 2.99Å; I106-I109 PolarHBondContact O-N 2.87Å; I106-I109 VanDerWaalsContact O-N 3.1Å; I106-E110 HydrophobicContact CG2-CG 4.31Å; I106-E110 WeakPolarHBondContact CG2-OE1 3.29Å; I106-E110 WeakPolarHBondContact O-CG 3.33Å; I106-E110 PolarHBondContact O-N 3.44Å
107	K	89.8	Confident	84.2	Confident	136 Å²	136	103 Å²	103	59%	0.591	55%	0.55	S	S	*	*	H	α-helix	trans	-62.2	-30.5	178.4	-171.7	170.9	-175.8	171.6	0	113.4	A103 A104 K111	A103-K107 WeakPolarHBondContact O-CB 3.13Å; A103-K107 PolarHBondContact O-N 3.15Å; A104-K107 PolarHBondContact O-N 3.39Å; K107-K111 WeakPolarHBondContact O-CB 3.37Å; K107-K111 WeakPolarHBondContact O-CG 3.24Å; K107-K111 PolarHBondContact O-N 3.31Å; K107-K111 VanDerWaalsContact O-N 3.16Å
108	A	86	Confident	85.8	Confident	47 Å²	47	100 Å²	100	39%	0.388	54%	0.538	S	S	.	.	H	α-helix	trans	-71.2	-43.1	173.3	0	0	0	0	0	111.8	A104 W105 I106 K111 A112	A104-A108 WeakPolarHBondContact O-CB 3.4Å; A104-A108 PolarHBondContact O-N 2.79Å; W105-A108 PolarHBondContact O-N 3.02Å; I106-A108 VanDerWaalsContact C-N 3.27Å; I106-A108 PolarHBondContact O-N 2.99Å; A108-K111 PolarHBondContact O-N 3.26Å; A108-A112 WeakPolarHBondContact O-CB 3.47Å; A108-A112 PolarHBondContact O-N 3.18Å
109	I	87.6	Confident	86.3	Confident	87 Å²	87	96.9 Å²	96.9	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-41.6	176.8	-67	162.8	0	0	0	111.1	W105 I106 A112 R113	W105-I109 VanDerWaalsContact O-CG1 3.3Å; W105-I109 WeakPolarHBondContact O-CG1 3.44Å; W105-I109 PolarHBondContact O-N 3.28Å; I106-I109 PolarHBondContact O-N 2.87Å; I106-I109 VanDerWaalsContact O-N 3.1Å; I109-A112 PolarHBondContact O-N 3.44Å; I109-R113 HydrophobicContact CG2-CG 4.48Å; I109-R113 WeakPolarHBondContact O-CB 3.24Å; I109-R113 WeakPolarHBondContact O-CG 3.32Å; I109-R113 PolarHBondContact O-N 3.05Å
110	E	89.9	Confident	86.8	Confident	116 Å²	116	90.5 Å²	90.5	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-59.6	-46.4	174.6	-73.2	168.7	167.1	0	0	111.4	I106 R113 A114	I106-E110 HydrophobicContact CG2-CG 4.31Å; I106-E110 WeakPolarHBondContact CG2-OE1 3.29Å; I106-E110 WeakPolarHBondContact O-CG 3.33Å; I106-E110 PolarHBondContact O-N 3.44Å; E110-R113 PolarHBondContact O-N 3.02Å; E110-A114 WeakPolarHBondContact O-CB 3.18Å; E110-A114 PolarHBondContact O-N 2.8Å; E110-A114 VanDerWaalsContact O-N 3.1Å
111	K	86.7	Confident	87.3	Confident	142 Å²	142	92.6 Å²	92.6	62%	0.617	49%	0.491	S	S	*	.	H	α-helix	trans	-60.2	-49.9	172.8	-81.7	-172.3	166.6	-156.1	0	112.3	K107 A108 R113 A114 M115	K107-K111 WeakPolarHBondContact O-CB 3.37Å; K107-K111 WeakPolarHBondContact O-CG 3.24Å; K107-K111 PolarHBondContact O-N 3.31Å; K107-K111 VanDerWaalsContact O-N 3.16Å; A108-K111 PolarHBondContact O-N 3.26Å; K111-R113 PolarHBondContact O-N 2.6Å; K111-A114 PolarHBondContact O-N 3.13Å; K111-M115 WeakPolarHBondContact O-CG 3.42Å; K111-M115 PolarHBondContact O-N 3.16Å
112	A	82.4	Confident	88	Confident	72 Å²	72	94.5 Å²	94.5	60%	0.595	49%	0.493	S	S	*	.	H	α-helix	trans	-61.4	-31.9	-178.7	0	0	0	0	0	112.8	A108 I109	A108-A112 WeakPolarHBondContact O-CB 3.47Å; A108-A112 PolarHBondContact O-N 3.18Å; I109-A112 PolarHBondContact O-N 3.44Å
113	R	81.6	Confident	88.4	Confident	215 Å²	215	91.5 Å²	91.5	81%	0.811	49%	0.486	S	S	*	.	H	α-helix	trans	-76.7	-21.6	173	-74.1	177.6	171.5	-147.9	-3.8	114.3	I109 E110 K111	I109-R113 HydrophobicContact CG2-CG 4.48Å; I109-R113 WeakPolarHBondContact O-CB 3.24Å; I109-R113 WeakPolarHBondContact O-CG 3.32Å; I109-R113 PolarHBondContact O-N 3.05Å; E110-R113 PolarHBondContact O-N 3.02Å; K111-R113 PolarHBondContact O-N 2.6Å
114	A	85.1	Confident	88.6	Confident	82 Å²	82	89 Å²	89	68%	0.678	47%	0.465	S	S	*	.	H	α-helix	trans	-91.7	-14.2	178.9	0	0	0	0	0	113.2	E110 K111	E110-A114 WeakPolarHBondContact O-CB 3.18Å; E110-A114 PolarHBondContact O-N 2.8Å; E110-A114 VanDerWaalsContact O-N 3.1Å; K111-A114 PolarHBondContact O-N 3.13Å
115	M	83.1	Confident	88.9	Confident	100 Å²	100	87.1 Å²	87.1	49%	0.493	45%	0.446	S	S	.	.	S	Bend	trans	-70.9	126	170	-67.8	-61.3	-67.8	0	0	109.6	K111 E253	K111-M115 WeakPolarHBondContact O-CG 3.42Å; K111-M115 PolarHBondContact O-N 3.16Å; M115-E253 WeakPolarHBondContact CE-OE1 3.28Å; M115-E253 VanDerWaalsContact CE-OE2 3.26Å; M115-E253 WeakPolarHBondContact CE-OE2 3.38Å
116	P	87.9	Confident	89.1	Confident	101 Å²	101	84.7 Å²	84.7	66%	0.656	45%	0.445	S	S	*	.			trans	-70.3	159.7	169.9	32	-34.8	0	0	0	110.4	P118	P116-P118 VanDerWaalsContact O-CD 3.25Å; P116-P118 WeakPolarHBondContact O-CD 3.49Å
117	D	89.2	Confident	89.3	Confident	45 Å²	45	83.4 Å²	83.4	24%	0.241	44%	0.439	C	S	.	.			trans	-65.6	114.1	168.5	170.3	10.9	0	0	0	109.4	W119 A120 K170 N186	D117-W119 PolarHBondContact O-N 3.42Å; D117-W119 PolarHBondContact OD1-N 2.9Å; D117-A120 HydrophobicContact CB-CB 4.14Å; D117-A120 WeakPolarHBondContact O-CB 3.42Å; D117-A120 PolarHBondContact O-N 3.4Å; D117-A120 PolarHBondContact OD2-N 2.95Å; D117-K170 WeakPolarHBondContact OD2-CE 3.41Å; D117-K170 IonicContact OD2-NZ 3.67Å; D117-K170 PolarHBondContact OD2-NZ 3.07Å; D117-N186 PolarHBondContact OD1-ND2 2.88Å
118	P	90.1	Very high	89.4	Confident	47 Å²	47	84.8 Å²	84.8	31%	0.305	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.4	-177	28.3	-35.8	0	0	0	113	P116 Y251	P116-P118 VanDerWaalsContact O-CD 3.25Å; P116-P118 WeakPolarHBondContact O-CD 3.49Å; P118-Y251 HydrophobicContact CB-CE1 4.38Å; P118-Y251 HydrophobicContact CG-CD1 4.2Å; P118-Y251 HydrophobicContact CG-CE1 3.75Å
119	W	92.6	Very high	89.8	Confident	8 Å²	8	85.2 Å²	85.2	3%	0.03	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	6.1	-179.8	-68.3	-3.6	0	0	0	114.3	D117 Q121 F122 L124 F158 R168 A169 N186 Y187 V188 Y251	D117-W119 PolarHBondContact O-N 3.42Å; D117-W119 PolarHBondContact OD1-N 2.9Å; W119-Q121 PolarHBondContact O-N 3.13Å; W119-Q121 VanDerWaalsContact O-N 3.16Å; W119-F122 HydrophobicContact CB-CD2 3.91Å; W119-F122 AromaticContact CD1-CE2 3.95Å; W119-F122 HydrophobicContact CG-CD2 4.11Å; W119-F122 HydrophobicContact CG-CE2 4.38Å; W119-F122 PolarHBondContact O-N 2.8Å; W119-L124 HydrophobicContact CB-CD1 4.2Å; W119-L124 HydrophobicContact CD2-CD1 4.43Å; W119-L124 HydrophobicContact CE3-CD1 3.73Å; W119-L124 HydrophobicContact CZ3-CD1 4.49Å; W119-F158 HydrophobicContact CZ2-CE1 4.39Å; W119-F158 HydrophobicContact CZ2-CZ 4.23Å; W119-R168 HydrophobicContact CD2-CB 4.17Å; W119-R168 HydrophobicContact CD2-CG 4.1Å; W119-R168 HydrophobicContact CE3-CB 3.83Å; W119-R168 HydrophobicContact CE3-CG 4.24Å; W119-R168 HydrophobicContact CH2-CB 3.95Å; W119-R168 HydrophobicContact CH2-CG 4.02Å; W119-R168 HydrophobicContact CZ2-CB 4.28Å; W119-R168 HydrophobicContact CZ2-CG 3.86Å; W119-R168 HydrophobicContact CZ3-CB 3.72Å; W119-R168 HydrophobicContact CZ3-CG 4.21Å; W119-A169 WeakPolarHBondContact CZ3-O 3.49Å; W119-N186 HydrophobicContact CD2-CB 4.2Å; W119-N186 HydrophobicContact CE3-CB 3.6Å; W119-N186 VanDerWaalsContact CE3-CG 3.44Å; W119-N186 HydrophobicContact CH2-CB 4.44Å; W119-N186 HydrophobicContact CZ3-CB 3.73Å; W119-Y187 VanDerWaalsContact CH2-O 3.22Å; W119-Y187 WeakPolarHBondContact CH2-O 3.45Å; W119-Y187 WeakPolarHBondContact CZ3-O 3.48Å; W119-V188 HydrophobicContact CH2-CG2 4.12Å; W119-V188 HydrophobicContact CZ2-CG2 4.47Å; W119-Y251 AromaticContact CE2-CD2 4Å; W119-Y251 AromaticContact CE2-CG 3.97Å; W119-Y251 AromaticContact CH2-CD2 3.96Å; W119-Y251 HydrophobicContact CH2-CD2 3.96Å; W119-Y251 AromaticContact CH2-CG 3.9Å; W119-Y251 HydrophobicContact CH2-CG 3.9Å; W119-Y251 HydrophobicContact CZ2-CD1 4.15Å; W119-Y251 AromaticContact CZ2-CD2 3.3Å; W119-Y251 HydrophobicContact CZ2-CD2 3.3Å; W119-Y251 AromaticContact CZ2-CE2 3.82Å; W119-Y251 HydrophobicContact CZ2-CE2 3.82Å; W119-Y251 AromaticContact CZ2-CG 3.49Å; W119-Y251 HydrophobicContact CZ2-CG 3.49Å; W119-Y251 VanDerWaalsContact CZ2-CG 3.49Å; W119-Y251 AromaticContact NE1-CZ 3.94Å
120	A	91.6	Very high	90.2	Very high	42 Å²	42	82.6 Å²	82.6	35%	0.347	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-54.1	-37.2	179.6	0	0	0	0	0	113.3	D117 F122 H123	D117-A120 HydrophobicContact CB-CB 4.14Å; D117-A120 WeakPolarHBondContact O-CB 3.42Å; D117-A120 PolarHBondContact O-N 3.4Å; D117-A120 PolarHBondContact OD2-N 2.95Å; A120-F122 PolarHBondContact O-N 3.01Å; A120-F122 VanDerWaalsContact O-N 3.15Å; A120-H123 PolarHBondContact O-N 3.28Å; A120-H123 VanDerWaalsContact O-N 3.13Å; A120-H123 PolarHBondContact O-ND1 3.18Å
121	Q	93.3	Very high	90.4	Very high	142 Å²	142	79.3 Å²	79.3	66%	0.664	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-65.5	-11.8	178.2	69.2	178.9	15.3	0	0	114.9	W119	W119-Q121 PolarHBondContact O-N 3.13Å; W119-Q121 VanDerWaalsContact O-N 3.16Å
122	F	92.9	Very high	90.8	Very high	72 Å²	72	72.6 Å²	72.6	32%	0.316	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-96.2	-0.4	177	-55.2	-67.5	0	0	0	112.8	W119 A120 L124 R168	W119-F122 HydrophobicContact CB-CD2 3.91Å; W119-F122 AromaticContact CD1-CE2 3.95Å; W119-F122 HydrophobicContact CG-CD2 4.11Å; W119-F122 HydrophobicContact CG-CE2 4.38Å; W119-F122 PolarHBondContact O-N 2.8Å; A120-F122 PolarHBondContact O-N 3.01Å; A120-F122 VanDerWaalsContact O-N 3.15Å; F122-L124 HydrophobicContact CB-CD2 4.1Å; F122-L124 HydrophobicContact CB-CG 4.14Å; F122-L124 PolarHBondContact O-N 2.93Å; F122-L124 VanDerWaalsContact O-N 3.09Å; F122-R168 VanDerWaalsContact CE2-CZ 3.49Å; F122-R168 VanDerWaalsContact CZ-NH2 3.28Å
123	H	93.9	Very high	91.5	Very high	103 Å²	103	70.6 Å²	70.6	48%	0.477	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	41	174.4	-61.5	-62	0	0	0	114.1	A120 E125 D126	A120-H123 PolarHBondContact O-N 3.28Å; A120-H123 VanDerWaalsContact O-N 3.13Å; A120-H123 PolarHBondContact O-ND1 3.18Å; H123-E125 PolarHBondContact O-N 2.81Å; H123-E125 VanDerWaalsContact O-N 3.1Å; H123-D126 PolarHBondContact O-N 2.7Å
124	L	93.6	Very high	92.3	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.021	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21	-178.5	-57.6	178.1	0	0	0	112.3	W119 F122 D126 I127 K152 R168 K170	W119-L124 HydrophobicContact CB-CD1 4.2Å; W119-L124 HydrophobicContact CD2-CD1 4.43Å; W119-L124 HydrophobicContact CE3-CD1 3.73Å; W119-L124 HydrophobicContact CZ3-CD1 4.49Å; F122-L124 HydrophobicContact CB-CD2 4.1Å; F122-L124 HydrophobicContact CB-CG 4.14Å; F122-L124 PolarHBondContact O-N 2.93Å; F122-L124 VanDerWaalsContact O-N 3.09Å; L124-D126 VanDerWaalsContact C-N 3.26Å; L124-D126 PolarHBondContact O-N 2.83Å; L124-I127 HydrophobicContact CD2-CD1 3.7Å; L124-K152 WeakPolarHBondContact O-CB 3.35Å; L124-K152 WeakPolarHBondContact O-CD 3.38Å; L124-R168 HydrophobicContact CD1-CB 3.94Å; L124-R168 HydrophobicContact CD2-CB 4.38Å; L124-K170 HydrophobicContact CB-CD 4.13Å; L124-K170 HydrophobicContact CB-CG 4.22Å; L124-K170 HydrophobicContact CD1-CG 4.14Å
125	E	91.4	Very high	92.9	Very high	21 Å²	21	58.3 Å²	58.3	10%	0.098	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.5	171.2	61	-99.8	-139.3	0	0	115	H123 K152 K170 W181 K182	H123-E125 PolarHBondContact O-N 2.81Å; H123-E125 VanDerWaalsContact O-N 3.1Å; E125-K152 PolarHBondContact O-NZ 3.05Å; E125-K170 IonicContact OE2-NZ 2.81Å; E125-W181 HydrophobicContact CB-CB 3.7Å; E125-K182 HydrophobicContact CB-CG 4.02Å; E125-K182 HydrophobicContact CG-CD 4.4Å; E125-K182 HydrophobicContact CG-CG 3.87Å; E125-K182 WeakPolarHBondContact OE1-CE 3.22Å; E125-K182 IonicContact OE1-NZ 3.23Å; E125-K182 PolarHBondContact OE1-NZ 2.82Å
126	D	92.9	Very high	93.6	Very high	119 Å²	119	57.1 Å²	57.1	64%	0.636	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-9.7	-175.1	-59.6	-36	0	0	0	112.5	H123 L124	H123-D126 PolarHBondContact O-N 2.7Å; L124-D126 VanDerWaalsContact C-N 3.26Å; L124-D126 PolarHBondContact O-N 2.83Å
127	I	93.9	Very high	93.9	Very high	51 Å²	51	53.8 Å²	53.8	26%	0.262	27%	0.271	S	S	.	.	S	Bend	trans	-65.6	156.8	172.2	-60	-179.5	0	0	0	110.4	L124 K152	L124-I127 HydrophobicContact CD2-CD1 3.7Å; I127-K152 HydrophobicContact CB-CB 4.44Å; I127-K152 VanDerWaalsContact O-CD 3.29Å; I127-K152 WeakPolarHBondContact O-CD 3.49Å; I127-K152 WeakPolarHBondContact O-CE 3.48Å; I127-K152 PolarHBondContact O-NZ 2.82Å
128	E	92.8	Very high	94	Very high	165 Å²	165	53.6 Å²	53.6	77%	0.771	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-58.1	147.9	173.4	-172.2	166.9	-168.4	0	0	112.4
129	T	94.4	Very high	94	Very high	55 Å²	55	51.6 Å²	51.6	34%	0.337	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-89.6	118.4	177.7	-52.1	0	0	0	0	110.3	H150 K152 W181	T129-H150 HydrophobicContact CG2-CB 3.99Å; T129-K152 WeakPolarHBondContact OG1-CE 3.33Å; T129-W181 HydrophobicContact CG2-CH2 4.41Å; T129-W181 HydrophobicContact CG2-CZ2 3.61Å
130	E	94.6	Very high	93.6	Very high	33 Å²	33	52.8 Å²	52.8	15%	0.154	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.6	179.8	-62.5	-178.1	94.5	0	0	110.3	H150 V151 R240	E130-H150 WeakPolarHBondContact O-CA 3.34Å; E130-V151 PolarHBondContact N-O 2.84Å; E130-V151 PolarHBondContact O-N 3.48Å; E130-R240 IonicContact OE1-CZ 3.37Å; E130-R240 VanDerWaalsContact OE1-CZ 3.27Å; E130-R240 IonicContact OE1-NE 2.83Å; E130-R240 PolarHBondContact OE1-NE 3.49Å; E130-R240 IonicContact OE1-NH2 2.7Å; E130-R240 PolarHBondContact OE1-NH2 2.91Å; E130-R240 IonicContact OE2-CZ 3.33Å; E130-R240 IonicContact OE2-NE 3.79Å; E130-R240 IonicContact OE2-NH2 2.74Å; E130-R240 PolarHBondContact OE2-NH2 2.78Å
131	P	93.8	Very high	93.3	Very high	46 Å²	46	52.5 Å²	52.5	30%	0.299	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136.8	165.4	32.4	-32.4	0	0	0	109.2	T238 N239	P131-T238 PolarHBondContact O-OG1 3.09Å; P131-N239 WeakPolarHBondContact CG-ND2 3.41Å
132	C	96.3	Very high	93.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	155.5	-178.3	-42.1	0	0	0	0	110.6	Q148 I149 V235 E236	C132-Q148 WeakPolarHBondContact O-CA 3.18Å; C132-I149 HydrophobicContact CB-CG1 3.98Å; C132-I149 PolarHBondContact N-O 3.04Å; C132-I149 PolarHBondContact O-N 3.34Å; C132-V235 HydrophobicContact CB-CG1 3.44Å; C132-V235 VanDerWaalsContact CB-CG1 3.44Å; C132-E236 WeakPolarHBondContact CA-O 3.44Å; C132-E236 WeakPolarHBondContact CB-O 3.41Å
133	I	97.4	Very high	93	Very high	30 Å²	30	48.9 Å²	48.9	15%	0.154	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.4	165.9	-65.4	170.8	0	0	0	108.2	Y135 Q146 V235 E236 T238	I133-Y135 HydrophobicContact CB-CE2 4.37Å; I133-Y135 HydrophobicContact CG2-CD2 4.24Å; I133-Y135 HydrophobicContact CG2-CE1 3.99Å; I133-Y135 HydrophobicContact CG2-CE2 3.66Å; I133-Q146 HydrophobicContact CG2-CG 3.45Å; I133-Q146 VanDerWaalsContact CG2-CG 3.45Å; I133-V235 CarbonylContact O-C 3.56Å; I133-V235 WeakPolarHBondContact O-CA 3.39Å; I133-E236 HydrophobicContact CB-CB 4.37Å; I133-E236 PolarHBondContact N-O 3.33Å; I133-E236 VanDerWaalsContact N-O 3.12Å; I133-E236 PolarHBondContact O-N 3.13Å; I133-T238 HydrophobicContact CB-CG2 4.37Å; I133-T238 HydrophobicContact CD1-CG2 3.63Å; I133-T238 HydrophobicContact CG1-CG2 3.73Å
134	R	97.6	Very high	93.1	Very high	8 Å²	8	47.6 Å²	47.6	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.7	174.4	173.1	178.1	64	164	-2.3	110.1	R136 Q146 D147 I149 C233 V234 V235 D495	R134-R136 HydrophobicContact CG-CG 4.33Å; R134-Q146 WeakPolarHBondContact O-CA 2.91Å; R134-D147 WeakPolarHBondContact CB-OD1 3.46Å; R134-D147 IonicContact CZ-OD1 2.76Å; R134-D147 IonicContact CZ-OD2 3.31Å; R134-D147 PolarHBondContact N-O 2.9Å; R134-D147 IonicContact NE-OD1 3.74Å; R134-D147 PolarHBondContact NE-OD1 3.39Å; R134-D147 IonicContact NE-OD2 3.84Å; R134-D147 IonicContact NH2-OD1 3.9Å; R134-D147 PolarHBondContact NH2-OD1 3Å; R134-D147 IonicContact NH2-OD2 3.31Å; R134-D147 PolarHBondContact NH2-OD2 3.4Å; R134-D147 PolarHBondContact O-N 2.81Å; R134-I149 HydrophobicContact CB-CD1 3.94Å; R134-I149 HydrophobicContact CB-CG1 4.03Å; R134-I149 HydrophobicContact CB-CG2 3.84Å; R134-C233 HydrophobicContact CG-CB 4.07Å; R134-V234 CarbonylContact C-O 3.59Å; R134-V234 WeakPolarHBondContact CA-O 3.43Å; R134-V235 HydrophobicContact CB-CG2 4.42Å; R134-V235 HydrophobicContact CG-CG2 4.48Å; R134-D495 IonicContact CZ-OD1 3.72Å; R134-D495 VanDerWaalsContact CZ-OD1 3.26Å; R134-D495 IonicContact NH1-OD1 2.65Å; R134-D495 PolarHBondContact NH1-OD1 2.81Å; R134-D495 IonicContact NH2-OD1 2.63Å; R134-D495 PolarHBondContact NH2-OD1 3.28Å
135	Y	98.1	Very high	93.2	Very high	30 Å²	30	49.8 Å²	49.8	12%	0.118	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.5	173.4	-53	-89.8	0	0	0	109.7	I133 A145 Q146 R198 F202 C233 V234 E236	I133-Y135 HydrophobicContact CB-CE2 4.37Å; I133-Y135 HydrophobicContact CG2-CD2 4.24Å; I133-Y135 HydrophobicContact CG2-CE1 3.99Å; I133-Y135 HydrophobicContact CG2-CE2 3.66Å; Y135-A145 WeakPolarHBondContact CA-O 3.49Å; Y135-Q146 HydrophobicContact CD1-CB 4.27Å; Y135-Q146 HydrophobicContact CD1-CG 3.99Å; Y135-Q146 HydrophobicContact CE1-CG 3.9Å; Y135-Q146 VanDerWaalsContact CE1-OE1 3.28Å; Y135-R198 PolarHBondContact OH-NH2 2.87Å; Y135-F202 HydrophobicContact CD1-CE1 4.05Å; Y135-F202 HydrophobicContact CD1-CZ 4.26Å; Y135-F202 HydrophobicContact CD2-CE1 4.14Å; Y135-F202 AromaticContact CD2-CZ 3.75Å; Y135-F202 HydrophobicContact CD2-CZ 3.75Å; Y135-F202 HydrophobicContact CE2-CZ 4.07Å; Y135-F202 AromaticContact CG-CE1 3.75Å; Y135-F202 HydrophobicContact CG-CE1 3.75Å; Y135-F202 AromaticContact CG-CZ 3.85Å; Y135-F202 HydrophobicContact CG-CZ 3.85Å; Y135-C233 WeakPolarHBondContact O-CA 3.37Å; Y135-C233 VanDerWaalsContact O-CB 3.28Å; Y135-C233 WeakPolarHBondContact O-CB 3.1Å; Y135-V234 HydrophobicContact CD2-CB 4.22Å; Y135-V234 HydrophobicContact CD2-CG1 4.39Å; Y135-V234 PolarHBondContact N-O 3.43Å; Y135-V234 PolarHBondContact O-N 3.15Å; Y135-E236 HydrophobicContact CE2-CB 4.09Å; Y135-E236 PolarHBondContact OH-OE2 3.33Å
136	R	96.6	Very high	93.4	Very high	75 Å²	75	54.7 Å²	54.7	28%	0.283	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.4	174.5	-70.8	-175.6	-59.1	-70.4	23.1	110.1	R134 W144 A145 D147 C233	R134-R136 HydrophobicContact CG-CG 4.33Å; R136-W144 CarbonylContact O-C 3.46Å; R136-W144 WeakPolarHBondContact O-CA 3.22Å; R136-A145 PolarHBondContact N-O 2.67Å; R136-A145 PolarHBondContact O-N 3.35Å; R136-D147 IonicContact CZ-OD2 2.7Å; R136-D147 VanDerWaalsContact CZ-OD2 3.23Å; R136-D147 IonicContact NH1-OD1 2.72Å; R136-D147 PolarHBondContact NH1-OD1 2.98Å; R136-D147 IonicContact NH1-OD2 3.7Å; R136-D147 PolarHBondContact NH1-OD2 3.34Å; R136-D147 IonicContact NH2-OD2 2.78Å; R136-D147 PolarHBondContact NH2-OD2 2.94Å; R136-C233 HydrophobicContact CG-CB 4.04Å
137	Y	95.8	Very high	93.5	Very high	32 Å²	32	50.8 Å²	50.8	13%	0.125	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.7	173.3	177.7	-118.1	0	0	0	110.8	A139 W144 R206 M209	Y137-A139 HydrophobicContact CD1-CB 4.21Å; Y137-A139 VanDerWaalsContact CE1-CA 3.47Å; Y137-A139 HydrophobicContact CE1-CB 3.67Å; Y137-W144 AromaticContact CD2-CD1 3.79Å; Y137-W144 HydrophobicContact CD2-CD2 4.12Å; Y137-W144 AromaticContact CD2-CE2 3.62Å; Y137-W144 HydrophobicContact CD2-CG 4.25Å; Y137-W144 HydrophobicContact CD2-CZ2 4.11Å; Y137-W144 AromaticContact CD2-NE1 3.35Å; Y137-W144 VanDerWaalsContact CD2-NE1 3.35Å; Y137-W144 AromaticContact CE2-NE1 3.91Å; Y137-W144 HydrophobicContact CG-CD2 4.5Å; Y137-W144 HydrophobicContact CG-CZ2 4.08Å; Y137-R206 HydrophobicContact CD1-CB 4.18Å; Y137-R206 HydrophobicContact CD1-CG 3.88Å; Y137-R206 HydrophobicContact CD2-CG 4.26Å; Y137-R206 HydrophobicContact CE1-CB 3.96Å; Y137-R206 HydrophobicContact CE1-CG 3.8Å; Y137-R206 HydrophobicContact CE2-CG 4.18Å; Y137-R206 HydrophobicContact CG-CG 4.11Å; Y137-M209 HydrophobicContact CD1-CB 3.96Å; Y137-M209 HydrophobicContact CD1-CG 4.47Å
138	S	91.6	Very high	93.6	Very high	40 Å²	40	55.6 Å²	55.6	28%	0.28	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	98.7	171.3	168	0	0	0	0	109.3	I140 T141 G142 E143	S138-I140 PolarHBondContact O-N 3.24Å; S138-T141 VanDerWaalsContact CB-OG1 3.24Å; S138-T141 WeakPolarHBondContact CB-OG1 3.41Å; S138-T141 PolarHBondContact O-N 3.03Å; S138-T141 VanDerWaalsContact O-N 3.08Å; S138-T141 PolarHBondContact OG-N 3.23Å; S138-T141 PolarHBondContact OG-OG1 2.88Å; S138-G142 PolarHBondContact O-N 3.13Å; S138-E143 PolarHBondContact N-O 3.36Å
139	A	88.4	Confident	93.7	Very high	5 Å²	5	47.8 Å²	47.8	4%	0.041	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-16.3	177.7	0	0	0	0	0	113.7	Y137 M209 E210 L213 F540	Y137-A139 HydrophobicContact CD1-CB 4.21Å; Y137-A139 VanDerWaalsContact CE1-CA 3.47Å; Y137-A139 HydrophobicContact CE1-CB 3.67Å; A139-M209 HydrophobicContact CB-CB 4.08Å; A139-E210 HydrophobicContact CB-CG 4.3Å; A139-L213 HydrophobicContact CB-CD1 3.54Å; A139-L213 HydrophobicContact CB-CG 4.17Å; A139-F540 WeakPolarHBondContact O-CE2 3.42Å
140	I	84.4	Confident	93.6	Very high	34 Å²	34	49.4 Å²	49.4	17%	0.174	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-37.1	175.1	-62.9	126.1	0	0	0	112.2	S138 L213 W537	S138-I140 PolarHBondContact O-N 3.24Å; I140-L213 HydrophobicContact CD1-CD2 4.07Å; I140-L213 HydrophobicContact CG1-CD1 4.12Å; I140-L213 HydrophobicContact CG1-CD2 3.94Å; I140-W537 HydrophobicContact CB-CZ2 4.37Å; I140-W537 HydrophobicContact CD1-CH2 3.66Å; I140-W537 HydrophobicContact CD1-CZ2 3.45Å; I140-W537 VanDerWaalsContact CD1-CZ2 3.45Å; I140-W537 HydrophobicContact CG1-CH2 3.68Å; I140-W537 HydrophobicContact CG1-CZ2 3.6Å; I140-W537 HydrophobicContact CG1-CZ3 4.26Å; I140-W537 HydrophobicContact CG2-CD2 3.97Å; I140-W537 HydrophobicContact CG2-CG 4.23Å; I140-W537 HydrophobicContact CG2-CZ2 3.97Å
141	T	86.6	Confident	93.7	Very high	35 Å²	35	47.9 Å²	47.9	22%	0.215	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-19.2	-176.9	57.7	0	0	0	0	113.3	S138 E143 L532	S138-T141 VanDerWaalsContact CB-OG1 3.24Å; S138-T141 WeakPolarHBondContact CB-OG1 3.41Å; S138-T141 PolarHBondContact O-N 3.03Å; S138-T141 VanDerWaalsContact O-N 3.08Å; S138-T141 PolarHBondContact OG-N 3.23Å; S138-T141 PolarHBondContact OG-OG1 2.88Å; T141-E143 WeakPolarHBondContact CB-OE2 3.13Å; T141-E143 WeakPolarHBondContact OG1-CB 3.41Å; T141-E143 PolarHBondContact OG1-N 2.86Å; T141-E143 PolarHBondContact OG1-OE2 2.82Å; T141-L532 HydrophobicContact CG2-CD1 3.48Å; T141-L532 VanDerWaalsContact CG2-CD1 3.48Å
142	G	87.3	Confident	93.8	Very high	44 Å²	44	46.5 Å²	46.5	45%	0.454	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	5	-170	0	0	0	0	0	113.5	S138	S138-G142 PolarHBondContact O-N 3.13Å
143	E	92.5	Very high	93.8	Very high	94 Å²	94	46.6 Å²	46.6	44%	0.439	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	156.2	-168.9	-64.8	160.2	176.7	0	0	112.2	S138 T141	S138-E143 PolarHBondContact N-O 3.36Å; T141-E143 WeakPolarHBondContact CB-OE2 3.13Å; T141-E143 WeakPolarHBondContact OG1-CB 3.41Å; T141-E143 PolarHBondContact OG1-N 2.86Å; T141-E143 PolarHBondContact OG1-OE2 2.82Å
144	W	95.9	Very high	93.7	Very high	76 Å²	76	45.8 Å²	45.8	29%	0.288	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.2	177.2	-75.9	83.3	0	0	0	110.9	R136 Y137 F202 V205 R206 V234	R136-W144 CarbonylContact O-C 3.46Å; R136-W144 WeakPolarHBondContact O-CA 3.22Å; Y137-W144 AromaticContact CD2-CD1 3.79Å; Y137-W144 HydrophobicContact CD2-CD2 4.12Å; Y137-W144 AromaticContact CD2-CE2 3.62Å; Y137-W144 HydrophobicContact CD2-CG 4.25Å; Y137-W144 HydrophobicContact CD2-CZ2 4.11Å; Y137-W144 AromaticContact CD2-NE1 3.35Å; Y137-W144 VanDerWaalsContact CD2-NE1 3.35Å; Y137-W144 AromaticContact CE2-NE1 3.91Å; Y137-W144 HydrophobicContact CG-CD2 4.5Å; Y137-W144 HydrophobicContact CG-CZ2 4.08Å; W144-F202 HydrophobicContact CD2-CD1 4.18Å; W144-F202 AromaticContact CE3-CD1 3.92Å; W144-F202 HydrophobicContact CE3-CD1 3.92Å; W144-F202 HydrophobicContact CE3-CE1 4.15Å; W144-F202 HydrophobicContact CH2-CB 3.85Å; W144-F202 AromaticContact CH2-CD1 3.39Å; W144-F202 HydrophobicContact CH2-CD1 3.39Å; W144-F202 HydrophobicContact CH2-CE1 4.26Å; W144-F202 AromaticContact CH2-CG 3.96Å; W144-F202 HydrophobicContact CH2-CG 3.96Å; W144-F202 HydrophobicContact CZ2-CB 3.84Å; W144-F202 AromaticContact CZ2-CD1 3.69Å; W144-F202 HydrophobicContact CZ2-CD1 3.69Å; W144-F202 HydrophobicContact CZ2-CG 4.24Å; W144-F202 WeakPolarHBondContact CZ2-O 3.4Å; W144-F202 AromaticContact CZ3-CD1 3.53Å; W144-F202 HydrophobicContact CZ3-CD1 3.53Å; W144-F202 AromaticContact CZ3-CE1 3.95Å; W144-F202 HydrophobicContact CZ3-CE1 3.95Å; W144-F202 HydrophobicContact CZ3-CG 4.45Å; W144-V205 HydrophobicContact CH2-CB 3.92Å; W144-V205 HydrophobicContact CH2-CG1 3.64Å; W144-V205 HydrophobicContact CZ3-CG1 4.04Å; W144-R206 HydrophobicContact CZ2-CG 3.93Å; W144-V234 HydrophobicContact CH2-CG2 4.42Å; W144-V234 HydrophobicContact CZ3-CG2 4.4Å
145	A	95.4	Very high	93.4	Very high	51 Å²	51	51.7 Å²	51.7	42%	0.421	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143	173.4	0	0	0	0	0	110.5	Y135 R136	Y135-A145 WeakPolarHBondContact CA-O 3.49Å; R136-A145 PolarHBondContact N-O 2.67Å; R136-A145 PolarHBondContact O-N 3.35Å
146	Q	96.1	Very high	93.2	Very high	123 Å²	123	57.7 Å²	57.7	58%	0.575	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.8	-179.2	-173.2	-174.6	-41.4	0	0	110.6	I133 R134 Y135	I133-Q146 HydrophobicContact CG2-CG 3.45Å; I133-Q146 VanDerWaalsContact CG2-CG 3.45Å; R134-Q146 WeakPolarHBondContact O-CA 2.91Å; Y135-Q146 HydrophobicContact CD1-CB 4.27Å; Y135-Q146 HydrophobicContact CD1-CG 3.99Å; Y135-Q146 HydrophobicContact CE1-CG 3.9Å; Y135-Q146 VanDerWaalsContact CE1-OE1 3.28Å
147	D	94.9	Very high	93.1	Very high	38 Å²	38	57 Å²	57	20%	0.203	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	171.4	166	57.1	21.9	0	0	0	112.6	R134 R136	R134-D147 WeakPolarHBondContact CB-OD1 3.46Å; R134-D147 IonicContact CZ-OD1 2.76Å; R134-D147 IonicContact CZ-OD2 3.31Å; R134-D147 PolarHBondContact N-O 2.9Å; R134-D147 IonicContact NE-OD1 3.74Å; R134-D147 PolarHBondContact NE-OD1 3.39Å; R134-D147 IonicContact NE-OD2 3.84Å; R134-D147 IonicContact NH2-OD1 3.9Å; R134-D147 PolarHBondContact NH2-OD1 3Å; R134-D147 IonicContact NH2-OD2 3.31Å; R134-D147 PolarHBondContact NH2-OD2 3.4Å; R134-D147 PolarHBondContact O-N 2.81Å; R136-D147 IonicContact CZ-OD2 2.7Å; R136-D147 VanDerWaalsContact CZ-OD2 3.23Å; R136-D147 IonicContact NH1-OD1 2.72Å; R136-D147 PolarHBondContact NH1-OD1 2.98Å; R136-D147 IonicContact NH1-OD2 3.7Å; R136-D147 PolarHBondContact NH1-OD2 3.34Å; R136-D147 IonicContact NH2-OD2 2.78Å; R136-D147 PolarHBondContact NH2-OD2 2.94Å
148	Q	94.9	Very high	93.1	Very high	151 Å²	151	59.1 Å²	59.1	71%	0.706	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	140.8	168.7	-71.7	179.9	-19	0	0	109.8	C132 N174	C132-Q148 WeakPolarHBondContact O-CA 3.18Å; Q148-N174 PolarHBondContact O-ND2 2.93Å
149	I	94.8	Very high	93.1	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	163	175.3	64	165.3	0	0	0	109.8	C132 R134 V151 K171 V235 L248	C132-I149 HydrophobicContact CB-CG1 3.98Å; C132-I149 PolarHBondContact N-O 3.04Å; C132-I149 PolarHBondContact O-N 3.34Å; R134-I149 HydrophobicContact CB-CD1 3.94Å; R134-I149 HydrophobicContact CB-CG1 4.03Å; R134-I149 HydrophobicContact CB-CG2 3.84Å; I149-V151 HydrophobicContact CD1-CG2 3.55Å; I149-V151 HydrophobicContact CG1-CG2 4.07Å; I149-K171 HydrophobicContact CD1-CG 4.37Å; I149-V235 HydrophobicContact CD1-CG1 4.13Å; I149-V235 HydrophobicContact CD1-CG2 3.96Å; I149-L248 HydrophobicContact CD1-CD2 4.14Å
150	H	93.6	Very high	93.3	Very high	89 Å²	89	66.3 Å²	66.3	41%	0.412	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.8	168.5	-65.3	92.4	0	0	0	109.4	T129 E130 L172 W181	T129-H150 HydrophobicContact CG2-CB 3.99Å; E130-H150 WeakPolarHBondContact O-CA 3.34Å; H150-L172 PolarHBondContact O-N 2.89Å; H150-W181 HydrophobicContact CB-CH2 4.19Å; H150-W181 HydrophobicContact CB-CZ2 4.12Å; H150-W181 WeakPolarHBondContact O-CH2 3.5Å
151	V	95.6	Very high	93.4	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.006	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	148.6	-177.5	-178.6	0	0	0	0	109.7	E130 I149 M153 A169 K170	E130-V151 PolarHBondContact N-O 2.84Å; E130-V151 PolarHBondContact O-N 3.48Å; I149-V151 HydrophobicContact CD1-CG2 3.55Å; I149-V151 HydrophobicContact CG1-CG2 4.07Å; V151-M153 HydrophobicContact CG1-CB 4.3Å; V151-A169 HydrophobicContact CG1-CB 4Å; V151-K170 CarbonylContact C-O 3.56Å; V151-K170 WeakPolarHBondContact CA-O 3.48Å
152	K	95.8	Very high	93.4	Very high	18 Å²	18	70.2 Å²	70.2	8%	0.078	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.2	161.4	-67.9	-165	173.7	-155.7	0	108.3	L124 E125 I127 T129 A169 K170 W181	L124-K152 WeakPolarHBondContact O-CB 3.35Å; L124-K152 WeakPolarHBondContact O-CD 3.38Å; E125-K152 PolarHBondContact O-NZ 3.05Å; I127-K152 HydrophobicContact CB-CB 4.44Å; I127-K152 VanDerWaalsContact O-CD 3.29Å; I127-K152 WeakPolarHBondContact O-CD 3.49Å; I127-K152 WeakPolarHBondContact O-CE 3.48Å; I127-K152 PolarHBondContact O-NZ 2.82Å; T129-K152 WeakPolarHBondContact OG1-CE 3.33Å; K152-A169 CarbonylContact O-C 3.48Å; K152-A169 VanDerWaalsContact O-CA 3.22Å; K152-A169 WeakPolarHBondContact O-CA 3.41Å; K152-K170 PolarHBondContact N-O 3.38Å; K152-K170 PolarHBondContact O-N 3.08Å; K152-W181 HydrophobicContact CB-CE3 4.3Å; K152-W181 HydrophobicContact CB-CH2 4.47Å; K152-W181 HydrophobicContact CB-CZ3 4.08Å; K152-W181 HydrophobicContact CD-CD2 3.72Å; K152-W181 HydrophobicContact CD-CE3 3.93Å; K152-W181 HydrophobicContact CD-CG 4.07Å; K152-W181 HydrophobicContact CD-CZ2 4.39Å; K152-W181 HydrophobicContact CD-CZ3 4.34Å; K152-W181 HydrophobicContact CG-CD2 4.01Å; K152-W181 HydrophobicContact CG-CE3 3.85Å; K152-W181 HydrophobicContact CG-CH2 3.8Å; K152-W181 HydrophobicContact CG-CZ2 3.96Å; K152-W181 HydrophobicContact CG-CZ3 3.75Å
153	M	96	Very high	93.7	Very high	4 Å²	4	73.6 Å²	73.6	2%	0.02	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.7	-171.8	-174	169.4	62.3	0	0	112	V151 F167 R168 A169 A189 M237 F246	V151-M153 HydrophobicContact CG1-CB 4.3Å; M153-F167 HydrophobicContact CG-CB 3.86Å; M153-F167 HydrophobicContact SD-CB 3.87Å; M153-F167 HydrophobicContact SD-CG 4.32Å; M153-R168 WeakPolarHBondContact CA-O 3.3Å; M153-A169 HydrophobicContact CB-CB 4.27Å; M153-A169 HydrophobicContact CG-CB 4.24Å; M153-A189 HydrophobicContact SD-CB 3.46Å; M153-A189 WeakPolarHBondContact SD-CB 3.46Å; M153-M237 HydrophobicContact CE-CE 3.71Å; M153-M237 HydrophobicContact SD-CE 4.2Å; M153-F246 HydrophobicContact CE-CD1 4.31Å; M153-F246 HydrophobicContact CE-CE1 3.78Å; M153-F246 HydrophobicContact CE-CE2 4.04Å; M153-F246 HydrophobicContact CE-CZ 3.64Å; M153-F246 HydrophobicContact SD-CD1 4.17Å; M153-F246 HydrophobicContact SD-CE1 4.04Å; M153-F246 HydrophobicContact SD-CZ 4.49Å
154	G	95.2	Very high	93.8	Very high	12 Å²	12	70.8 Å²	70.8	12%	0.124	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	144.2	173.9	0	0	0	0	0	112.1	F167 R168	G154-F167 VanDerWaalsContact O-CD1 3.3Å; G154-F167 WeakPolarHBondContact O-CD1 3.4Å; G154-R168 PolarHBondContact N-O 2.86Å
155	T	91.1	Very high	93.8	Very high	133 Å²	133	68.8 Å²	68.8	82%	0.816	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	-21.3	-177.9	51.1	0	0	0	0	114
156	Q	93.9	Very high	93.9	Very high	155 Å²	155	67.4 Å²	67.4	72%	0.724	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.5	179.3	-65.5	-177.7	-4.2	0	0	111.2	F167	Q156-F167 VanDerWaalsContact C-CE1 3.49Å
157	P	96.3	Very high	94	Very high	62 Å²	62	61.8 Å²	61.8	40%	0.403	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	149	171.7	31.9	-36.1	0	0	0	110.1	E165 C166 F167	P157-E165 HydrophobicContact CB-CB 4.21Å; P157-E165 WeakPolarHBondContact CG-OE2 3.34Å; P157-C166 CarbonylContact C-O 3.59Å; P157-C166 VanDerWaalsContact CA-O 3.26Å; P157-C166 WeakPolarHBondContact CA-O 3.49Å; P157-F167 HydrophobicContact CB-CD1 4.41Å; P157-F167 HydrophobicContact CB-CE1 3.96Å; P157-F167 HydrophobicContact CB-CE2 4.35Å; P157-F167 HydrophobicContact CB-CZ 3.89Å; P157-F167 HydrophobicContact CG-CE1 4.37Å; P157-F167 HydrophobicContact CG-CZ 4.34Å; P157-F167 VanDerWaalsContact N-CE1 3.28Å
158	F	94.6	Very high	94.1	Very high	76 Å²	76	62.8 Å²	62.8	33%	0.333	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-7.7	177.2	79.5	-87.9	0	0	0	113.9	W119 C166 R168 V188	W119-F158 HydrophobicContact CZ2-CE1 4.39Å; W119-F158 HydrophobicContact CZ2-CZ 4.23Å; F158-C166 HydrophobicContact CD1-CB 4.42Å; F158-C166 WeakPolarHBondContact CD1-O 3.35Å; F158-C166 HydrophobicContact CE1-CB 3.99Å; F158-C166 HydrophobicContact CZ-CB 4.33Å; F158-C166 PolarHBondContact N-O 3.26Å; F158-R168 HydrophobicContact CB-CG 4.35Å; F158-R168 VanDerWaalsContact CB-CZ 3.41Å; F158-R168 HydrophobicContact CD1-CB 4.48Å; F158-R168 HydrophobicContact CD1-CG 3.47Å; F158-R168 VanDerWaalsContact CD1-CG 3.47Å; F158-R168 HydrophobicContact CE1-CG 3.91Å; F158-R168 HydrophobicContact CG-CG 3.97Å; F158-V188 HydrophobicContact CE1-CG1 4.14Å; F158-V188 HydrophobicContact CE1-CG2 4.29Å; F158-V188 HydrophobicContact CZ-CG1 4.26Å; F158-V188 HydrophobicContact CZ-CG2 3.93Å
159	G	91.8	Very high	94.2	Very high	31 Å²	31	55.6 Å²	55.6	32%	0.32	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	164.4	176.6	0	0	0	0	0	110.3	C166	G159-C166 PolarHBondContact O-N 3.45Å
160	K	92.1	Very high	94.2	Very high	165 Å²	165	55.6 Å²	55.6	72%	0.717	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	143.1	174	59.1	177.6	-177.9	173.5	0	110.6	R164 E165 M193	K160-R164 WeakPolarHBondContact CA-O 3.41Å; K160-E165 HydrophobicContact CB-CB 4.36Å; K160-M193 HydrophobicContact CB-SD 4.34Å; K160-M193 HydrophobicContact CD-SD 4.21Å
161	G	87.6	Confident	94.2	Very high	51 Å²	51	51.5 Å²	51.5	53%	0.526	29%	0.293	S	S	.	.			trans	-89.8	-153.4	166.3	0	0	0	0	0	110.9	R164	G161-R164 PolarHBondContact N-O 3.1Å
162	A	87.1	Confident	93.9	Very high	100 Å²	100	52.8 Å²	52.8	83%	0.826	30%	0.3	S	S	*	.	S	Bend	trans	-70.4	-46.3	174.4	0	0	0	0	0	112.5	M193	A162-M193 WeakPolarHBondContact O-CE 3.3Å
163	M	91.8	Very high	93.3	Very high	114 Å²	114	54.3 Å²	54.3	56%	0.562	31%	0.313	S	S	*	.	S	Bend	trans	-114.4	-22.1	-172.1	-58.4	169.8	79.1	0	0	114.2	Y192 M193	M163-Y192 HydrophobicContact CB-CD1 4.04Å; M163-Y192 HydrophobicContact CB-CE1 4.24Å; M163-Y192 HydrophobicContact CE-CE1 4.19Å; M163-Y192 WeakPolarHBondContact O-CA 3.3Å; M163-M193 PolarHBondContact O-N 2.96Å
164	R	95.4	Very high	92.4	Very high	36 Å²	36	57.4 Å²	57.4	14%	0.136	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.2	-172.2	-63.5	179.8	-63	164.3	12.7	112.3	K160 G161 R191 Y192 D204 H247 D304	K160-R164 WeakPolarHBondContact CA-O 3.41Å; G161-R164 PolarHBondContact N-O 3.1Å; R164-R191 CarbonylContact C-O 3.49Å; R164-R191 WeakPolarHBondContact CA-O 3.32Å; R164-R191 WeakPolarHBondContact CB-O 3.38Å; R164-Y192 HydrophobicContact CG-CD1 3.67Å; R164-Y192 HydrophobicContact CG-CD2 4.19Å; R164-Y192 HydrophobicContact CG-CE1 3.79Å; R164-Y192 HydrophobicContact CG-CE2 4.31Å; R164-Y192 HydrophobicContact CG-CG 3.88Å; R164-D204 IonicContact CZ-OD2 3.73Å; R164-D204 IonicContact NE-OD2 4Å; R164-D204 IonicContact NH1-OD2 2.73Å; R164-D204 PolarHBondContact NH1-OD2 3.07Å; R164-H247 PolarHBondContact NH1-ND1 3.2Å; R164-D304 IonicContact CZ-OD1 2.64Å; R164-D304 IonicContact NH1-OD1 2.83Å; R164-D304 IonicContact NH2-OD1 1.82Å; R164-D304 PolarHBondContact NH2-OD1 3.27Å; R164-D304 IonicContact NH2-OD2 3.51Å; R164-D304 PolarHBondContact NH2-OD2 3.26Å
165	E	96.8	Very high	91.2	Very high	34 Å²	34	61.8 Å²	61.8	16%	0.159	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	149	172.4	53.7	160.8	-166.5	0	0	111.9	P157 K160 F167 K190 R191 M193	P157-E165 HydrophobicContact CB-CB 4.21Å; P157-E165 WeakPolarHBondContact CG-OE2 3.34Å; K160-E165 HydrophobicContact CB-CB 4.36Å; E165-F167 HydrophobicContact CG-CE2 3.82Å; E165-F167 HydrophobicContact CG-CZ 4.29Å; E165-F167 VanDerWaalsContact OE1-CE2 3.32Å; E165-F167 WeakPolarHBondContact OE1-CE2 3.19Å; E165-F167 WeakPolarHBondContact OE1-CZ 3.25Å; E165-K190 VanDerWaalsContact O-CA 3.26Å; E165-K190 WeakPolarHBondContact O-CA 3.22Å; E165-R191 HydrophobicContact CG-CG 4.09Å; E165-R191 PolarHBondContact N-O 3.29Å; E165-R191 PolarHBondContact O-N 3.42Å; E165-R191 VanDerWaalsContact O-N 3.12Å; E165-R191 IonicContact OE1-CZ 2.82Å; E165-R191 IonicContact OE1-NE 3.22Å; E165-R191 PolarHBondContact OE1-NE 2.81Å; E165-R191 IonicContact OE1-NH2 3.43Å; E165-R191 PolarHBondContact OE1-NH2 2.78Å; E165-M193 HydrophobicContact CB-CG 4.07Å; E165-M193 HydrophobicContact CB-SD 4.45Å; E165-M193 HydrophobicContact CG-CG 3.97Å
166	C	97	Very high	90.1	Very high	22 Å²	22	58.1 Å²	58.1	15%	0.149	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.5	-167.8	-60.7	0	0	0	0	112.3	P157 F158 G159 V188 A189	P157-C166 CarbonylContact C-O 3.59Å; P157-C166 VanDerWaalsContact CA-O 3.26Å; P157-C166 WeakPolarHBondContact CA-O 3.49Å; F158-C166 HydrophobicContact CD1-CB 4.42Å; F158-C166 WeakPolarHBondContact CD1-O 3.35Å; F158-C166 HydrophobicContact CE1-CB 3.99Å; F158-C166 HydrophobicContact CZ-CB 4.33Å; F158-C166 PolarHBondContact N-O 3.26Å; G159-C166 PolarHBondContact O-N 3.45Å; C166-V188 HydrophobicContact CB-CG1 3.81Å; C166-A189 CarbonylContact C-O 3.59Å
167	F	97.4	Very high	88.8	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.022	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	149	179.9	-64.7	-90.3	0	0	0	111.5	M153 G154 Q156 P157 E165 A189 R191 F246	M153-F167 HydrophobicContact CG-CB 3.86Å; M153-F167 HydrophobicContact SD-CB 3.87Å; M153-F167 HydrophobicContact SD-CG 4.32Å; G154-F167 VanDerWaalsContact O-CD1 3.3Å; G154-F167 WeakPolarHBondContact O-CD1 3.4Å; Q156-F167 VanDerWaalsContact C-CE1 3.49Å; P157-F167 HydrophobicContact CB-CD1 4.41Å; P157-F167 HydrophobicContact CB-CE1 3.96Å; P157-F167 HydrophobicContact CB-CE2 4.35Å; P157-F167 HydrophobicContact CB-CZ 3.89Å; P157-F167 HydrophobicContact CG-CE1 4.37Å; P157-F167 HydrophobicContact CG-CZ 4.34Å; P157-F167 VanDerWaalsContact N-CE1 3.28Å; E165-F167 HydrophobicContact CG-CE2 3.82Å; E165-F167 HydrophobicContact CG-CZ 4.29Å; E165-F167 VanDerWaalsContact OE1-CE2 3.32Å; E165-F167 WeakPolarHBondContact OE1-CE2 3.19Å; E165-F167 WeakPolarHBondContact OE1-CZ 3.25Å; F167-A189 HydrophobicContact CB-CB 4.33Å; F167-A189 PolarHBondContact N-O 3.34Å; F167-A189 PolarHBondContact O-N 2.98Å; F167-R191 HydrophobicContact CE2-CG 4.2Å; F167-F246 HydrophobicContact CD2-CE1 4.04Å; F167-F246 HydrophobicContact CE2-CE1 4.24Å
168	R	97.1	Very high	87.4	Confident	58 Å²	58	60.3 Å²	60.3	22%	0.219	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.2	171.6	-59.4	-172.2	-177.4	91.2	0.2	109.3	W119 F122 L124 M153 G154 F158	W119-R168 HydrophobicContact CD2-CB 4.17Å; W119-R168 HydrophobicContact CD2-CG 4.1Å; W119-R168 HydrophobicContact CE3-CB 3.83Å; W119-R168 HydrophobicContact CE3-CG 4.24Å; W119-R168 HydrophobicContact CH2-CB 3.95Å; W119-R168 HydrophobicContact CH2-CG 4.02Å; W119-R168 HydrophobicContact CZ2-CB 4.28Å; W119-R168 HydrophobicContact CZ2-CG 3.86Å; W119-R168 HydrophobicContact CZ3-CB 3.72Å; W119-R168 HydrophobicContact CZ3-CG 4.21Å; F122-R168 VanDerWaalsContact CE2-CZ 3.49Å; F122-R168 VanDerWaalsContact CZ-NH2 3.28Å; L124-R168 HydrophobicContact CD1-CB 3.94Å; L124-R168 HydrophobicContact CD2-CB 4.38Å; M153-R168 WeakPolarHBondContact CA-O 3.3Å; G154-R168 PolarHBondContact N-O 2.86Å; F158-R168 HydrophobicContact CB-CG 4.35Å; F158-R168 VanDerWaalsContact CB-CZ 3.41Å; F158-R168 HydrophobicContact CD1-CB 4.48Å; F158-R168 HydrophobicContact CD1-CG 3.47Å; F158-R168 VanDerWaalsContact CD1-CG 3.47Å; F158-R168 HydrophobicContact CE1-CG 3.91Å; F158-R168 HydrophobicContact CG-CG 3.97Å
169	A	96.8	Very high	86.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.7	176.8	0	0	0	0	0	112	W119 V151 K152 M153 Y187 A189 L248	W119-A169 WeakPolarHBondContact CZ3-O 3.49Å; V151-A169 HydrophobicContact CG1-CB 4Å; K152-A169 CarbonylContact O-C 3.48Å; K152-A169 VanDerWaalsContact O-CA 3.22Å; K152-A169 WeakPolarHBondContact O-CA 3.41Å; M153-A169 HydrophobicContact CB-CB 4.27Å; M153-A169 HydrophobicContact CG-CB 4.24Å; A169-Y187 WeakPolarHBondContact CA-O 3.15Å; A169-Y187 PolarHBondContact N-O 3.07Å; A169-Y187 PolarHBondContact O-N 3.28Å; A169-A189 HydrophobicContact CB-CB 4.25Å; A169-L248 HydrophobicContact CB-CD1 4.25Å
170	K	95.5	Very high	86.3	Confident	1 Å²	1	63.6 Å²	63.6	0%	0.004	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	145.3	160.4	-73.6	-173	174.6	179.8	0	109.1	D117 L124 E125 V151 K152 W181 A184 S185 N186	D117-K170 WeakPolarHBondContact OD2-CE 3.41Å; D117-K170 IonicContact OD2-NZ 3.67Å; D117-K170 PolarHBondContact OD2-NZ 3.07Å; L124-K170 HydrophobicContact CB-CD 4.13Å; L124-K170 HydrophobicContact CB-CG 4.22Å; L124-K170 HydrophobicContact CD1-CG 4.14Å; E125-K170 IonicContact OE2-NZ 2.81Å; V151-K170 CarbonylContact C-O 3.56Å; V151-K170 WeakPolarHBondContact CA-O 3.48Å; K152-K170 PolarHBondContact N-O 3.38Å; K152-K170 PolarHBondContact O-N 3.08Å; K170-W181 HydrophobicContact CB-CE3 3.95Å; K170-W181 HydrophobicContact CB-CZ3 3.97Å; K170-W181 WeakPolarHBondContact CD-O 3.13Å; K170-W181 PolarHBondContact NZ-O 3.46Å; K170-W181 WeakPolarHBondContact O-CZ3 3.17Å; K170-A184 HydrophobicContact CB-CB 4.23Å; K170-A184 HydrophobicContact CD-CB 4.41Å; K170-S185 WeakPolarHBondContact CA-O 3.48Å; K170-N186 WeakPolarHBondContact CE-OD1 3.17Å; K170-N186 WeakPolarHBondContact CG-OD1 3.34Å
171	K	93.7	Very high	86.2	Confident	3 Å²	3	57 Å²	57	1%	0.013	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.3	171.4	-175.2	-153	171.2	-82.9	0	108.6	I149 N174 S185 Y187 D495	I149-K171 HydrophobicContact CD1-CG 4.37Å; K171-N174 PolarHBondContact NZ-OD1 3.42Å; K171-S185 PolarHBondContact N-O 3.33Å; K171-Y187 HydrophobicContact CB-CD2 3.63Å; K171-Y187 HydrophobicContact CB-CE2 3.55Å; K171-Y187 HydrophobicContact CB-CG 4.38Å; K171-Y187 HydrophobicContact CD-CE1 4.35Å; K171-Y187 HydrophobicContact CD-CE2 3.91Å; K171-Y187 HydrophobicContact CG-CE2 4.36Å; K171-D495 IonicContact NZ-OD1 2.69Å; K171-D495 IonicContact NZ-OD2 3.58Å; K171-D495 PolarHBondContact NZ-OD2 2.87Å
172	L	88.4	Confident	86.1	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.147	33%	0.329	C	S	.	.			trans	-67.9	144.3	167.9	-81	172	0	0	0	110.4	H150 W181 A184	H150-L172 PolarHBondContact O-N 2.89Å; L172-W181 HydrophobicContact CB-CH2 4.3Å; L172-W181 HydrophobicContact CB-CZ2 4.46Å; L172-W181 HydrophobicContact CD1-CD2 4.32Å; L172-W181 HydrophobicContact CD1-CH2 4.05Å; L172-W181 HydrophobicContact CD1-CZ2 3.38Å; L172-W181 HydrophobicContact CD2-CD2 4.33Å; L172-W181 HydrophobicContact CG-CD2 4.02Å; L172-W181 HydrophobicContact CG-CE3 4.15Å; L172-W181 HydrophobicContact CG-CH2 3.72Å; L172-W181 HydrophobicContact CG-CZ2 3.54Å; L172-W181 HydrophobicContact CG-CZ3 4.01Å; L172-A184 HydrophobicContact CD2-CB 4.16Å
173	S	83.3	Confident	86	Confident	51 Å²	51	59.5 Å²	59.5	36%	0.357	32%	0.316	S	S	.	.			trans	-68.1	133.9	169.9	176.9	0	0	0	0	109.5	F175 S176	S173-F175 PolarHBondContact O-N 3.42Å; S173-F175 VanDerWaalsContact O-N 3.09Å; S173-F175 PolarHBondContact OG-N 3.28Å; S173-S176 PolarHBondContact O-N 3.1Å
174	N	76.9	Confident	85.8	Confident	69 Å²	69	54.6 Å²	54.6	37%	0.369	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-5.8	176.5	-74.8	44.1	0	0	0	112.7	Q148 K171 D495	Q148-N174 PolarHBondContact O-ND2 2.93Å; K171-N174 PolarHBondContact NZ-OD1 3.42Å; N174-D495 PolarHBondContact N-OD2 3.23Å; N174-D495 VanDerWaalsContact N-OD2 3.07Å
175	F	70.8	Confident	85.6	Confident	104 Å²	104	55.7 Å²	55.7	46%	0.456	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-7.5	-174.3	-56.3	-85.6	0	0	0	113.6	S173 E493 D495	S173-F175 PolarHBondContact O-N 3.42Å; S173-F175 VanDerWaalsContact O-N 3.09Å; S173-F175 PolarHBondContact OG-N 3.28Å; F175-E493 WeakPolarHBondContact CE1-O 3.48Å; F175-E493 WeakPolarHBondContact CZ-O 3.46Å; F175-D495 HydrophobicContact CD2-CB 3.8Å; F175-D495 HydrophobicContact CE2-CB 3.54Å
176	S	67.9	Low	85.5	Confident	56 Å²	56	55.1 Å²	55.1	39%	0.392	31%	0.305	S	S	.	.			trans	-88.7	125.8	176	-169.9	0	0	0	0	110.6	S173 S178	S173-S176 PolarHBondContact O-N 3.1Å; S176-S178 PolarHBondContact O-N 3.04Å; S176-S178 PolarHBondContact OG-N 2.84Å; S176-S178 VanDerWaalsContact OG-N 3.13Å; S176-S178 PolarHBondContact OG-O 3.06Å; S176-S178 PolarHBondContact OG-OG 2.99Å
177	H	65.8	Low	85.5	Confident	201 Å²	201	54.9 Å²	54.9	93%	0.931	30%	0.301	S	S	*	.	S	Bend	trans	-73.5	-2.2	167.2	-61.6	-57.6	0	0	0	113.1
178	S	67.4	Low	85.5	Confident	62 Å²	62	55 Å²	55	43%	0.434	30%	0.303	S	S	.	.			trans	-100.7	117	173.9	68	0	0	0	0	112.1	S176 N180	S176-S178 PolarHBondContact O-N 3.04Å; S176-S178 PolarHBondContact OG-N 2.84Å; S176-S178 VanDerWaalsContact OG-N 3.13Å; S176-S178 PolarHBondContact OG-O 3.06Å; S176-S178 PolarHBondContact OG-OG 2.99Å; S178-N180 PolarHBondContact O-N 3.37Å
179	S	77.2	Confident	85.5	Confident	97 Å²	97	52.3 Å²	52.3	68%	0.678	29%	0.292	S	S	*	.			trans	-74	30.4	173.3	-48.2	0	0	0	0	113.3	W181	S179-W181 PolarHBondContact O-N 3.24Å; S179-W181 VanDerWaalsContact O-N 3.11Å
180	N	86.5	Confident	85.6	Confident	79 Å²	79	52.4 Å²	52.4	42%	0.422	29%	0.293	S	S	.	.			trans	-82.2	93.1	-173.5	-178.1	7.9	0	0	0	111.6	S178 K182 S183 A184	S178-N180 PolarHBondContact O-N 3.37Å; N180-K182 PolarHBondContact O-N 2.91Å; N180-K182 PolarHBondContact OD1-N 3.01Å; N180-S183 WeakPolarHBondContact CB-OG 3.28Å; N180-S183 VanDerWaalsContact CG-OG 3.24Å; N180-S183 PolarHBondContact ND2-OG 2.9Å; N180-S183 VanDerWaalsContact ND2-OG 3.13Å; N180-S183 CarbonylContact O-C 3.59Å; N180-S183 PolarHBondContact O-N 3.03Å; N180-S183 VanDerWaalsContact O-N 3.07Å; N180-S183 PolarHBondContact O-OG 3.06Å; N180-A184 PolarHBondContact O-N 2.76Å
181	W	89.4	Confident	85.6	Confident	26 Å²	26	56.2 Å²	56.2	10%	0.098	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-59.1	-25	176.4	-73.4	103	0	0	0	115.1	E125 T129 H150 K152 K170 L172 S179 S183 A184	E125-W181 HydrophobicContact CB-CB 3.7Å; T129-W181 HydrophobicContact CG2-CH2 4.41Å; T129-W181 HydrophobicContact CG2-CZ2 3.61Å; H150-W181 HydrophobicContact CB-CH2 4.19Å; H150-W181 HydrophobicContact CB-CZ2 4.12Å; H150-W181 WeakPolarHBondContact O-CH2 3.5Å; K152-W181 HydrophobicContact CB-CE3 4.3Å; K152-W181 HydrophobicContact CB-CH2 4.47Å; K152-W181 HydrophobicContact CB-CZ3 4.08Å; K152-W181 HydrophobicContact CD-CD2 3.72Å; K152-W181 HydrophobicContact CD-CE3 3.93Å; K152-W181 HydrophobicContact CD-CG 4.07Å; K152-W181 HydrophobicContact CD-CZ2 4.39Å; K152-W181 HydrophobicContact CD-CZ3 4.34Å; K152-W181 HydrophobicContact CG-CD2 4.01Å; K152-W181 HydrophobicContact CG-CE3 3.85Å; K152-W181 HydrophobicContact CG-CH2 3.8Å; K152-W181 HydrophobicContact CG-CZ2 3.96Å; K152-W181 HydrophobicContact CG-CZ3 3.75Å; K170-W181 HydrophobicContact CB-CE3 3.95Å; K170-W181 HydrophobicContact CB-CZ3 3.97Å; K170-W181 WeakPolarHBondContact CD-O 3.13Å; K170-W181 PolarHBondContact NZ-O 3.46Å; K170-W181 WeakPolarHBondContact O-CZ3 3.17Å; L172-W181 HydrophobicContact CB-CH2 4.3Å; L172-W181 HydrophobicContact CB-CZ2 4.46Å; L172-W181 HydrophobicContact CD1-CD2 4.32Å; L172-W181 HydrophobicContact CD1-CH2 4.05Å; L172-W181 HydrophobicContact CD1-CZ2 3.38Å; L172-W181 HydrophobicContact CD2-CD2 4.33Å; L172-W181 HydrophobicContact CG-CD2 4.02Å; L172-W181 HydrophobicContact CG-CE3 4.15Å; L172-W181 HydrophobicContact CG-CH2 3.72Å; L172-W181 HydrophobicContact CG-CZ2 3.54Å; L172-W181 HydrophobicContact CG-CZ3 4.01Å; S179-W181 PolarHBondContact O-N 3.24Å; S179-W181 VanDerWaalsContact O-N 3.11Å; W181-S183 VanDerWaalsContact C-N 3.27Å; W181-S183 PolarHBondContact O-N 2.8Å; W181-A184 HydrophobicContact CE3-CB 3.86Å; W181-A184 HydrophobicContact CZ3-CB 4.37Å; W181-A184 WeakPolarHBondContact O-CB 3.47Å; W181-A184 PolarHBondContact O-N 3.19Å
182	K	86.6	Confident	85.8	Confident	123 Å²	123	57 Å²	57	54%	0.535	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-69.8	-27.7	175.8	-58.4	-165.3	-175.6	-105.7	0	111.9	E125 N180	E125-K182 HydrophobicContact CB-CG 4.02Å; E125-K182 HydrophobicContact CG-CD 4.4Å; E125-K182 HydrophobicContact CG-CG 3.87Å; E125-K182 WeakPolarHBondContact OE1-CE 3.22Å; E125-K182 IonicContact OE1-NZ 3.23Å; E125-K182 PolarHBondContact OE1-NZ 2.82Å; N180-K182 PolarHBondContact O-N 2.91Å; N180-K182 PolarHBondContact OD1-N 3.01Å
183	S	83.6	Confident	86.1	Confident	80 Å²	80	59.9 Å²	59.9	56%	0.559	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-100	5.6	172.7	54.6	0	0	0	0	114.5	N180 W181	N180-S183 WeakPolarHBondContact CB-OG 3.28Å; N180-S183 VanDerWaalsContact CG-OG 3.24Å; N180-S183 PolarHBondContact ND2-OG 2.9Å; N180-S183 VanDerWaalsContact ND2-OG 3.13Å; N180-S183 CarbonylContact O-C 3.59Å; N180-S183 PolarHBondContact O-N 3.03Å; N180-S183 VanDerWaalsContact O-N 3.07Å; N180-S183 PolarHBondContact O-OG 3.06Å; W181-S183 VanDerWaalsContact C-N 3.27Å; W181-S183 PolarHBondContact O-N 2.8Å
184	A	89.4	Confident	86.6	Confident	11 Å²	11	65.3 Å²	65.3	9%	0.091	34%	0.344	C	S	.	.	S	Bend	trans	-71.9	143.3	176.2	0	0	0	0	0	110.7	K170 L172 N180 W181	K170-A184 HydrophobicContact CB-CB 4.23Å; K170-A184 HydrophobicContact CD-CB 4.41Å; L172-A184 HydrophobicContact CD2-CB 4.16Å; N180-A184 PolarHBondContact O-N 2.76Å; W181-A184 HydrophobicContact CE3-CB 3.86Å; W181-A184 HydrophobicContact CZ3-CB 4.37Å; W181-A184 WeakPolarHBondContact O-CB 3.47Å; W181-A184 PolarHBondContact O-N 3.19Å
185	S	91	Very high	87.3	Confident	60 Å²	60	69 Å²	69	42%	0.42	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	144.7	-175.7	-56	0	0	0	0	112.1	K170 K171 Y187	K170-S185 WeakPolarHBondContact CA-O 3.48Å; K171-S185 PolarHBondContact N-O 3.33Å; S185-Y187 WeakPolarHBondContact O-CD2 3.41Å
186	N	94.7	Very high	88.5	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.118	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.6	174.8	-69.5	-29.3	0	0	0	111.4	D117 W119 K170 H250 Y251	D117-N186 PolarHBondContact OD1-ND2 2.88Å; W119-N186 HydrophobicContact CD2-CB 4.2Å; W119-N186 HydrophobicContact CE3-CB 3.6Å; W119-N186 VanDerWaalsContact CE3-CG 3.44Å; W119-N186 HydrophobicContact CH2-CB 4.44Å; W119-N186 HydrophobicContact CZ3-CB 3.73Å; K170-N186 WeakPolarHBondContact CE-OD1 3.17Å; K170-N186 WeakPolarHBondContact CG-OD1 3.34Å; N186-H250 PolarHBondContact O-ND1 3.45Å; N186-Y251 HydrophobicContact CB-CD1 4.36Å; N186-Y251 HydrophobicContact CB-CG 4.46Å; N186-Y251 PolarHBondContact O-N 3.23Å
187	Y	96.6	Very high	89.8	Confident	17 Å²	17	69.9 Å²	69.9	7%	0.067	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	145.1	-179.4	-78.5	-103.7	0	0	0	110.3	W119 A169 K171 S185 L248 E249 H250	W119-Y187 VanDerWaalsContact CH2-O 3.22Å; W119-Y187 WeakPolarHBondContact CH2-O 3.45Å; W119-Y187 WeakPolarHBondContact CZ3-O 3.48Å; A169-Y187 WeakPolarHBondContact CA-O 3.15Å; A169-Y187 PolarHBondContact N-O 3.07Å; A169-Y187 PolarHBondContact O-N 3.28Å; K171-Y187 HydrophobicContact CB-CD2 3.63Å; K171-Y187 HydrophobicContact CB-CE2 3.55Å; K171-Y187 HydrophobicContact CB-CG 4.38Å; K171-Y187 HydrophobicContact CD-CE1 4.35Å; K171-Y187 HydrophobicContact CD-CE2 3.91Å; K171-Y187 HydrophobicContact CG-CE2 4.36Å; S185-Y187 WeakPolarHBondContact O-CD2 3.41Å; Y187-L248 HydrophobicContact CD1-CD1 4.3Å; Y187-L248 HydrophobicContact CD1-CD2 3.82Å; Y187-L248 HydrophobicContact CD1-CG 3.68Å; Y187-L248 HydrophobicContact CE1-CD2 4.21Å; Y187-L248 HydrophobicContact CE1-CG 4.42Å; Y187-L248 HydrophobicContact CG-CD1 4.34Å; Y187-L248 HydrophobicContact CG-CD2 4.27Å; Y187-L248 HydrophobicContact CG-CG 4.19Å; Y187-E249 CarbonylContact C-O 3.55Å; Y187-E249 WeakPolarHBondContact CA-O 3.44Å; Y187-E249 VanDerWaalsContact CB-O 3.28Å; Y187-E249 WeakPolarHBondContact CB-O 3.1Å; Y187-E249 VanDerWaalsContact CD1-C 3.4Å; Y187-E249 WeakPolarHBondContact CD1-O 3.27Å; Y187-H250 AromaticContact CE1-CD2 3.96Å; Y187-H250 AromaticContact CE1-NE2 3.97Å; Y187-H250 AromaticContact CE2-CE1 3.38Å; Y187-H250 WeakPolarHBondContact CE2-CE1 3.23Å; Y187-H250 AromaticContact CE2-ND1 3.67Å; Y187-H250 AromaticContact CE2-NE2 3.97Å; Y187-H250 AromaticContact CZ-CD2 3.91Å; Y187-H250 AromaticContact CZ-CE1 3.33Å; Y187-H250 AromaticContact CZ-ND1 3.72Å; Y187-H250 AromaticContact CZ-NE2 3.43Å; Y187-H250 PolarHBondContact OH-CE1 3.29Å; Y187-H250 PolarHBondContact OH-NE2 3.36Å; Y187-H250 VanDerWaalsContact OH-NE2 3.13Å
188	V	97.3	Very high	91.2	Very high	8 Å²	8	64.6 Å²	64.6	5%	0.048	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126	167	-179.1	0	0	0	0	108.2	W119 F158 C166 K190 E249 Y251	W119-V188 HydrophobicContact CH2-CG2 4.12Å; W119-V188 HydrophobicContact CZ2-CG2 4.47Å; F158-V188 HydrophobicContact CE1-CG1 4.14Å; F158-V188 HydrophobicContact CE1-CG2 4.29Å; F158-V188 HydrophobicContact CZ-CG1 4.26Å; F158-V188 HydrophobicContact CZ-CG2 3.93Å; C166-V188 HydrophobicContact CB-CG1 3.81Å; V188-K190 HydrophobicContact CG1-CG 4Å; V188-E249 HydrophobicContact CB-CG 3.92Å; V188-E249 PolarHBondContact N-O 3.43Å; V188-E249 PolarHBondContact O-N 2.97Å; V188-Y251 HydrophobicContact CG2-CD2 4.04Å
189	A	97.8	Very high	92.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126	169.7	0	0	0	0	0	109.2	M153 C166 F167 A169 F246 H247 L248	M153-A189 HydrophobicContact SD-CB 3.46Å; M153-A189 WeakPolarHBondContact SD-CB 3.46Å; C166-A189 CarbonylContact C-O 3.59Å; F167-A189 HydrophobicContact CB-CB 4.33Å; F167-A189 PolarHBondContact N-O 3.34Å; F167-A189 PolarHBondContact O-N 2.98Å; A169-A189 HydrophobicContact CB-CB 4.25Å; A189-F246 HydrophobicContact CB-CB 4.44Å; A189-F246 HydrophobicContact CB-CD1 4.18Å; A189-H247 CarbonylContact C-O 3.59Å; A189-H247 VanDerWaalsContact CA-O 3.23Å; A189-H247 WeakPolarHBondContact CA-O 3.18Å; A189-L248 HydrophobicContact CB-CD1 3.85Å
190	K	97.8	Very high	93.3	Very high	3 Å²	3	65.1 Å²	65.1	1%	0.013	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	146.5	-178.9	-42.5	177.3	-170.9	171.9	0	110.5	E165 V188 F246 H247 E249 D304	E165-K190 VanDerWaalsContact O-CA 3.26Å; E165-K190 WeakPolarHBondContact O-CA 3.22Å; V188-K190 HydrophobicContact CG1-CG 4Å; K190-F246 CarbonylContact O-C 3.57Å; K190-F246 WeakPolarHBondContact O-CA 3.45Å; K190-F246 WeakPolarHBondContact O-CB 3.48Å; K190-H247 HydrophobicContact CB-CB 4.2Å; K190-H247 PolarHBondContact N-O 3.3Å; K190-H247 PolarHBondContact O-N 2.97Å; K190-E249 WeakPolarHBondContact CE-OE1 3.23Å; K190-E249 IonicContact NZ-OE1 2.6Å; K190-E249 PolarHBondContact NZ-OE1 2.8Å; K190-E249 IonicContact NZ-OE2 3.03Å; K190-E249 PolarHBondContact NZ-OE2 3.06Å; K190-D304 IonicContact NZ-OD1 2.72Å; K190-D304 PolarHBondContact NZ-OD1 3.29Å; K190-D304 IonicContact NZ-OD2 2.77Å; K190-D304 PolarHBondContact NZ-OD2 3.15Å
191	R	96.1	Very high	93.8	Very high	80 Å²	80	62.5 Å²	62.5	30%	0.302	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	160.3	165.3	64.6	172.3	174.8	-158.7	-3.6	110.5	R164 E165 F167 F246	R164-R191 CarbonylContact C-O 3.49Å; R164-R191 WeakPolarHBondContact CA-O 3.32Å; R164-R191 WeakPolarHBondContact CB-O 3.38Å; E165-R191 HydrophobicContact CG-CG 4.09Å; E165-R191 PolarHBondContact N-O 3.29Å; E165-R191 PolarHBondContact O-N 3.42Å; E165-R191 VanDerWaalsContact O-N 3.12Å; E165-R191 IonicContact OE1-CZ 2.82Å; E165-R191 IonicContact OE1-NE 3.22Å; E165-R191 PolarHBondContact OE1-NE 2.81Å; E165-R191 IonicContact OE1-NH2 3.43Å; E165-R191 PolarHBondContact OE1-NH2 2.78Å; F167-R191 HydrophobicContact CE2-CG 4.2Å; R191-F246 HydrophobicContact CB-CD1 3.9Å; R191-F246 HydrophobicContact CB-CE1 4Å; R191-F246 HydrophobicContact CB-CG 4.49Å; R191-F246 HydrophobicContact CG-CD1 4.19Å; R191-F246 HydrophobicContact CG-CE1 3.81Å; R191-F246 HydrophobicContact CG-CZ 4.45Å
192	Y	96.8	Very high	94.2	Very high	20 Å²	20	62.5 Å²	62.5	8%	0.078	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	145.8	172.4	-66.9	-93.5	0	0	0	111.2	M163 R164 E194 V196 V200 Y201 D204 H247	M163-Y192 HydrophobicContact CB-CD1 4.04Å; M163-Y192 HydrophobicContact CB-CE1 4.24Å; M163-Y192 HydrophobicContact CE-CE1 4.19Å; M163-Y192 WeakPolarHBondContact O-CA 3.3Å; R164-Y192 HydrophobicContact CG-CD1 3.67Å; R164-Y192 HydrophobicContact CG-CD2 4.19Å; R164-Y192 HydrophobicContact CG-CE1 3.79Å; R164-Y192 HydrophobicContact CG-CE2 4.31Å; R164-Y192 HydrophobicContact CG-CG 3.88Å; Y192-E194 VanDerWaalsContact C-N 3.3Å; Y192-E194 VanDerWaalsContact CB-O 3.29Å; Y192-E194 WeakPolarHBondContact CB-O 3.46Å; Y192-V196 HydrophobicContact CD1-CG1 4.03Å; Y192-V196 HydrophobicContact CD1-CG2 4.43Å; Y192-V196 HydrophobicContact CD2-CG1 4.44Å; Y192-V196 HydrophobicContact CD2-CG2 3.4Å; Y192-V196 HydrophobicContact CE2-CG2 3.8Å; Y192-V196 HydrophobicContact CG-CG1 3.97Å; Y192-V196 HydrophobicContact CG-CG2 3.75Å; Y192-V200 HydrophobicContact CE2-CG1 4.25Å; Y192-V200 WeakPolarHBondContact OH-CG1 3.22Å; Y192-Y201 HydrophobicContact CD2-CE1 4.06Å; Y192-Y201 AromaticContact CD2-CE2 3.89Å; Y192-Y201 HydrophobicContact CD2-CE2 3.89Å; Y192-Y201 AromaticContact CD2-CZ 3.63Å; Y192-Y201 HydrophobicContact CE2-CD1 4.5Å; Y192-Y201 HydrophobicContact CE2-CD2 4.45Å; Y192-Y201 HydrophobicContact CE2-CE1 4.32Å; Y192-Y201 HydrophobicContact CE2-CE2 4.27Å; Y192-Y201 PolarHBondContact N-OH 2.96Å; Y192-D204 VanDerWaalsContact OH-CG 3.28Å; Y192-D204 PolarHBondContact OH-OD1 2.96Å; Y192-D204 PolarHBondContact OH-OD2 3.45Å; Y192-D204 VanDerWaalsContact OH-OD2 3.06Å; Y192-H247 AromaticContact CE2-CE1 3.9Å
193	M	94.7	Very high	94.6	Very high	88 Å²	88	59.7 Å²	59.7	43%	0.433	31%	0.31	S	S	.	.	S	Bend	trans	-77.6	-21.2	174.1	-66.9	-177.8	-74.2	0	0	111.9	K160 A162 M163 E165	K160-M193 HydrophobicContact CB-SD 4.34Å; K160-M193 HydrophobicContact CD-SD 4.21Å; A162-M193 WeakPolarHBondContact O-CE 3.3Å; M163-M193 PolarHBondContact O-N 2.96Å; E165-M193 HydrophobicContact CB-CG 4.07Å; E165-M193 HydrophobicContact CB-SD 4.45Å; E165-M193 HydrophobicContact CG-CG 3.97Å
194	E	93.9	Very high	95.2	Very high	165 Å²	165	57.5 Å²	57.5	77%	0.771	29%	0.292	S	S	*	.	S	Bend	trans	-111.8	163.3	174.4	-66.1	177.5	-171.8	0	0	110.5	Y192 V196	Y192-E194 VanDerWaalsContact C-N 3.3Å; Y192-E194 VanDerWaalsContact CB-O 3.29Å; Y192-E194 WeakPolarHBondContact CB-O 3.46Å; E194-V196 PolarHBondContact O-N 2.76Å
195	T	92.9	Very high	95.5	Very high	148 Å²	148	57 Å²	57	91%	0.908	29%	0.287	S	S	*	.			trans	-76.4	116.4	177.1	48.6	0	0	0	0	110.7
196	V	94.8	Very high	95.7	Very high	54 Å²	54	59.4 Å²	59.4	33%	0.327	29%	0.287	S	S	.	.			trans	-118.3	158.8	173.4	-56.8	0	0	0	0	110.6	Y192 E194 V200 Y201	Y192-V196 HydrophobicContact CD1-CG1 4.03Å; Y192-V196 HydrophobicContact CD1-CG2 4.43Å; Y192-V196 HydrophobicContact CD2-CG1 4.44Å; Y192-V196 HydrophobicContact CD2-CG2 3.4Å; Y192-V196 HydrophobicContact CE2-CG2 3.8Å; Y192-V196 HydrophobicContact CG-CG1 3.97Å; Y192-V196 HydrophobicContact CG-CG2 3.75Å; E194-V196 PolarHBondContact O-N 2.76Å; V196-V200 HydrophobicContact CB-CB 4.48Å; V196-V200 HydrophobicContact CB-CG2 4.33Å; V196-V200 HydrophobicContact CG2-CB 4.25Å; V196-Y201 HydrophobicContact CG2-CD2 4.16Å; V196-Y201 HydrophobicContact CG2-CE2 3.67Å
197	D	95.2	Very high	95.8	Very high	124 Å²	124	58.7 Å²	58.7	66%	0.663	28%	0.283	S	S	*	.			trans	-63.5	155.8	175.5	-73.3	-44.1	0	0	0	112.6	E199 V200	D197-E199 PolarHBondContact O-N 2.96Å; D197-V200 HydrophobicContact CB-CG2 4.36Å; D197-V200 PolarHBondContact O-N 3.36Å
198	R	95.8	Very high	95.8	Very high	89 Å²	89	58 Å²	58	34%	0.336	28%	0.281	S	S	.	.	H	α-helix	trans	-58.4	-40.7	-177.3	166.9	163.8	-166.2	116.9	-3.3	111.4	Y135 V200 Y201 F202 E236 L245	Y135-R198 PolarHBondContact OH-NH2 2.87Å; R198-V200 PolarHBondContact O-N 2.73Å; R198-Y201 WeakPolarHBondContact O-CB 3.44Å; R198-Y201 PolarHBondContact O-N 3.01Å; R198-Y201 VanDerWaalsContact O-N 3.15Å; R198-F202 HydrophobicContact CG-CD2 4.24Å; R198-F202 HydrophobicContact CG-CE2 3.94Å; R198-F202 WeakPolarHBondContact O-CD2 3.47Å; R198-E236 IonicContact CZ-OE2 3.9Å; R198-E236 VanDerWaalsContact CZ-OE2 3.22Å; R198-E236 IonicContact NH1-OE2 3.43Å; R198-E236 PolarHBondContact NH1-OE2 3.27Å; R198-E236 IonicContact NH2-OE2 3.62Å; R198-E236 PolarHBondContact NH2-OE2 3.5Å; R198-L245 HydrophobicContact CB-CD1 4.43Å; R198-L245 HydrophobicContact CG-CD1 3.85Å
199	E	94.8	Very high	95.8	Very high	124 Å²	124	58.6 Å²	58.6	58%	0.579	28%	0.283	S	S	*	.	H	α-helix	trans	-61.9	-33.5	-172.5	-74.2	51.3	-122.1	0	0	111.7	D197 Y201 F202 E203	D197-E199 PolarHBondContact O-N 2.96Å; E199-Y201 VanDerWaalsContact C-N 3.31Å; E199-Y201 PolarHBondContact O-N 3.16Å; E199-F202 WeakPolarHBondContact O-CA 3.49Å; E199-F202 WeakPolarHBondContact O-CB 3.39Å; E199-F202 PolarHBondContact O-N 3.48Å; E199-E203 PolarHBondContact O-N 2.92Å
200	V	94.9	Very high	95.5	Very high	47 Å²	47	59.5 Å²	59.5	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-41.6	176.8	-172.4	0	0	0	0	111.4	Y192 V196 D197 R198 F202 E203 D204	Y192-V200 HydrophobicContact CE2-CG1 4.25Å; Y192-V200 WeakPolarHBondContact OH-CG1 3.22Å; V196-V200 HydrophobicContact CB-CB 4.48Å; V196-V200 HydrophobicContact CB-CG2 4.33Å; V196-V200 HydrophobicContact CG2-CB 4.25Å; D197-V200 HydrophobicContact CB-CG2 4.36Å; D197-V200 PolarHBondContact O-N 3.36Å; R198-V200 PolarHBondContact O-N 2.73Å; V200-F202 PolarHBondContact O-N 2.96Å; V200-E203 PolarHBondContact O-N 3.4Å; V200-D204 PolarHBondContact O-N 3.48Å
201	Y	96.9	Very high	95.5	Very high	23 Å²	23	59.4 Å²	59.4	9%	0.09	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-34.6	176.3	-77.2	-95.5	0	0	0	112.5	Y192 V196 R198 E199 V234 L245 H247	Y192-Y201 HydrophobicContact CD2-CE1 4.06Å; Y192-Y201 AromaticContact CD2-CE2 3.89Å; Y192-Y201 HydrophobicContact CD2-CE2 3.89Å; Y192-Y201 AromaticContact CD2-CZ 3.63Å; Y192-Y201 HydrophobicContact CE2-CD1 4.5Å; Y192-Y201 HydrophobicContact CE2-CD2 4.45Å; Y192-Y201 HydrophobicContact CE2-CE1 4.32Å; Y192-Y201 HydrophobicContact CE2-CE2 4.27Å; Y192-Y201 PolarHBondContact N-OH 2.96Å; V196-Y201 HydrophobicContact CG2-CD2 4.16Å; V196-Y201 HydrophobicContact CG2-CE2 3.67Å; R198-Y201 WeakPolarHBondContact O-CB 3.44Å; R198-Y201 PolarHBondContact O-N 3.01Å; R198-Y201 VanDerWaalsContact O-N 3.15Å; E199-Y201 VanDerWaalsContact C-N 3.31Å; E199-Y201 PolarHBondContact O-N 3.16Å; Y201-V234 WeakPolarHBondContact O-CG2 3.43Å; Y201-L245 HydrophobicContact CD1-CB 3.79Å; Y201-L245 HydrophobicContact CD2-CB 4.03Å; Y201-L245 HydrophobicContact CD2-CD1 4.01Å; Y201-L245 HydrophobicContact CE1-CB 3.86Å; Y201-L245 WeakPolarHBondContact CE1-O 3.36Å; Y201-L245 HydrophobicContact CE2-CB 4.09Å; Y201-L245 HydrophobicContact CG-CB 3.88Å; Y201-L245 HydrophobicContact CG-CD1 4.01Å; Y201-L245 PolarHBondContact OH-O 3.25Å; Y201-H247 WeakPolarHBondContact CA-NE2 3.15Å; Y201-H247 AromaticContact CD1-CE1 3.55Å; Y201-H247 AromaticContact CD1-ND1 3.86Å; Y201-H247 AromaticContact CD1-NE2 3.71Å; Y201-H247 PolarHBondContact O-NE2 2.72Å
202	F	96.5	Very high	95.5	Very high	27 Å²	27	56.7 Å²	56.7	12%	0.118	28%	0.278	C	S	.	.	H	α-helix	trans	-79.9	-32.3	179.6	-72.5	-106.4	0	0	0	111.4	Y135 W144 R198 E199 V200 V205 R206 V234 L245	Y135-F202 HydrophobicContact CD1-CE1 4.05Å; Y135-F202 HydrophobicContact CD1-CZ 4.26Å; Y135-F202 HydrophobicContact CD2-CE1 4.14Å; Y135-F202 AromaticContact CD2-CZ 3.75Å; Y135-F202 HydrophobicContact CD2-CZ 3.75Å; Y135-F202 HydrophobicContact CE2-CZ 4.07Å; Y135-F202 AromaticContact CG-CE1 3.75Å; Y135-F202 HydrophobicContact CG-CE1 3.75Å; Y135-F202 AromaticContact CG-CZ 3.85Å; Y135-F202 HydrophobicContact CG-CZ 3.85Å; W144-F202 HydrophobicContact CD2-CD1 4.18Å; W144-F202 AromaticContact CE3-CD1 3.92Å; W144-F202 HydrophobicContact CE3-CD1 3.92Å; W144-F202 HydrophobicContact CE3-CE1 4.15Å; W144-F202 HydrophobicContact CH2-CB 3.85Å; W144-F202 AromaticContact CH2-CD1 3.39Å; W144-F202 HydrophobicContact CH2-CD1 3.39Å; W144-F202 HydrophobicContact CH2-CE1 4.26Å; W144-F202 AromaticContact CH2-CG 3.96Å; W144-F202 HydrophobicContact CH2-CG 3.96Å; W144-F202 HydrophobicContact CZ2-CB 3.84Å; W144-F202 AromaticContact CZ2-CD1 3.69Å; W144-F202 HydrophobicContact CZ2-CD1 3.69Å; W144-F202 HydrophobicContact CZ2-CG 4.24Å; W144-F202 WeakPolarHBondContact CZ2-O 3.4Å; W144-F202 AromaticContact CZ3-CD1 3.53Å; W144-F202 HydrophobicContact CZ3-CD1 3.53Å; W144-F202 AromaticContact CZ3-CE1 3.95Å; W144-F202 HydrophobicContact CZ3-CE1 3.95Å; W144-F202 HydrophobicContact CZ3-CG 4.45Å; R198-F202 HydrophobicContact CG-CD2 4.24Å; R198-F202 HydrophobicContact CG-CE2 3.94Å; R198-F202 WeakPolarHBondContact O-CD2 3.47Å; E199-F202 WeakPolarHBondContact O-CA 3.49Å; E199-F202 WeakPolarHBondContact O-CB 3.39Å; E199-F202 PolarHBondContact O-N 3.48Å; V200-F202 PolarHBondContact O-N 2.96Å; F202-V205 PolarHBondContact O-N 3.48Å; F202-R206 WeakPolarHBondContact O-CG 3.41Å; F202-R206 PolarHBondContact O-N 2.78Å; F202-R206 VanDerWaalsContact O-N 3.13Å; F202-V234 HydrophobicContact CD1-CG2 4.34Å; F202-V234 HydrophobicContact CD2-CG1 4.48Å; F202-V234 HydrophobicContact CD2-CG2 4.18Å; F202-V234 HydrophobicContact CE1-CG2 4.46Å; F202-V234 HydrophobicContact CE2-CB 4.4Å; F202-V234 HydrophobicContact CE2-CG1 3.93Å; F202-V234 HydrophobicContact CE2-CG2 4.3Å; F202-V234 HydrophobicContact CG-CG2 4.18Å; F202-V234 HydrophobicContact CZ-CB 4.3Å; F202-V234 HydrophobicContact CZ-CG1 4.15Å; F202-V234 HydrophobicContact CZ-CG2 4.43Å; F202-L245 HydrophobicContact CE2-CD1 3.98Å
203	E	94.6	Very high	95.3	Very high	64 Å²	64	56.2 Å²	56.2	30%	0.299	28%	0.276	S	S	.	.	H	α-helix	trans	-69.3	-44.7	175.3	-173.8	163.5	-160.2	0	0	112.6	E199 V200 V205 R206 L207 F315 G316	E199-E203 PolarHBondContact O-N 2.92Å; V200-E203 PolarHBondContact O-N 3.4Å; E203-V205 PolarHBondContact O-N 2.84Å; E203-R206 WeakPolarHBondContact O-CA 3.37Å; E203-R206 WeakPolarHBondContact O-CB 3.42Å; E203-R206 PolarHBondContact O-N 3.04Å; E203-L207 PolarHBondContact O-N 2.89Å; E203-F315 VanDerWaalsContact OE1-CA 3.26Å; E203-F315 WeakPolarHBondContact OE1-CA 3.11Å; E203-F315 PolarHBondContact OE1-N 3.35Å; E203-G316 PolarHBondContact OE1-N 2.77Å
204	D	96.1	Very high	95.3	Very high	33 Å²	33	52.3 Å²	52.3	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-49.2	-42.1	170.9	-108.1	24.3	0	0	0	112	R164 Y192 V200 Q208 M232 H247	R164-D204 IonicContact CZ-OD2 3.73Å; R164-D204 IonicContact NE-OD2 4Å; R164-D204 IonicContact NH1-OD2 2.73Å; R164-D204 PolarHBondContact NH1-OD2 3.07Å; Y192-D204 VanDerWaalsContact OH-CG 3.28Å; Y192-D204 PolarHBondContact OH-OD1 2.96Å; Y192-D204 PolarHBondContact OH-OD2 3.45Å; Y192-D204 VanDerWaalsContact OH-OD2 3.06Å; V200-D204 PolarHBondContact O-N 3.48Å; D204-Q208 PolarHBondContact O-N 3.12Å; D204-M232 HydrophobicContact CB-CE 4.02Å; D204-M232 WeakPolarHBondContact O-CE 3.36Å; D204-H247 WeakPolarHBondContact CB-NE2 3.39Å; D204-H247 IonicContact OD2-CE1 3.22Å; D204-H247 PolarHBondContact OD2-CE1 2.73Å; D204-H247 IonicContact OD2-ND1 3.73Å; D204-H247 IonicContact OD2-NE2 2.97Å; D204-H247 PolarHBondContact OD2-NE2 3.11Å
205	V	96.9	Very high	95.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-73	-34.6	178.5	167.1	0	0	0	0	112	W144 F202 E203 M209 M232 V234	W144-V205 HydrophobicContact CH2-CB 3.92Å; W144-V205 HydrophobicContact CH2-CG1 3.64Å; W144-V205 HydrophobicContact CZ3-CG1 4.04Å; F202-V205 PolarHBondContact O-N 3.48Å; E203-V205 PolarHBondContact O-N 2.84Å; V205-M209 HydrophobicContact CG1-CG 4.42Å; V205-M209 WeakPolarHBondContact O-CB 3.2Å; V205-M209 WeakPolarHBondContact O-CG 3.45Å; V205-M209 PolarHBondContact O-N 2.94Å; V205-M209 VanDerWaalsContact O-N 3.15Å; V205-M232 HydrophobicContact CG2-CB 4.39Å; V205-M232 HydrophobicContact CG2-CE 3.85Å; V205-M232 HydrophobicContact CG2-CG 4.04Å; V205-V234 HydrophobicContact CB-CG2 4.4Å; V205-V234 HydrophobicContact CG2-CG2 3.75Å
206	R	95.3	Very high	95.5	Very high	112 Å²	112	39.8 Å²	39.8	42%	0.423	19%	0.188	S	C	.	.	H	α-helix	trans	-64	-48.1	171.8	-66.8	170.6	-166.4	-178	2.8	110.6	Y137 W144 F202 E203 Q208 M209 E210	Y137-R206 HydrophobicContact CD1-CB 4.18Å; Y137-R206 HydrophobicContact CD1-CG 3.88Å; Y137-R206 HydrophobicContact CD2-CG 4.26Å; Y137-R206 HydrophobicContact CE1-CB 3.96Å; Y137-R206 HydrophobicContact CE1-CG 3.8Å; Y137-R206 HydrophobicContact CE2-CG 4.18Å; Y137-R206 HydrophobicContact CG-CG 4.11Å; W144-R206 HydrophobicContact CZ2-CG 3.93Å; F202-R206 WeakPolarHBondContact O-CG 3.41Å; F202-R206 PolarHBondContact O-N 2.78Å; F202-R206 VanDerWaalsContact O-N 3.13Å; E203-R206 WeakPolarHBondContact O-CA 3.37Å; E203-R206 WeakPolarHBondContact O-CB 3.42Å; E203-R206 PolarHBondContact O-N 3.04Å; R206-Q208 PolarHBondContact O-N 3.11Å; R206-M209 PolarHBondContact O-N 3.23Å; R206-E210 WeakPolarHBondContact O-CB 3.26Å; R206-E210 WeakPolarHBondContact O-CG 3.35Å; R206-E210 PolarHBondContact O-N 3.5Å
207	L	95.5	Very high	95.3	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-51.9	-58.1	176.9	-167.9	178.2	0	0	0	110.6	E203 M209 E210 A211 P305 I307 F315	E203-L207 PolarHBondContact O-N 2.89Å; L207-M209 VanDerWaalsContact C-N 3.33Å; L207-M209 PolarHBondContact O-N 3.16Å; L207-E210 PolarHBondContact O-N 3.12Å; L207-A211 WeakPolarHBondContact O-CB 3.25Å; L207-A211 PolarHBondContact O-N 3.36Å; L207-P305 HydrophobicContact CD2-CG 4.02Å; L207-P305 WeakPolarHBondContact CD2-O 3.26Å; L207-I307 HydrophobicContact CD2-CB 4.46Å; L207-I307 HydrophobicContact CD2-CD1 4.02Å; L207-I307 HydrophobicContact CD2-CG1 3.78Å; L207-I307 HydrophobicContact CG-CB 4.44Å; L207-I307 HydrophobicContact CG-CD1 4.19Å; L207-I307 HydrophobicContact CG-CG1 4.15Å; L207-F315 HydrophobicContact CB-CB 4.4Å; L207-F315 HydrophobicContact CB-CD1 3.73Å; L207-F315 HydrophobicContact CB-CE1 4.49Å; L207-F315 HydrophobicContact CB-CG 4.45Å; L207-F315 HydrophobicContact CD1-CB 3.89Å; L207-F315 HydrophobicContact CG-CB 3.92Å; L207-F315 HydrophobicContact CG-CD1 3.91Å; L207-F315 HydrophobicContact CG-CG 4.18Å
208	Q	97.4	Very high	95.3	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-35	-174.6	-176	156.9	-37.7	0	0	113	D204 R206 K212 I229 M230 M232 T303 D304 P305	D204-Q208 PolarHBondContact O-N 3.12Å; R206-Q208 PolarHBondContact O-N 3.11Å; Q208-K212 PolarHBondContact O-N 3.01Å; Q208-I229 HydrophobicContact CG-CG2 3.88Å; Q208-M230 PolarHBondContact NE2-O 2.72Å; Q208-M232 HydrophobicContact CB-CE 3.99Å; Q208-M232 HydrophobicContact CG-CB 4.43Å; Q208-T303 PolarHBondContact NE2-OG1 3Å; Q208-T303 PolarHBondContact OE1-OG1 2.81Å; Q208-D304 VanDerWaalsContact OE1-N 3.11Å; Q208-P305 HydrophobicContact CG-CG 4.36Å
209	M	96.4	Very high	95.2	Very high	21 Å²	21	29.5 Å²	29.5	10%	0.103	14%	0.137	C	C	.	.	H	α-helix	trans	-76	-32.7	177.1	-66.7	-62	-67.3	0	0	113	Y137 A139 V205 R206 L207 K212 L213 Q231	Y137-M209 HydrophobicContact CD1-CB 3.96Å; Y137-M209 HydrophobicContact CD1-CG 4.47Å; A139-M209 HydrophobicContact CB-CB 4.08Å; V205-M209 HydrophobicContact CG1-CG 4.42Å; V205-M209 WeakPolarHBondContact O-CB 3.2Å; V205-M209 WeakPolarHBondContact O-CG 3.45Å; V205-M209 PolarHBondContact O-N 2.94Å; V205-M209 VanDerWaalsContact O-N 3.15Å; R206-M209 PolarHBondContact O-N 3.23Å; L207-M209 VanDerWaalsContact C-N 3.33Å; L207-M209 PolarHBondContact O-N 3.16Å; M209-K212 HydrophobicContact CE-CD 4.49Å; M209-K212 WeakPolarHBondContact O-CB 3.41Å; M209-K212 PolarHBondContact O-N 3.04Å; M209-K212 HydrophobicContact SD-CD 4.49Å; M209-L213 PolarHBondContact O-N 3.38Å; M209-Q231 HydrophobicContact CE-CG 4.09Å; M209-Q231 HydrophobicContact SD-CB 4.11Å; M209-Q231 HydrophobicContact SD-CG 3.98Å
210	E	93.4	Very high	95	Very high	19 Å²	19	28.1 Å²	28.1	9%	0.089	13%	0.127	C	C	.	.	H	α-helix	trans	-65.4	-44.4	169.3	-79	-67	167.9	0	0	111.6	A139 R206 L207 K212 L213 W214 I307 F315 R544	A139-E210 HydrophobicContact CB-CG 4.3Å; R206-E210 WeakPolarHBondContact O-CB 3.26Å; R206-E210 WeakPolarHBondContact O-CG 3.35Å; R206-E210 PolarHBondContact O-N 3.5Å; L207-E210 PolarHBondContact O-N 3.12Å; E210-K212 PolarHBondContact O-N 3.38Å; E210-L213 PolarHBondContact O-N 3.33Å; E210-L213 VanDerWaalsContact O-N 3.12Å; E210-W214 VanDerWaalsContact O-CD1 3.31Å; E210-W214 PolarHBondContact O-N 2.88Å; E210-I307 HydrophobicContact CB-CD1 4.06Å; E210-F315 HydrophobicContact CG-CE1 4.34Å; E210-R544 IonicContact OE1-NH2 2.77Å; E210-R544 IonicContact OE2-CZ 2.69Å; E210-R544 VanDerWaalsContact OE2-CZ 3.22Å; E210-R544 IonicContact OE2-NH1 3.84Å; E210-R544 PolarHBondContact OE2-NH1 2.73Å; E210-R544 IonicContact OE2-NH2 2.8Å; E210-R544 PolarHBondContact OE2-NH2 3.35Å
211	A	96.2	Very high	94.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.5	-33.9	174.4	0	0	0	0	0	112.1	L207 L213 W214 G215 I229 V292 P305 I307	L207-A211 WeakPolarHBondContact O-CB 3.25Å; L207-A211 PolarHBondContact O-N 3.36Å; A211-L213 PolarHBondContact O-N 3.03Å; A211-W214 WeakPolarHBondContact O-CB 3.34Å; A211-W214 PolarHBondContact O-N 2.76Å; A211-G215 PolarHBondContact O-N 2.87Å; A211-I229 HydrophobicContact CB-CD1 3.7Å; A211-I229 WeakPolarHBondContact O-CD1 2.95Å; A211-V292 HydrophobicContact CB-CG1 3.89Å; A211-P305 HydrophobicContact CB-CB 4.16Å; A211-P305 HydrophobicContact CB-CG 3.6Å; A211-I307 HydrophobicContact CB-CD1 4.36Å
212	K	96.1	Very high	94.2	Very high	24 Å²	24	39 Å²	39	10%	0.104	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-42.3	172.9	-171.9	179.3	-179.1	63.4	0	112.5	Q208 M209 E210 W214 G215 E216 D228 I229 Q231	Q208-K212 PolarHBondContact O-N 3.01Å; M209-K212 HydrophobicContact CE-CD 4.49Å; M209-K212 WeakPolarHBondContact O-CB 3.41Å; M209-K212 PolarHBondContact O-N 3.04Å; M209-K212 HydrophobicContact SD-CD 4.49Å; E210-K212 PolarHBondContact O-N 3.38Å; K212-W214 VanDerWaalsContact C-N 3.27Å; K212-W214 PolarHBondContact O-N 2.78Å; K212-G215 WeakPolarHBondContact O-CA 3.41Å; K212-G215 PolarHBondContact O-N 2.68Å; K212-E216 PolarHBondContact O-N 2.71Å; K212-D228 IonicContact NZ-OD1 2.79Å; K212-D228 PolarHBondContact NZ-OD1 2.85Å; K212-D228 IonicContact NZ-OD2 3.93Å; K212-D228 PolarHBondContact NZ-OD2 2.8Å; K212-I229 HydrophobicContact CB-CB 4.13Å; K212-I229 WeakPolarHBondContact CD-O 3.13Å; K212-I229 HydrophobicContact CG-CB 4.45Å; K212-I229 PolarHBondContact NZ-O 3.4Å; K212-Q231 HydrophobicContact CD-CG 3.89Å
213	L	93.6	Very high	93.9	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.052	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-30.8	176.7	-62.1	-177.4	0	0	0	112.4	A139 I140 M209 E210 A211 E216 E217 F540	A139-L213 HydrophobicContact CB-CD1 3.54Å; A139-L213 HydrophobicContact CB-CG 4.17Å; I140-L213 HydrophobicContact CD1-CD2 4.07Å; I140-L213 HydrophobicContact CG1-CD1 4.12Å; I140-L213 HydrophobicContact CG1-CD2 3.94Å; M209-L213 PolarHBondContact O-N 3.38Å; E210-L213 PolarHBondContact O-N 3.33Å; E210-L213 VanDerWaalsContact O-N 3.12Å; A211-L213 PolarHBondContact O-N 3.03Å; L213-E216 PolarHBondContact O-N 3.26Å; L213-E217 PolarHBondContact O-N 3.37Å; L213-F540 HydrophobicContact CD1-CE1 3.55Å; L213-F540 HydrophobicContact CD1-CE2 4.44Å; L213-F540 HydrophobicContact CD1-CZ 3.48Å; L213-F540 VanDerWaalsContact CD1-CZ 3.48Å
214	W	95	Very high	93.5	Very high	5 Å²	5	35.6 Å²	35.6	2%	0.019	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-38	169.2	-74.5	107.8	0	0	0	112.7	E210 A211 K212 E216 E217 Y218 F278 T282 R285 L290 V292 R544	E210-W214 VanDerWaalsContact O-CD1 3.31Å; E210-W214 PolarHBondContact O-N 2.88Å; A211-W214 WeakPolarHBondContact O-CB 3.34Å; A211-W214 PolarHBondContact O-N 2.76Å; K212-W214 VanDerWaalsContact C-N 3.27Å; K212-W214 PolarHBondContact O-N 2.78Å; W214-E216 VanDerWaalsContact C-N 3.31Å; W214-E216 PolarHBondContact O-N 2.81Å; W214-E217 HydrophobicContact CE3-CB 4.47Å; W214-E217 HydrophobicContact CE3-CG 4.49Å; W214-E217 HydrophobicContact CZ3-CG 4.45Å; W214-E217 PolarHBondContact O-N 3.49Å; W214-Y218 WeakPolarHBondContact O-CB 3.26Å; W214-Y218 PolarHBondContact O-N 3.13Å; W214-F278 HydrophobicContact CB-CE2 4.36Å; W214-F278 HydrophobicContact CB-CZ 4.2Å; W214-T282 HydrophobicContact CB-CG2 3.8Å; W214-T282 HydrophobicContact CD2-CG2 4.18Å; W214-T282 HydrophobicContact CE3-CG2 4.09Å; W214-T282 HydrophobicContact CG-CG2 4.09Å; W214-R285 HydrophobicContact CZ3-CB 3.91Å; W214-L290 HydrophobicContact CD2-CD1 4.46Å; W214-L290 HydrophobicContact CZ2-CD1 4.04Å; W214-L290 HydrophobicContact CZ2-CD2 4.09Å; W214-L290 HydrophobicContact CZ2-CG 4.25Å; W214-V292 HydrophobicContact CB-CG2 4.12Å; W214-V292 HydrophobicContact CG-CG2 4.08Å; W214-R544 HydrophobicContact CH2-CB 4.25Å; W214-R544 HydrophobicContact CH2-CG 4.29Å; W214-R544 HydrophobicContact CZ2-CG 4.28Å
215	G	95.8	Very high	93.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.6	-41.2	169.5	0	0	0	0	0	112.7	A211 K212 N219	A211-G215 PolarHBondContact O-N 2.87Å; K212-G215 WeakPolarHBondContact O-CA 3.41Å; K212-G215 PolarHBondContact O-N 2.68Å; G215-N219 WeakPolarHBondContact O-CB 3.39Å; G215-N219 PolarHBondContact O-N 3.46Å; G215-N219 PolarHBondContact O-ND2 2.53Å
216	E	93.6	Very high	92.9	Very high	51 Å²	51	41.9 Å²	41.9	24%	0.238	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-44	172.7	-66	-166.7	-168.6	0	0	113.4	K212 L213 W214 Y218 N219 R220	K212-E216 PolarHBondContact O-N 2.71Å; L213-E216 PolarHBondContact O-N 3.26Å; W214-E216 VanDerWaalsContact C-N 3.31Å; W214-E216 PolarHBondContact O-N 2.81Å; E216-Y218 VanDerWaalsContact C-N 3.34Å; E216-Y218 PolarHBondContact O-N 2.82Å; E216-N219 CarbonylContact O-C 3.39Å; E216-N219 WeakPolarHBondContact O-CA 3.29Å; E216-N219 WeakPolarHBondContact O-CB 3.13Å; E216-N219 PolarHBondContact O-N 2.84Å; E216-N219 VanDerWaalsContact O-N 3.11Å; E216-R220 WeakPolarHBondContact O-CG 3.43Å; E216-R220 PolarHBondContact O-N 3.18Å; E216-R220 IonicContact OE2-CZ 2.84Å; E216-R220 IonicContact OE2-NH2 3.26Å; E216-R220 PolarHBondContact OE2-NH2 2.73Å
217	E	92.4	Very high	92.9	Very high	20 Å²	20	36.8 Å²	36.8	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-39.9	179.5	-179.5	58.2	-168.6	0	0	111.8	L213 W214 N219 R220 H221 F281 R285	L213-E217 PolarHBondContact O-N 3.37Å; W214-E217 HydrophobicContact CE3-CB 4.47Å; W214-E217 HydrophobicContact CE3-CG 4.49Å; W214-E217 HydrophobicContact CZ3-CG 4.45Å; W214-E217 PolarHBondContact O-N 3.49Å; E217-N219 VanDerWaalsContact C-N 3.35Å; E217-N219 PolarHBondContact O-N 3.34Å; E217-R220 PolarHBondContact O-N 3.15Å; E217-R220 WeakPolarHBondContact OE2-CD 3.04Å; E217-R220 IonicContact OE2-CZ 3.5Å; E217-R220 IonicContact OE2-NH1 2.71Å; E217-R220 PolarHBondContact OE2-NH1 2.92Å; E217-H221 PolarHBondContact O-ND1 3.06Å; E217-H221 IonicContact OE1-CE1 3.27Å; E217-H221 PolarHBondContact OE1-CE1 3.06Å; E217-H221 VanDerWaalsContact OE1-CE1 3.31Å; E217-F281 HydrophobicContact CB-CE1 4.43Å; E217-F281 HydrophobicContact CG-CE1 4.09Å; E217-F281 HydrophobicContact CG-CZ 4.05Å; E217-R285 IonicContact OE1-CZ 3.96Å; E217-R285 IonicContact OE1-NE 3.93Å; E217-R285 IonicContact OE1-NH2 3.73Å; E217-R285 PolarHBondContact OE1-NH2 2.95Å
218	Y	94.4	Very high	93	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.9	-46.7	169	179.8	-98	0	0	0	111.1	W214 E216 R220 H221 P223 V227 T274 F278 F281 M341	W214-Y218 WeakPolarHBondContact O-CB 3.26Å; W214-Y218 PolarHBondContact O-N 3.13Å; E216-Y218 VanDerWaalsContact C-N 3.34Å; E216-Y218 PolarHBondContact O-N 2.82Å; Y218-R220 VanDerWaalsContact C-N 3.31Å; Y218-R220 PolarHBondContact O-N 3Å; Y218-H221 PolarHBondContact O-N 2.73Å; Y218-H221 VanDerWaalsContact O-N 3.17Å; Y218-P223 HydrophobicContact CD1-CB 4.28Å; Y218-P223 HydrophobicContact CD1-CG 3.66Å; Y218-P223 HydrophobicContact CE1-CB 3.58Å; Y218-P223 HydrophobicContact CE1-CG 3.38Å; Y218-P223 HydrophobicContact CE2-CB 4.39Å; Y218-P223 HydrophobicContact CG-CG 4.45Å; Y218-P223 WeakPolarHBondContact O-CD 3.47Å; Y218-V227 HydrophobicContact CD1-CG1 4.26Å; Y218-V227 HydrophobicContact CD1-CG2 3.74Å; Y218-V227 HydrophobicContact CE1-CG1 3.89Å; Y218-V227 HydrophobicContact CE1-CG2 4.23Å; Y218-T274 HydrophobicContact CE1-CG2 4.08Å; Y218-T274 VanDerWaalsContact OH-CG2 3.31Å; Y218-T274 WeakPolarHBondContact OH-CG2 3.16Å; Y218-F278 HydrophobicContact CD1-CD2 4.15Å; Y218-F278 HydrophobicContact CD2-CB 4.32Å; Y218-F278 AromaticContact CD2-CD2 3.83Å; Y218-F278 HydrophobicContact CD2-CD2 3.83Å; Y218-F278 HydrophobicContact CE2-CB 4.13Å; Y218-F278 HydrophobicContact CE2-CD2 4.46Å; Y218-F278 AromaticContact CG-CD2 3.66Å; Y218-F278 HydrophobicContact CG-CD2 3.66Å; Y218-F278 HydrophobicContact CG-CE2 4.35Å; Y218-F281 VanDerWaalsContact CA-CZ 3.48Å; Y218-F281 HydrophobicContact CD2-CB 3.93Å; Y218-F281 AromaticContact CD2-CD1 3.78Å; Y218-F281 HydrophobicContact CD2-CD1 3.78Å; Y218-F281 HydrophobicContact CD2-CD2 4.13Å; Y218-F281 HydrophobicContact CD2-CE1 4.3Å; Y218-F281 AromaticContact CD2-CG 3.7Å; Y218-F281 HydrophobicContact CD2-CG 3.7Å; Y218-F281 HydrophobicContact CE2-CB 4.32Å; Y218-F281 HydrophobicContact CE2-CG 4.47Å; Y218-F281 HydrophobicContact CG-CD1 4.36Å; Y218-M341 HydrophobicContact CD2-CE 3.66Å; Y218-M341 HydrophobicContact CD2-SD 4.13Å; Y218-M341 HydrophobicContact CE2-CE 3.65Å; Y218-M341 HydrophobicContact CE2-SD 3.46Å; Y218-M341 WeakPolarHBondContact CE2-SD 3.32Å; Y218-M341 HydrophobicContact CG-CE 4.45Å
219	N	94	Very high	92.9	Very high	30 Å²	30	39.1 Å²	39.1	16%	0.16	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-29.7	178.2	-73.5	-23.3	0	0	0	114.5	G215 E216 E217 H221 R222 Q226 V227	G215-N219 WeakPolarHBondContact O-CB 3.39Å; G215-N219 PolarHBondContact O-N 3.46Å; G215-N219 PolarHBondContact O-ND2 2.53Å; E216-N219 CarbonylContact O-C 3.39Å; E216-N219 WeakPolarHBondContact O-CA 3.29Å; E216-N219 WeakPolarHBondContact O-CB 3.13Å; E216-N219 PolarHBondContact O-N 2.84Å; E216-N219 VanDerWaalsContact O-N 3.11Å; E217-N219 VanDerWaalsContact C-N 3.35Å; E217-N219 PolarHBondContact O-N 3.34Å; N219-H221 PolarHBondContact O-N 2.94Å; N219-R222 PolarHBondContact O-N 3.26Å; N219-Q226 HydrophobicContact CB-CG 4.44Å; N219-Q226 WeakPolarHBondContact OD1-CA 3.26Å; N219-Q226 WeakPolarHBondContact OD1-CB 3.44Å; N219-Q226 WeakPolarHBondContact OD1-CG 3.42Å; N219-V227 PolarHBondContact ND2-O 3.4Å; N219-V227 PolarHBondContact OD1-N 2.74Å; N219-V227 PolarHBondContact OD1-O 3.32Å
220	R	90.6	Very high	92.9	Very high	96 Å²	96	39.3 Å²	39.3	36%	0.362	17%	0.174	S	C	.	.	H	α-helix	trans	-64.9	-27.9	177.1	-70.1	166.4	-154.9	139.2	-2.3	112.2	E216 E217 Y218 R222 H541	E216-R220 WeakPolarHBondContact O-CG 3.43Å; E216-R220 PolarHBondContact O-N 3.18Å; E216-R220 IonicContact OE2-CZ 2.84Å; E216-R220 IonicContact OE2-NH2 3.26Å; E216-R220 PolarHBondContact OE2-NH2 2.73Å; E217-R220 PolarHBondContact O-N 3.15Å; E217-R220 WeakPolarHBondContact OE2-CD 3.04Å; E217-R220 IonicContact OE2-CZ 3.5Å; E217-R220 IonicContact OE2-NH1 2.71Å; E217-R220 PolarHBondContact OE2-NH1 2.92Å; Y218-R220 VanDerWaalsContact C-N 3.31Å; Y218-R220 PolarHBondContact O-N 3Å; R220-R222 PolarHBondContact O-N 2.86Å; R220-H541 PolarHBondContact NH1-CD2 3.37Å; R220-H541 PolarHBondContact NH1-NE2 3.04Å; R220-H541 PolarHBondContact NH2-NE2 3.4Å; R220-H541 VanDerWaalsContact NH2-NE2 3.12Å
221	H	88.1	Confident	93	Very high	77 Å²	77	42.2 Å²	42.2	36%	0.356	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	5.5	176.4	-68.2	74.7	0	0	0	114.2	E217 Y218 N219 F281 R285 M341	E217-H221 PolarHBondContact O-ND1 3.06Å; E217-H221 IonicContact OE1-CE1 3.27Å; E217-H221 PolarHBondContact OE1-CE1 3.06Å; E217-H221 VanDerWaalsContact OE1-CE1 3.31Å; Y218-H221 PolarHBondContact O-N 2.73Å; Y218-H221 VanDerWaalsContact O-N 3.17Å; N219-H221 PolarHBondContact O-N 2.94Å; H221-F281 HydrophobicContact CB-CE2 4.23Å; H221-F281 AromaticContact CE1-CZ 3.92Å; H221-F281 AromaticContact CG-CE2 3.72Å; H221-F281 AromaticContact ND1-CE2 3.63Å; H221-F281 AromaticContact ND1-CZ 3.47Å; H221-F281 WeakPolarHBondContact ND1-CZ 3.47Å; H221-R285 PolarHBondContact CE1-NH2 2.68Å; H221-R285 VanDerWaalsContact CE1-NH2 3.27Å; H221-R285 PolarHBondContact NE2-NH2 3.27Å; H221-M341 HydrophobicContact CB-CE 3.68Å
222	R	87.3	Confident	93	Very high	221 Å²	221	42.6 Å²	42.6	83%	0.834	19%	0.189	S	C	*	.			trans	53.7	49.1	177.7	-52.1	-178.1	-175.3	-177.2	2.5	114.5	N219 R220	N219-R222 PolarHBondContact O-N 3.26Å; R220-R222 PolarHBondContact O-N 2.86Å
223	P	89.3	Confident	93.1	Very high	4 Å²	4	42 Å²	42	3%	0.026	19%	0.187	C	C	.	.			trans	-59.2	156.1	177	28.7	-38.2	0	0	0	111.5	Y218 K225 M341	Y218-P223 HydrophobicContact CD1-CB 4.28Å; Y218-P223 HydrophobicContact CD1-CG 3.66Å; Y218-P223 HydrophobicContact CE1-CB 3.58Å; Y218-P223 HydrophobicContact CE1-CG 3.38Å; Y218-P223 HydrophobicContact CE2-CB 4.39Å; Y218-P223 HydrophobicContact CG-CG 4.45Å; Y218-P223 WeakPolarHBondContact O-CD 3.47Å; P223-K225 WeakPolarHBondContact CB-O 3.49Å; P223-K225 VanDerWaalsContact CG-O 3.29Å; P223-K225 WeakPolarHBondContact CG-O 3.36Å; P223-K225 PolarHBondContact O-N 2.88Å; P223-K225 VanDerWaalsContact O-N 3.12Å; P223-M341 HydrophobicContact CB-CE 4.39Å; P223-M341 HydrophobicContact CB-SD 4.11Å
224	P	86	Confident	93.3	Very high	16 Å²	16	41.5 Å²	41.5	10%	0.104	19%	0.185	C	C	.	.	S	Bend	trans	-52.9	-36.6	179.7	-29.1	36.4	0	0	0	114	I337 L370	P224-I337 HydrophobicContact CG-CG1 4.32Å; P224-L370 HydrophobicContact CB-CD2 4.25Å; P224-L370 HydrophobicContact CG-CD2 3.46Å; P224-L370 VanDerWaalsContact CG-CD2 3.46Å
225	K	87.5	Confident	93.5	Very high	74 Å²	74	41.3 Å²	41.3	32%	0.322	18%	0.184	S	C	.	.	S	Bend	trans	-123	130	168	-75.1	-176.2	152.4	-145.9	0	108.4	P223 T274 D300 T368	P223-K225 WeakPolarHBondContact CB-O 3.49Å; P223-K225 VanDerWaalsContact CG-O 3.29Å; P223-K225 WeakPolarHBondContact CG-O 3.36Å; P223-K225 PolarHBondContact O-N 2.88Å; P223-K225 VanDerWaalsContact O-N 3.12Å; K225-T274 HydrophobicContact CB-CG2 4.04Å; K225-D300 IonicContact NZ-OD2 3.36Å; K225-D300 PolarHBondContact NZ-OD2 3.05Å; K225-T368 HydrophobicContact CD-CG2 4.32Å
226	Q	92.7	Very high	93.6	Very high	91 Å²	91	41.9 Å²	41.9	43%	0.425	19%	0.187	S	C	.	.			trans	-77.1	151.8	166.3	-67.4	-178.2	-81.2	0	0	109.3	N219 D300	N219-Q226 HydrophobicContact CB-CG 4.44Å; N219-Q226 WeakPolarHBondContact OD1-CA 3.26Å; N219-Q226 WeakPolarHBondContact OD1-CB 3.44Å; N219-Q226 WeakPolarHBondContact OD1-CG 3.42Å; Q226-D300 WeakPolarHBondContact O-CB 3.36Å
227	V	95.8	Very high	93.7	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.03	18%	0.177	C	C	.	.			trans	-117.6	162.2	175.5	-55.5	0	0	0	0	109.7	Y218 N219 T274 F278 D300 Y302	Y218-V227 HydrophobicContact CD1-CG1 4.26Å; Y218-V227 HydrophobicContact CD1-CG2 3.74Å; Y218-V227 HydrophobicContact CE1-CG1 3.89Å; Y218-V227 HydrophobicContact CE1-CG2 4.23Å; N219-V227 PolarHBondContact ND2-O 3.4Å; N219-V227 PolarHBondContact OD1-N 2.74Å; N219-V227 PolarHBondContact OD1-O 3.32Å; V227-T274 HydrophobicContact CG1-CG2 3.57Å; V227-F278 HydrophobicContact CG2-CD2 4.12Å; V227-F278 HydrophobicContact CG2-CE2 4.28Å; V227-D300 CarbonylContact C-O 3.48Å; V227-D300 VanDerWaalsContact CA-O 3.24Å; V227-D300 WeakPolarHBondContact CA-O 3.49Å; V227-D300 HydrophobicContact CG1-CB 4.46Å; V227-Y302 HydrophobicContact CB-CD2 4.31Å; V227-Y302 HydrophobicContact CB-CE2 3.66Å; V227-Y302 HydrophobicContact CG1-CE2 3.67Å; V227-Y302 HydrophobicContact CG2-CE2 4.32Å
228	D	96.9	Very high	93.8	Very high	57 Å²	57	40.6 Å²	40.6	31%	0.305	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	158.2	162.2	-165.7	21.6	0	0	0	110.6	K212 D300 L301 Y302	K212-D228 IonicContact NZ-OD1 2.79Å; K212-D228 PolarHBondContact NZ-OD1 2.85Å; K212-D228 IonicContact NZ-OD2 3.93Å; K212-D228 PolarHBondContact NZ-OD2 2.8Å; D228-D300 PolarHBondContact N-O 3.12Å; D228-L301 HydrophobicContact CB-CD1 4.07Å; D228-L301 WeakPolarHBondContact O-CA 3.4Å; D228-Y302 PolarHBondContact O-N 2.75Å
229	I	97.1	Very high	93.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133	173.3	-49.8	-162.1	0	0	0	108.8	Q208 A211 K212 F278 Y302 P305	Q208-I229 HydrophobicContact CG-CG2 3.88Å; A211-I229 HydrophobicContact CB-CD1 3.7Å; A211-I229 WeakPolarHBondContact O-CD1 2.95Å; K212-I229 HydrophobicContact CB-CB 4.13Å; K212-I229 WeakPolarHBondContact CD-O 3.13Å; K212-I229 HydrophobicContact CG-CB 4.45Å; K212-I229 PolarHBondContact NZ-O 3.4Å; I229-F278 HydrophobicContact CD1-CE1 4.42Å; I229-F278 HydrophobicContact CD1-CZ 4.43Å; I229-Y302 CarbonylContact C-O 3.59Å; I229-Y302 WeakPolarHBondContact CA-O 3.48Å; I229-Y302 HydrophobicContact CG1-CD2 4.48Å; I229-P305 HydrophobicContact CD1-CB 4.44Å; I229-P305 HydrophobicContact CD1-CG 4.24Å; I229-P305 HydrophobicContact CG2-CG 4.26Å
230	M	96.1	Very high	93.8	Very high	26 Å²	26	48.1 Å²	48.1	13%	0.128	22%	0.219	C	C	.	.			trans	-61.5	141	-177.6	-172.4	53.3	79.2	0	0	111	Q208 E249 H250 I252 L301 Y302	Q208-M230 PolarHBondContact NE2-O 2.72Å; M230-E249 HydrophobicContact CG-CB 4.1Å; M230-H250 HydrophobicContact CE-CB 3.79Å; M230-H250 HydrophobicContact SD-CB 3.75Å; M230-I252 HydrophobicContact CB-CD1 4.38Å; M230-I252 HydrophobicContact CE-CD1 4.07Å; M230-I252 HydrophobicContact CE-CG1 3.67Å; M230-L301 HydrophobicContact CE-CD1 4.32Å; M230-L301 HydrophobicContact CE-CD2 3.93Å; M230-L301 HydrophobicContact CE-CG 4.41Å; M230-Y302 PolarHBondContact N-O 2.99Å
231	Q	95.4	Very high	94	Very high	79 Å²	79	49.8 Å²	49.8	37%	0.369	24%	0.242	S	C	.	.			trans	-73.2	137.6	172.3	-69.2	-176.7	-30.1	0	0	110.2	M209 K212	M209-Q231 HydrophobicContact CE-CG 4.09Å; M209-Q231 HydrophobicContact SD-CB 4.11Å; M209-Q231 HydrophobicContact SD-CG 3.98Å; K212-Q231 HydrophobicContact CD-CG 3.89Å
232	M	96.1	Very high	94.2	Very high	9 Å²	9	50 Å²	50	4%	0.044	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	147.8	177.5	-168.6	167.6	65.8	0	0	109.5	D204 V205 Q208 H247	D204-M232 HydrophobicContact CB-CE 4.02Å; D204-M232 WeakPolarHBondContact O-CE 3.36Å; V205-M232 HydrophobicContact CG2-CB 4.39Å; V205-M232 HydrophobicContact CG2-CE 3.85Å; V205-M232 HydrophobicContact CG2-CG 4.04Å; Q208-M232 HydrophobicContact CB-CE 3.99Å; Q208-M232 HydrophobicContact CG-CB 4.43Å; M232-H247 HydrophobicContact CG-CB 4.01Å; M232-H247 HydrophobicContact SD-CB 3.69Å
233	C	97.8	Very high	94.6	Very high	10 Å²	10	44.9 Å²	44.9	7%	0.068	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.3	176.8	60.7	0	0	0	0	110.7	R134 Y135 R136 H247 L248	R134-C233 HydrophobicContact CG-CB 4.07Å; Y135-C233 WeakPolarHBondContact O-CA 3.37Å; Y135-C233 VanDerWaalsContact O-CB 3.28Å; Y135-C233 WeakPolarHBondContact O-CB 3.1Å; R136-C233 HydrophobicContact CG-CB 4.04Å; C233-H247 CarbonylContact O-C 3.59Å; C233-H247 WeakPolarHBondContact O-CA 3.44Å; C233-L248 PolarHBondContact N-O 3.12Å; C233-L248 PolarHBondContact O-N 3.02Å; C233-L248 PolarHBondContact SG-O 3.25Å
234	V	98.4	Very high	95	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	137.8	172.9	-172.3	0	0	0	0	108.7	R134 Y135 W144 Y201 F202 V205 L245 F246	R134-V234 CarbonylContact C-O 3.59Å; R134-V234 WeakPolarHBondContact CA-O 3.43Å; Y135-V234 HydrophobicContact CD2-CB 4.22Å; Y135-V234 HydrophobicContact CD2-CG1 4.39Å; Y135-V234 PolarHBondContact N-O 3.43Å; Y135-V234 PolarHBondContact O-N 3.15Å; W144-V234 HydrophobicContact CH2-CG2 4.42Å; W144-V234 HydrophobicContact CZ3-CG2 4.4Å; Y201-V234 WeakPolarHBondContact O-CG2 3.43Å; F202-V234 HydrophobicContact CD1-CG2 4.34Å; F202-V234 HydrophobicContact CD2-CG1 4.48Å; F202-V234 HydrophobicContact CD2-CG2 4.18Å; F202-V234 HydrophobicContact CE1-CG2 4.46Å; F202-V234 HydrophobicContact CE2-CB 4.4Å; F202-V234 HydrophobicContact CE2-CG1 3.93Å; F202-V234 HydrophobicContact CE2-CG2 4.3Å; F202-V234 HydrophobicContact CG-CG2 4.18Å; F202-V234 HydrophobicContact CZ-CB 4.3Å; F202-V234 HydrophobicContact CZ-CG1 4.15Å; F202-V234 HydrophobicContact CZ-CG2 4.43Å; V205-V234 HydrophobicContact CB-CG2 4.4Å; V205-V234 HydrophobicContact CG2-CG2 3.75Å; V234-L245 HydrophobicContact CG1-CB 4.26Å; V234-L245 HydrophobicContact CG1-CD1 4.01Å; V234-L245 HydrophobicContact CG1-CD2 4.01Å; V234-L245 HydrophobicContact CG1-CG 4.33Å; V234-F246 CarbonylContact C-O 3.5Å
235	V	98	Very high	95.5	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.1	177.8	178.6	0	0	0	0	109.9	C132 I133 R134 I149 M237 L245 F246 L248	C132-V235 HydrophobicContact CB-CG1 3.44Å; C132-V235 VanDerWaalsContact CB-CG1 3.44Å; I133-V235 CarbonylContact O-C 3.56Å; I133-V235 WeakPolarHBondContact O-CA 3.39Å; R134-V235 HydrophobicContact CB-CG2 4.42Å; R134-V235 HydrophobicContact CG-CG2 4.48Å; I149-V235 HydrophobicContact CD1-CG1 4.13Å; I149-V235 HydrophobicContact CD1-CG2 3.96Å; V235-M237 HydrophobicContact CG1-CE 4.06Å; V235-L245 WeakPolarHBondContact O-CA 3.24Å; V235-F246 PolarHBondContact N-O 3.16Å; V235-F246 PolarHBondContact O-N 3Å; V235-L248 HydrophobicContact CB-CB 4.47Å; V235-L248 HydrophobicContact CG2-CB 3.55Å; V235-L248 HydrophobicContact CG2-CD2 3.87Å; V235-L248 HydrophobicContact CG2-CG 4.27Å
236	E	98	Very high	96	Very high	13 Å²	13	43 Å²	43	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	118.9	176.9	-178	173.7	135	0	0	110.6	C132 I133 Y135 R198 T238 K243 L245	C132-E236 WeakPolarHBondContact CA-O 3.44Å; C132-E236 WeakPolarHBondContact CB-O 3.41Å; I133-E236 HydrophobicContact CB-CB 4.37Å; I133-E236 PolarHBondContact N-O 3.33Å; I133-E236 VanDerWaalsContact N-O 3.12Å; I133-E236 PolarHBondContact O-N 3.13Å; Y135-E236 HydrophobicContact CE2-CB 4.09Å; Y135-E236 PolarHBondContact OH-OE2 3.33Å; R198-E236 IonicContact CZ-OE2 3.9Å; R198-E236 VanDerWaalsContact CZ-OE2 3.22Å; R198-E236 IonicContact NH1-OE2 3.43Å; R198-E236 PolarHBondContact NH1-OE2 3.27Å; R198-E236 IonicContact NH2-OE2 3.62Å; R198-E236 PolarHBondContact NH2-OE2 3.5Å; E236-T238 VanDerWaalsContact C-N 3.3Å; E236-T238 HydrophobicContact CG-CG2 4.26Å; E236-T238 PolarHBondContact O-N 2.73Å; E236-K243 HydrophobicContact CG-CB 4.04Å; E236-K243 VanDerWaalsContact OE1-CD 3.24Å; E236-K243 WeakPolarHBondContact OE1-CD 3.28Å; E236-K243 IonicContact OE1-NZ 3.94Å; E236-L245 HydrophobicContact CB-CD2 3.58Å; E236-L245 HydrophobicContact CG-CD2 3.91Å
237	M	96	Very high	96.3	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.02	22%	0.223	C	C	.	.			trans	-80.2	75.3	178.8	-58.9	-69.2	170.5	0	0	110	M153 V235 N239 R240 P244 F246	M153-M237 HydrophobicContact CE-CE 3.71Å; M153-M237 HydrophobicContact SD-CE 4.2Å; V235-M237 HydrophobicContact CG1-CE 4.06Å; M237-N239 PolarHBondContact O-N 2.93Å; M237-R240 HydrophobicContact CB-CB 4.09Å; M237-R240 HydrophobicContact CB-CG 3.92Å; M237-R240 PolarHBondContact O-N 2.77Å; M237-P244 HydrophobicContact CB-CG 4.18Å; M237-P244 PolarHBondContact N-O 2.82Å; M237-P244 VanDerWaalsContact N-O 3.15Å; M237-F246 HydrophobicContact CE-CB 4.44Å; M237-F246 HydrophobicContact CE-CD2 3.63Å; M237-F246 HydrophobicContact CE-CE2 4.1Å; M237-F246 HydrophobicContact CE-CG 4.09Å; M237-F246 HydrophobicContact CG-CD2 3.7Å; M237-F246 HydrophobicContact CG-CE2 3.69Å
238	T	94.6	Very high	96.4	Very high	39 Å²	39	38.6 Å²	38.6	24%	0.239	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.9	-166.8	54.5	0	0	0	0	115.4	P131 I133 E236	P131-T238 PolarHBondContact O-OG1 3.09Å; I133-T238 HydrophobicContact CB-CG2 4.37Å; I133-T238 HydrophobicContact CD1-CG2 3.63Å; I133-T238 HydrophobicContact CG1-CG2 3.73Å; E236-T238 VanDerWaalsContact C-N 3.3Å; E236-T238 HydrophobicContact CG-CG2 4.26Å; E236-T238 PolarHBondContact O-N 2.73Å
239	N	94.2	Very high	96.4	Very high	119 Å²	119	36.5 Å²	36.5	64%	0.636	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-10	-176.5	-63.8	13.1	0	0	0	113.2	P131 M237	P131-N239 WeakPolarHBondContact CG-ND2 3.41Å; M237-N239 PolarHBondContact O-N 2.93Å
240	R	94.6	Very high	96.3	Very high	70 Å²	70	39.7 Å²	39.7	26%	0.264	23%	0.226	S	C	.	.	S	Bend	trans	-85.9	145.5	178	-68.4	-173.7	-174.1	-159	-2.7	110.9	E130 M237 G242 K243 P244	E130-R240 IonicContact OE1-CZ 3.37Å; E130-R240 VanDerWaalsContact OE1-CZ 3.27Å; E130-R240 IonicContact OE1-NE 2.83Å; E130-R240 PolarHBondContact OE1-NE 3.49Å; E130-R240 IonicContact OE1-NH2 2.7Å; E130-R240 PolarHBondContact OE1-NH2 2.91Å; E130-R240 IonicContact OE2-CZ 3.33Å; E130-R240 IonicContact OE2-NE 3.79Å; E130-R240 IonicContact OE2-NH2 2.74Å; E130-R240 PolarHBondContact OE2-NH2 2.78Å; M237-R240 HydrophobicContact CB-CB 4.09Å; M237-R240 HydrophobicContact CB-CG 3.92Å; M237-R240 PolarHBondContact O-N 2.77Å; R240-G242 PolarHBondContact O-N 2.87Å; R240-K243 PolarHBondContact O-N 3.29Å; R240-P244 HydrophobicContact CB-CG 4.04Å
241	P	94.3	Very high	96.2	Very high	130 Å²	130	41.7 Å²	41.7	84%	0.844	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	134	172.5	-26.2	35	0	0	0	111.9	K243 P244	P241-K243 PolarHBondContact O-N 3.49Å; P241-P244 WeakPolarHBondContact O-CD 3.42Å
242	G	92.8	Very high	96	Very high	82 Å²	82	39.1 Å²	39.1	85%	0.845	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.9	-1.7	-176.5	0	0	0	0	0	115.7	R240	R240-G242 PolarHBondContact O-N 2.87Å
243	K	95.8	Very high	95.7	Very high	113 Å²	113	43.7 Å²	43.7	49%	0.491	24%	0.242	S	C	.	.			trans	46.1	54.2	-177.7	-55.2	-169.1	-175.3	-179.9	0	113.9	E236 R240 P241	E236-K243 HydrophobicContact CG-CB 4.04Å; E236-K243 VanDerWaalsContact OE1-CD 3.24Å; E236-K243 WeakPolarHBondContact OE1-CD 3.28Å; E236-K243 IonicContact OE1-NZ 3.94Å; R240-K243 PolarHBondContact O-N 3.29Å; P241-K243 PolarHBondContact O-N 3.49Å
244	P	96.1	Very high	95.2	Very high	41 Å²	41	45.6 Å²	45.6	27%	0.266	26%	0.264	S	S	.	.			trans	-57.9	141	-173.8	24.7	-35.5	0	0	0	112.1	M237 R240 P241 F246	M237-P244 HydrophobicContact CB-CG 4.18Å; M237-P244 PolarHBondContact N-O 2.82Å; M237-P244 VanDerWaalsContact N-O 3.15Å; R240-P244 HydrophobicContact CB-CG 4.04Å; P241-P244 WeakPolarHBondContact O-CD 3.42Å; P244-F246 HydrophobicContact CB-CE2 4.13Å; P244-F246 HydrophobicContact CG-CE2 4.24Å
245	L	97.9	Very high	94.8	Very high	13 Å²	13	52.1 Å²	52.1	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	148.3	174.8	-62.4	-173.8	0	0	0	111.4	R198 Y201 F202 V234 V235 E236	R198-L245 HydrophobicContact CB-CD1 4.43Å; R198-L245 HydrophobicContact CG-CD1 3.85Å; Y201-L245 HydrophobicContact CD1-CB 3.79Å; Y201-L245 HydrophobicContact CD2-CB 4.03Å; Y201-L245 HydrophobicContact CD2-CD1 4.01Å; Y201-L245 HydrophobicContact CE1-CB 3.86Å; Y201-L245 WeakPolarHBondContact CE1-O 3.36Å; Y201-L245 HydrophobicContact CE2-CB 4.09Å; Y201-L245 HydrophobicContact CG-CB 3.88Å; Y201-L245 HydrophobicContact CG-CD1 4.01Å; Y201-L245 PolarHBondContact OH-O 3.25Å; F202-L245 HydrophobicContact CE2-CD1 3.98Å; V234-L245 HydrophobicContact CG1-CB 4.26Å; V234-L245 HydrophobicContact CG1-CD1 4.01Å; V234-L245 HydrophobicContact CG1-CD2 4.01Å; V234-L245 HydrophobicContact CG1-CG 4.33Å; V235-L245 WeakPolarHBondContact O-CA 3.24Å; E236-L245 HydrophobicContact CB-CD2 3.58Å; E236-L245 HydrophobicContact CG-CD2 3.91Å
246	F	98.1	Very high	94.4	Very high	1 Å²	1	57.3 Å²	57.3	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.4	169.8	-68.1	-102.1	0	0	0	109	M153 F167 A189 K190 R191 V234 V235 M237 P244	M153-F246 HydrophobicContact CE-CD1 4.31Å; M153-F246 HydrophobicContact CE-CE1 3.78Å; M153-F246 HydrophobicContact CE-CE2 4.04Å; M153-F246 HydrophobicContact CE-CZ 3.64Å; M153-F246 HydrophobicContact SD-CD1 4.17Å; M153-F246 HydrophobicContact SD-CE1 4.04Å; M153-F246 HydrophobicContact SD-CZ 4.49Å; F167-F246 HydrophobicContact CD2-CE1 4.04Å; F167-F246 HydrophobicContact CE2-CE1 4.24Å; A189-F246 HydrophobicContact CB-CB 4.44Å; A189-F246 HydrophobicContact CB-CD1 4.18Å; K190-F246 CarbonylContact O-C 3.57Å; K190-F246 WeakPolarHBondContact O-CA 3.45Å; K190-F246 WeakPolarHBondContact O-CB 3.48Å; R191-F246 HydrophobicContact CB-CD1 3.9Å; R191-F246 HydrophobicContact CB-CE1 4Å; R191-F246 HydrophobicContact CB-CG 4.49Å; R191-F246 HydrophobicContact CG-CD1 4.19Å; R191-F246 HydrophobicContact CG-CE1 3.81Å; R191-F246 HydrophobicContact CG-CZ 4.45Å; V234-F246 CarbonylContact C-O 3.5Å; V235-F246 PolarHBondContact N-O 3.16Å; V235-F246 PolarHBondContact O-N 3Å; M237-F246 HydrophobicContact CE-CB 4.44Å; M237-F246 HydrophobicContact CE-CD2 3.63Å; M237-F246 HydrophobicContact CE-CE2 4.1Å; M237-F246 HydrophobicContact CE-CG 4.09Å; M237-F246 HydrophobicContact CG-CD2 3.7Å; M237-F246 HydrophobicContact CG-CE2 3.69Å; P244-F246 HydrophobicContact CB-CE2 4.13Å; P244-F246 HydrophobicContact CG-CE2 4.24Å
247	H	98.3	Very high	94	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	138.1	157.7	-61.6	114.9	0	0	0	109.1	R164 A189 K190 Y192 Y201 D204 M232 C233	R164-H247 PolarHBondContact NH1-ND1 3.2Å; A189-H247 CarbonylContact C-O 3.59Å; A189-H247 VanDerWaalsContact CA-O 3.23Å; A189-H247 WeakPolarHBondContact CA-O 3.18Å; K190-H247 HydrophobicContact CB-CB 4.2Å; K190-H247 PolarHBondContact N-O 3.3Å; K190-H247 PolarHBondContact O-N 2.97Å; Y192-H247 AromaticContact CE2-CE1 3.9Å; Y201-H247 WeakPolarHBondContact CA-NE2 3.15Å; Y201-H247 AromaticContact CD1-CE1 3.55Å; Y201-H247 AromaticContact CD1-ND1 3.86Å; Y201-H247 AromaticContact CD1-NE2 3.71Å; Y201-H247 PolarHBondContact O-NE2 2.72Å; D204-H247 WeakPolarHBondContact CB-NE2 3.39Å; D204-H247 IonicContact OD2-CE1 3.22Å; D204-H247 PolarHBondContact OD2-CE1 2.73Å; D204-H247 IonicContact OD2-ND1 3.73Å; D204-H247 IonicContact OD2-NE2 2.97Å; D204-H247 PolarHBondContact OD2-NE2 3.11Å; M232-H247 HydrophobicContact CG-CB 4.01Å; M232-H247 HydrophobicContact SD-CB 3.69Å; C233-H247 CarbonylContact O-C 3.59Å; C233-H247 WeakPolarHBondContact O-CA 3.44Å
248	L	97.9	Very high	93.7	Very high	4 Å²	4	61.5 Å²	61.5	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.4	176.7	-168.5	79.4	0	0	0	110.1	I149 A169 Y187 A189 C233 V235	I149-L248 HydrophobicContact CD1-CD2 4.14Å; A169-L248 HydrophobicContact CB-CD1 4.25Å; Y187-L248 HydrophobicContact CD1-CD1 4.3Å; Y187-L248 HydrophobicContact CD1-CD2 3.82Å; Y187-L248 HydrophobicContact CD1-CG 3.68Å; Y187-L248 HydrophobicContact CE1-CD2 4.21Å; Y187-L248 HydrophobicContact CE1-CG 4.42Å; Y187-L248 HydrophobicContact CG-CD1 4.34Å; Y187-L248 HydrophobicContact CG-CD2 4.27Å; Y187-L248 HydrophobicContact CG-CG 4.19Å; A189-L248 HydrophobicContact CB-CD1 3.85Å; C233-L248 PolarHBondContact N-O 3.12Å; C233-L248 PolarHBondContact O-N 3.02Å; C233-L248 PolarHBondContact SG-O 3.25Å; V235-L248 HydrophobicContact CB-CB 4.47Å; V235-L248 HydrophobicContact CG2-CB 3.55Å; V235-L248 HydrophobicContact CG2-CD2 3.87Å; V235-L248 HydrophobicContact CG2-CG 4.27Å
249	E	96.8	Very high	93.4	Very high	12 Å²	12	60.1 Å²	60.1	6%	0.056	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	159.3	178.2	66.4	173.6	-169.4	0	0	110.6	Y187 V188 K190 M230 T303	Y187-E249 CarbonylContact C-O 3.55Å; Y187-E249 WeakPolarHBondContact CA-O 3.44Å; Y187-E249 VanDerWaalsContact CB-O 3.28Å; Y187-E249 WeakPolarHBondContact CB-O 3.1Å; Y187-E249 VanDerWaalsContact CD1-C 3.4Å; Y187-E249 WeakPolarHBondContact CD1-O 3.27Å; V188-E249 HydrophobicContact CB-CG 3.92Å; V188-E249 PolarHBondContact N-O 3.43Å; V188-E249 PolarHBondContact O-N 2.97Å; K190-E249 WeakPolarHBondContact CE-OE1 3.23Å; K190-E249 IonicContact NZ-OE1 2.6Å; K190-E249 PolarHBondContact NZ-OE1 2.8Å; K190-E249 IonicContact NZ-OE2 3.03Å; K190-E249 PolarHBondContact NZ-OE2 3.06Å; M230-E249 HydrophobicContact CG-CB 4.1Å; E249-T303 WeakPolarHBondContact OE2-CB 3.21Å; E249-T303 PolarHBondContact OE2-OG1 2.87Å
250	H	94.9	Very high	93.2	Very high	68 Å²	68	54.6 Å²	54.6	32%	0.315	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	142.7	173.8	-93.5	-68.8	0	0	0	112.2	N186 Y187 M230 I252	N186-H250 PolarHBondContact O-ND1 3.45Å; Y187-H250 AromaticContact CE1-CD2 3.96Å; Y187-H250 AromaticContact CE1-NE2 3.97Å; Y187-H250 AromaticContact CE2-CE1 3.38Å; Y187-H250 WeakPolarHBondContact CE2-CE1 3.23Å; Y187-H250 AromaticContact CE2-ND1 3.67Å; Y187-H250 AromaticContact CE2-NE2 3.97Å; Y187-H250 AromaticContact CZ-CD2 3.91Å; Y187-H250 AromaticContact CZ-CE1 3.33Å; Y187-H250 AromaticContact CZ-ND1 3.72Å; Y187-H250 AromaticContact CZ-NE2 3.43Å; Y187-H250 PolarHBondContact OH-CE1 3.29Å; Y187-H250 PolarHBondContact OH-NE2 3.36Å; Y187-H250 VanDerWaalsContact OH-NE2 3.13Å; M230-H250 HydrophobicContact CE-CB 3.79Å; M230-H250 HydrophobicContact SD-CB 3.75Å; H250-I252 PolarHBondContact O-N 3.28Å
251	Y	94.1	Very high	93	Very high	67 Å²	67	51.5 Å²	51.5	26%	0.263	28%	0.281	S	S	.	.			trans	-67	127.6	171.9	173.6	-114.1	0	0	0	111.1	P118 W119 N186 V188 E253	P118-Y251 HydrophobicContact CB-CE1 4.38Å; P118-Y251 HydrophobicContact CG-CD1 4.2Å; P118-Y251 HydrophobicContact CG-CE1 3.75Å; W119-Y251 AromaticContact CE2-CD2 4Å; W119-Y251 AromaticContact CE2-CG 3.97Å; W119-Y251 AromaticContact CH2-CD2 3.96Å; W119-Y251 HydrophobicContact CH2-CD2 3.96Å; W119-Y251 AromaticContact CH2-CG 3.9Å; W119-Y251 HydrophobicContact CH2-CG 3.9Å; W119-Y251 HydrophobicContact CZ2-CD1 4.15Å; W119-Y251 AromaticContact CZ2-CD2 3.3Å; W119-Y251 HydrophobicContact CZ2-CD2 3.3Å; W119-Y251 AromaticContact CZ2-CE2 3.82Å; W119-Y251 HydrophobicContact CZ2-CE2 3.82Å; W119-Y251 AromaticContact CZ2-CG 3.49Å; W119-Y251 HydrophobicContact CZ2-CG 3.49Å; W119-Y251 VanDerWaalsContact CZ2-CG 3.49Å; W119-Y251 AromaticContact NE1-CZ 3.94Å; N186-Y251 HydrophobicContact CB-CD1 4.36Å; N186-Y251 HydrophobicContact CB-CG 4.46Å; N186-Y251 PolarHBondContact O-N 3.23Å; V188-Y251 HydrophobicContact CG2-CD2 4.04Å; Y251-E253 HydrophobicContact CE1-CB 3.91Å; Y251-E253 HydrophobicContact CE1-CG 4.28Å
252	I	91.3	Very high	92.7	Very high	26 Å²	26	47.2 Å²	47.2	13%	0.133	25%	0.251	C	S	.	.			trans	-101.6	113	176.3	-47.9	169.6	0	0	0	109	M230 H250 V298 L301 T303	M230-I252 HydrophobicContact CB-CD1 4.38Å; M230-I252 HydrophobicContact CE-CD1 4.07Å; M230-I252 HydrophobicContact CE-CG1 3.67Å; H250-I252 PolarHBondContact O-N 3.28Å; I252-V298 HydrophobicContact CB-CG2 4.15Å; I252-V298 HydrophobicContact CG2-CB 3.61Å; I252-V298 HydrophobicContact CG2-CG2 3.6Å; I252-L301 HydrophobicContact CD1-CD2 4.42Å; I252-L301 HydrophobicContact CD1-CG 4.17Å; I252-L301 HydrophobicContact CG1-CD2 4.34Å; I252-L301 HydrophobicContact CG2-CD2 4.01Å; I252-L301 HydrophobicContact CG2-CG 4.49Å; I252-T303 HydrophobicContact CD1-CG2 4.46Å
253	E	88.9	Confident	92.4	Very high	104 Å²	104	45.5 Å²	45.5	49%	0.486	23%	0.227	S	C	.	.			trans	-77.3	125.6	179.6	-168.4	-171	164.7	0	0	111.9	M115 Y251	M115-E253 WeakPolarHBondContact CE-OE1 3.28Å; M115-E253 VanDerWaalsContact CE-OE2 3.26Å; M115-E253 WeakPolarHBondContact CE-OE2 3.38Å; Y251-E253 HydrophobicContact CE1-CB 3.91Å; Y251-E253 HydrophobicContact CE1-CG 4.28Å
254	G	88.9	Confident	91.4	Very high	50 Å²	50	40.7 Å²	40.7	52%	0.515	21%	0.209	S	C	.	.	S	Bend	trans	139.2	-165.7	169.1	0	0	0	0	0	114.2	Y256	G254-Y256 PolarHBondContact O-N 3.33Å
255	K	89.3	Confident	90.3	Very high	138 Å²	138	44.6 Å²	44.6	60%	0.6	22%	0.222	S	C	*	.			trans	-75.9	106.8	177.5	-174.3	-174.4	176	-166.8	0	109.9	I257 N270	K255-I257 HydrophobicContact CD-CD1 4.04Å; K255-I257 HydrophobicContact CD-CG1 4.15Å; K255-I257 HydrophobicContact CG-CD1 4.37Å; K255-I257 HydrophobicContact CG-CG1 4.03Å; K255-N270 PolarHBondContact NZ-OD1 3.31Å
256	Y	89.5	Confident	88.8	Confident	110 Å²	110	45 Å²	45	43%	0.431	22%	0.224	S	C	.	.			trans	-65.9	132.2	169.5	-166.6	-84.3	0	0	0	110.4	G254 Q296 G297 T303	G254-Y256 PolarHBondContact O-N 3.33Å; Y256-Q296 HydrophobicContact CE1-CB 4.14Å; Y256-Q296 HydrophobicContact CE1-CG 4.38Å; Y256-Q296 VanDerWaalsContact OH-CG 3.23Å; Y256-Q296 WeakPolarHBondContact OH-CG 3.13Å; Y256-Q296 PolarHBondContact OH-OE1 2.98Å; Y256-G297 CarbonylContact C-O 3.45Å; Y256-G297 WeakPolarHBondContact CA-O 3.38Å; Y256-T303 HydrophobicContact CE2-CG2 4.2Å
257	I	89.4	Confident	87	Confident	29 Å²	29	52.7 Å²	52.7	15%	0.149	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.6	178.6	-54	176.2	0	0	0	108.8	K255 Y259 N270 Q296 G297	K255-I257 HydrophobicContact CD-CD1 4.04Å; K255-I257 HydrophobicContact CD-CG1 4.15Å; K255-I257 HydrophobicContact CG-CD1 4.37Å; K255-I257 HydrophobicContact CG-CG1 4.03Å; I257-Y259 HydrophobicContact CB-CD1 4.42Å; I257-Y259 HydrophobicContact CB-CE1 3.76Å; I257-Y259 HydrophobicContact CD1-CE1 4.22Å; I257-Y259 HydrophobicContact CG2-CD1 3.7Å; I257-Y259 HydrophobicContact CG2-CE1 3.39Å; I257-Y259 HydrophobicContact CG2-CG 4.48Å; I257-N270 HydrophobicContact CG2-CB 4.15Å; I257-Q296 CarbonylContact O-C 3.51Å; I257-Q296 VanDerWaalsContact O-CA 3.27Å; I257-Q296 WeakPolarHBondContact O-CA 3.37Å; I257-G297 PolarHBondContact N-O 3.27Å; I257-G297 PolarHBondContact O-N 2.94Å
258	K	90.1	Very high	85.1	Confident	75 Å²	75	56.7 Å²	56.7	33%	0.326	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.1	166.5	178.9	162.9	177.5	162.3	0	109.3	N260 D294 Q296	K258-N260 WeakPolarHBondContact CE-O 3.14Å; K258-N260 VanDerWaalsContact CG-O 3.24Å; K258-N260 WeakPolarHBondContact CG-O 2.93Å; K258-D294 VanDerWaalsContact CE-CG 3.5Å; K258-D294 WeakPolarHBondContact CE-OD1 3.36Å; K258-D294 VanDerWaalsContact CE-OD2 3.31Å; K258-D294 WeakPolarHBondContact CE-OD2 3.2Å; K258-D294 IonicContact NZ-OD1 2.65Å; K258-D294 PolarHBondContact NZ-OD1 3.41Å; K258-D294 IonicContact NZ-OD2 2.95Å; K258-D294 PolarHBondContact NZ-OD2 3.4Å; K258-Q296 HydrophobicContact CB-CB 3.88Å; K258-Q296 HydrophobicContact CG-CB 4.11Å
259	Y	89.1	Confident	83.5	Confident	11 Å²	11	63.8 Å²	63.8	4%	0.043	31%	0.313	C	S	.	.			trans	-101.1	-32.5	-169.4	-61.6	-63.5	0	0	0	113.7	I257 R272 P275 Q276 I295 G299 Y302	I257-Y259 HydrophobicContact CB-CD1 4.42Å; I257-Y259 HydrophobicContact CB-CE1 3.76Å; I257-Y259 HydrophobicContact CD1-CE1 4.22Å; I257-Y259 HydrophobicContact CG2-CD1 3.7Å; I257-Y259 HydrophobicContact CG2-CE1 3.39Å; I257-Y259 HydrophobicContact CG2-CG 4.48Å; Y259-R272 HydrophobicContact CD1-CB 4.45Å; Y259-R272 HydrophobicContact CE1-CB 4.48Å; Y259-R272 HydrophobicContact CE1-CG 4.15Å; Y259-R272 PolarHBondContact OH-NH1 2.92Å; Y259-P275 HydrophobicContact CD1-CG 4.23Å; Y259-P275 HydrophobicContact CD2-CB 4.12Å; Y259-P275 HydrophobicContact CD2-CG 3.51Å; Y259-P275 HydrophobicContact CE2-CG 4.14Å; Y259-P275 HydrophobicContact CG-CB 4.03Å; Y259-P275 HydrophobicContact CG-CG 3.56Å; Y259-Q276 PolarHBondContact O-NE2 2.85Å; Y259-I295 WeakPolarHBondContact CB-O 3.18Å; Y259-I295 HydrophobicContact CD2-CG2 4.41Å; Y259-I295 WeakPolarHBondContact CD2-O 3.33Å; Y259-I295 PolarHBondContact N-O 3.38Å; Y259-G299 PolarHBondContact OH-O 2.86Å; Y259-Y302 HydrophobicContact CD2-CE1 4.27Å; Y259-Y302 AromaticContact CE2-CE1 3.99Å; Y259-Y302 HydrophobicContact CE2-CE1 3.99Å
260	N	90.2	Very high	81.9	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.011	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-142.4	172.5	165	61.3	30	0	0	0	109.6	K258 F265 V266 Q276 S279 D294 I295	K258-N260 WeakPolarHBondContact CE-O 3.14Å; K258-N260 VanDerWaalsContact CG-O 3.24Å; K258-N260 WeakPolarHBondContact CG-O 2.93Å; N260-F265 CarbonylContact C-O 3.57Å; N260-F265 VanDerWaalsContact CA-O 3.31Å; N260-F265 WeakPolarHBondContact CA-O 3.48Å; N260-V266 HydrophobicContact CB-CG2 4.34Å; N260-Q276 PolarHBondContact ND2-OE1 2.89Å; N260-S279 PolarHBondContact ND2-OG 3.37Å; N260-D294 PolarHBondContact OD1-N 2.97Å; N260-I295 PolarHBondContact OD1-N 2.99Å
261	S	90	Very high	80.8	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.042	32%	0.315	C	S	.	.			trans	-113.3	165.7	169.6	74.7	0	0	0	0	112.4	S263 G264 F265 D294	S261-S263 PolarHBondContact O-N 2.74Å; S261-S263 WeakPolarHBondContact OG-CA 3.17Å; S261-S263 PolarHBondContact OG-N 2.9Å; S261-S263 PolarHBondContact OG-OG 2.97Å; S261-G264 PolarHBondContact O-N 2.82Å; S261-G264 PolarHBondContact OG-N 3.21Å; S261-F265 PolarHBondContact N-O 2.91Å; S261-F265 WeakPolarHBondContact OG-CB 3.47Å; S261-F265 PolarHBondContact OG-N 3.26Å; S261-D294 WeakPolarHBondContact CA-OD1 3.31Å
262	N	87.7	Confident	80.4	Confident	39 Å²	39	62.4 Å²	62.4	21%	0.209	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.1	164	74.6	-34.4	0	0	0	114	V293 D294 Q306 H308 G318	N262-V293 HydrophobicContact CB-CG2 4.17Å; N262-D294 HydrophobicContact CB-CB 4.46Å; N262-D294 PolarHBondContact N-OD1 2.9Å; N262-Q306 HydrophobicContact CB-CB 3.94Å; N262-Q306 HydrophobicContact CB-CG 3.89Å; N262-H308 PolarHBondContact O-CE1 3Å; N262-H308 PolarHBondContact O-NE2 3.37Å; N262-G318 PolarHBondContact ND2-O 3.03Å
263	S	86.2	Confident	80.2	Confident	47 Å²	47	61.2 Å²	61.2	33%	0.329	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	21.1	-175.8	64.1	0	0	0	0	114.3	S261 F265	S261-S263 PolarHBondContact O-N 2.74Å; S261-S263 WeakPolarHBondContact OG-CA 3.17Å; S261-S263 PolarHBondContact OG-N 2.9Å; S261-S263 PolarHBondContact OG-OG 2.97Å; S263-F265 VanDerWaalsContact C-N 3.31Å; S263-F265 PolarHBondContact O-N 2.71Å
264	G	74.3	Confident	80.4	Confident	11 Å²	11	56.2 Å²	56.2	11%	0.113	28%	0.28	C	S	.	.	S	Bend	trans	80.1	-0.5	176.8	0	0	0	0	0	116	S261 L327 S331	S261-G264 PolarHBondContact O-N 2.82Å; S261-G264 PolarHBondContact OG-N 3.21Å; G264-L327 WeakPolarHBondContact CA-O 3.31Å; G264-S331 WeakPolarHBondContact O-CB 3.47Å; G264-S331 PolarHBondContact O-OG 3.39Å
265	F	73.4	Confident	80.6	Confident	124 Å²	124	53.9 Å²	53.9	54%	0.544	26%	0.256	S	S	.	.			trans	-79.5	130.4	-178	-179.1	-107.9	0	0	0	112.2	N260 S261 S263 R267	N260-F265 CarbonylContact C-O 3.57Å; N260-F265 VanDerWaalsContact CA-O 3.31Å; N260-F265 WeakPolarHBondContact CA-O 3.48Å; S261-F265 PolarHBondContact N-O 2.91Å; S261-F265 WeakPolarHBondContact OG-CB 3.47Å; S261-F265 PolarHBondContact OG-N 3.26Å; S263-F265 VanDerWaalsContact C-N 3.31Å; S263-F265 PolarHBondContact O-N 2.71Å; F265-R267 HydrophobicContact CD1-CG 4.38Å; F265-R267 HydrophobicContact CE1-CG 3.5Å; F265-R267 HydrophobicContact CZ-CG 4.01Å
266	V	65.8	Low	80.8	Confident	20 Å²	20	47.9 Å²	47.9	12%	0.121	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-119.9	141.8	175.9	178.8	0	0	0	0	108.7	N260 I271	N260-V266 HydrophobicContact CB-CG2 4.34Å; V266-I271 HydrophobicContact CG1-CD1 4.04Å; V266-I271 HydrophobicContact CG1-CG1 3.83Å
267	R	60.5	Low	81.1	Confident	163 Å²	163	42.7 Å²	42.7	62%	0.615	21%	0.209	S	C	*	.			trans	-98.4	111.1	176.4	-74.2	-171.1	172.6	-151.1	-2.5	111.6	F265 D269 N270	F265-R267 HydrophobicContact CD1-CG 4.38Å; F265-R267 HydrophobicContact CE1-CG 3.5Å; F265-R267 HydrophobicContact CZ-CG 4.01Å; R267-D269 PolarHBondContact O-N 3.06Å; R267-N270 PolarHBondContact O-N 2.7Å
268	D	59.7	Low	81.4	Confident	85 Å²	85	41.3 Å²	41.3	46%	0.455	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-53.8	-47	-175	-65.4	-50.1	0	0	0	114.3	N270 I271 L362	D268-N270 PolarHBondContact O-N 2.79Å; D268-I271 PolarHBondContact O-N 2.95Å; D268-L362 HydrophobicContact CB-CD1 3.75Å
269	D	62.5	Low	81.8	Confident	153 Å²	153	37.7 Å²	37.7	82%	0.818	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-53.1	-23.1	-176.1	-63.7	-23.2	0	0	0	115.2	R267	R267-D269 PolarHBondContact O-N 3.06Å
270	N	64	Low	82.2	Confident	55 Å²	55	37.2 Å²	37.2	29%	0.294	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-136	27.5	-172.8	-64.4	-107.6	0	0	0	112.5	K255 I257 R267 D268 R272	K255-N270 PolarHBondContact NZ-OD1 3.31Å; I257-N270 HydrophobicContact CG2-CB 4.15Å; R267-N270 PolarHBondContact O-N 2.7Å; D268-N270 PolarHBondContact O-N 2.79Å; N270-R272 PolarHBondContact O-N 3.24Å
271	I	71.9	Confident	82.5	Confident	23 Å²	23	37.2 Å²	37.2	12%	0.118	19%	0.185	C	C	.	.			trans	-54.8	128	178.1	-71.8	179.6	0	0	0	111.3	V266 D268 T359 L362 L363	V266-I271 HydrophobicContact CG1-CD1 4.04Å; V266-I271 HydrophobicContact CG1-CG1 3.83Å; D268-I271 PolarHBondContact O-N 2.95Å; I271-T359 HydrophobicContact CD1-CG2 4Å; I271-L362 HydrophobicContact CD1-CB 4.09Å; I271-L362 HydrophobicContact CD1-CD1 3.81Å; I271-L363 HydrophobicContact CG2-CD2 3.59Å; I271-L363 HydrophobicContact CG2-CG 4.22Å
272	R	84.6	Confident	82.8	Confident	39 Å²	39	37 Å²	37	15%	0.147	18%	0.183	C	C	.	.			trans	-129	148.5	176.9	-72.1	-175.3	65.6	-140.9	-4.5	111.2	Y259 N270 P275 G299 D300	Y259-R272 HydrophobicContact CD1-CB 4.45Å; Y259-R272 HydrophobicContact CE1-CB 4.48Å; Y259-R272 HydrophobicContact CE1-CG 4.15Å; Y259-R272 PolarHBondContact OH-NH1 2.92Å; N270-R272 PolarHBondContact O-N 3.24Å; R272-P275 HydrophobicContact CB-CG 4.19Å; R272-G299 VanDerWaalsContact NH1-C 3.33Å; R272-G299 PolarHBondContact NH1-O 2.63Å; R272-D300 IonicContact CZ-OD1 2.91Å; R272-D300 IonicContact CZ-OD2 3.94Å; R272-D300 IonicContact NH1-OD1 2.77Å; R272-D300 IonicContact NH1-OD2 3.83Å; R272-D300 IonicContact NH2-OD1 3.83Å; R272-D300 PolarHBondContact NH2-OD1 2.65Å; R272-D300 IonicContact NH2-OD2 2.62Å; R272-D300 PolarHBondContact NH2-OD2 2.94Å
273	L	88.6	Confident	83.2	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-77.4	-37.9	-172.7	-51.5	-170.8	0	0	0	112.9	A277 N335 K336 I337 L363 A366	L273-A277 VanDerWaalsContact O-CB 3.26Å; L273-A277 WeakPolarHBondContact O-CB 3.17Å; L273-A277 PolarHBondContact O-N 2.8Å; L273-A277 VanDerWaalsContact O-N 3.13Å; L273-N335 HydrophobicContact CD2-CB 4.1Å; L273-N335 PolarHBondContact O-ND2 2.99Å; L273-N335 VanDerWaalsContact O-ND2 3.12Å; L273-K336 HydrophobicContact CD1-CD 3.99Å; L273-K336 VanDerWaalsContact CD1-CE 3.44Å; L273-K336 HydrophobicContact CD1-CG 3.91Å; L273-I337 HydrophobicContact CB-CD1 3.65Å; L273-I337 HydrophobicContact CB-CG1 4Å; L273-L363 HydrophobicContact CD2-CB 4.36Å; L273-L363 HydrophobicContact CD2-CD2 3.38Å; L273-L363 HydrophobicContact CD2-CG 4.48Å; L273-A366 HydrophobicContact CD1-CB 4.27Å; L273-A366 HydrophobicContact CD2-CB 3.77Å; L273-A366 HydrophobicContact CG-CB 3.96Å
274	T	92.6	Very high	83.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-49.6	-177.8	-19.9	0	0	0	0	113.1	Y218 K225 V227 Q276 A277 F278 D300	Y218-T274 HydrophobicContact CE1-CG2 4.08Å; Y218-T274 VanDerWaalsContact OH-CG2 3.31Å; Y218-T274 WeakPolarHBondContact OH-CG2 3.16Å; K225-T274 HydrophobicContact CB-CG2 4.04Å; V227-T274 HydrophobicContact CG1-CG2 3.57Å; T274-Q276 PolarHBondContact O-N 2.91Å; T274-A277 PolarHBondContact O-N 2.92Å; T274-F278 VanDerWaalsContact O-CB 3.29Å; T274-F278 WeakPolarHBondContact O-CB 3.29Å; T274-F278 PolarHBondContact O-N 3.38Å; T274-D300 PolarHBondContact OG1-OD1 2.81Å
275	P	93.9	Very high	84.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-44.6	-177	-27.3	36.7	0	0	0	114.1	Y259 R272 F278 S279 I295	Y259-P275 HydrophobicContact CD1-CG 4.23Å; Y259-P275 HydrophobicContact CD2-CB 4.12Å; Y259-P275 HydrophobicContact CD2-CG 3.51Å; Y259-P275 HydrophobicContact CE2-CG 4.14Å; Y259-P275 HydrophobicContact CG-CB 4.03Å; Y259-P275 HydrophobicContact CG-CG 3.56Å; R272-P275 HydrophobicContact CB-CG 4.19Å; P275-F278 PolarHBondContact O-N 3.27Å; P275-S279 PolarHBondContact O-N 3.19Å; P275-S279 PolarHBondContact O-OG 3.39Å; P275-I295 HydrophobicContact CB-CB 4.18Å; P275-I295 HydrophobicContact CB-CG2 3.85Å; P275-I295 HydrophobicContact CG-CG2 4.44Å
276	Q	92.4	Very high	85.4	Confident	13 Å²	13	28.6 Å²	28.6	6%	0.061	14%	0.135	C	C	.	.	H	α-helix	trans	-71.9	-38.1	179.9	-45.1	-54.4	15.2	0	0	111.7	Y259 N260 T274 S279 H280	Y259-Q276 PolarHBondContact O-NE2 2.85Å; N260-Q276 PolarHBondContact ND2-OE1 2.89Å; T274-Q276 PolarHBondContact O-N 2.91Å; Q276-S279 PolarHBondContact O-N 3.17Å; Q276-H280 WeakPolarHBondContact O-CB 3.4Å; Q276-H280 PolarHBondContact O-N 2.92Å
277	A	95.1	Very high	86.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68.6	-32.9	174.9	0	0	0	0	0	112.9	L273 T274 F281 I337	L273-A277 VanDerWaalsContact O-CB 3.26Å; L273-A277 WeakPolarHBondContact O-CB 3.17Å; L273-A277 PolarHBondContact O-N 2.8Å; L273-A277 VanDerWaalsContact O-N 3.13Å; T274-A277 PolarHBondContact O-N 2.92Å; A277-F281 WeakPolarHBondContact O-CB 3.41Å; A277-F281 PolarHBondContact O-N 2.8Å; A277-I337 HydrophobicContact CB-CB 3.73Å; A277-I337 HydrophobicContact CB-CG2 3.64Å
278	F	97.2	Very high	88.2	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.5	-50.3	172.1	172.6	-113.2	0	0	0	111.1	W214 Y218 V227 I229 T274 P275 H280 F281 T282 V292 I295	W214-F278 HydrophobicContact CB-CE2 4.36Å; W214-F278 HydrophobicContact CB-CZ 4.2Å; Y218-F278 HydrophobicContact CD1-CD2 4.15Å; Y218-F278 HydrophobicContact CD2-CB 4.32Å; Y218-F278 AromaticContact CD2-CD2 3.83Å; Y218-F278 HydrophobicContact CD2-CD2 3.83Å; Y218-F278 HydrophobicContact CE2-CB 4.13Å; Y218-F278 HydrophobicContact CE2-CD2 4.46Å; Y218-F278 AromaticContact CG-CD2 3.66Å; Y218-F278 HydrophobicContact CG-CD2 3.66Å; Y218-F278 HydrophobicContact CG-CE2 4.35Å; V227-F278 HydrophobicContact CG2-CD2 4.12Å; V227-F278 HydrophobicContact CG2-CE2 4.28Å; I229-F278 HydrophobicContact CD1-CE1 4.42Å; I229-F278 HydrophobicContact CD1-CZ 4.43Å; T274-F278 VanDerWaalsContact O-CB 3.29Å; T274-F278 WeakPolarHBondContact O-CB 3.29Å; T274-F278 PolarHBondContact O-N 3.38Å; P275-F278 PolarHBondContact O-N 3.27Å; F278-H280 PolarHBondContact O-N 3.31Å; F278-F281 WeakPolarHBondContact O-CB 3.16Å; F278-F281 PolarHBondContact O-N 3.36Å; F278-T282 HydrophobicContact CD2-CG2 4.33Å; F278-T282 HydrophobicContact CE2-CG2 3.86Å; F278-T282 HydrophobicContact CZ-CG2 3.98Å; F278-T282 WeakPolarHBondContact O-CG2 3.29Å; F278-T282 PolarHBondContact O-N 3.03Å; F278-V292 HydrophobicContact CE1-CB 4.13Å; F278-V292 HydrophobicContact CE1-CG1 3.93Å; F278-V292 HydrophobicContact CZ-CB 4.43Å; F278-V292 HydrophobicContact CZ-CG1 4.38Å; F278-I295 HydrophobicContact CD1-CD1 3.71Å; F278-I295 HydrophobicContact CD1-CG1 4.26Å; F278-I295 HydrophobicContact CE1-CD1 3.7Å
279	S	97.5	Very high	89.7	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-55.8	-55.2	178.9	-49.3	0	0	0	0	110.3	N260 P275 Q276 F281 T282 F283 I291 V292 F328	N260-S279 PolarHBondContact ND2-OG 3.37Å; P275-S279 PolarHBondContact O-N 3.19Å; P275-S279 PolarHBondContact O-OG 3.39Å; Q276-S279 PolarHBondContact O-N 3.17Å; S279-F281 PolarHBondContact O-N 3.45Å; S279-T282 PolarHBondContact O-N 3.22Å; S279-T282 PolarHBondContact O-OG1 2.79Å; S279-F283 PolarHBondContact O-N 3.02Å; S279-I291 WeakPolarHBondContact O-CG1 3.39Å; S279-V292 WeakPolarHBondContact CA-O 3.43Å; S279-V292 WeakPolarHBondContact CB-O 3.4Å; S279-V292 PolarHBondContact OG-O 3.04Å; S279-F328 VanDerWaalsContact CB-CE2 3.44Å
280	H	97.2	Very high	91.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.2	-40.1	177.1	-179.7	-156.7	0	0	0	113.4	Q276 F278 T282 F283 E284 F328 F329 H332 L343 T344 S551	Q276-H280 WeakPolarHBondContact O-CB 3.4Å; Q276-H280 PolarHBondContact O-N 2.92Å; F278-H280 PolarHBondContact O-N 3.31Å; H280-T282 VanDerWaalsContact C-N 3.32Å; H280-T282 PolarHBondContact O-N 3.11Å; H280-F283 PolarHBondContact O-N 3.01Å; H280-E284 IonicContact NE2-OE1 3.02Å; H280-E284 PolarHBondContact NE2-OE1 3.03Å; H280-E284 PolarHBondContact O-N 2.72Å; H280-F328 HydrophobicContact CB-CE1 4.2Å; H280-F328 HydrophobicContact CB-CZ 4.21Å; H280-F329 AromaticContact CD2-CE1 3.83Å; H280-F329 AromaticContact CD2-CZ 3.95Å; H280-H332 WeakPolarHBondContact CB-NE2 3.47Å; H280-H332 AromaticContact CE1-NE2 3.89Å; H280-H332 AromaticContact CG-NE2 3.25Å; H280-H332 VanDerWaalsContact CG-NE2 3.25Å; H280-H332 AromaticContact ND1-CE1 3.84Å; H280-H332 AromaticContact ND1-NE2 3.04Å; H280-H332 PolarHBondContact ND1-NE2 3.12Å; H280-L343 HydrophobicContact CB-CD1 4.25Å; H280-T344 PolarHBondContact CE1-O 3.26Å; H280-T344 PolarHBondContact NE2-O 3.39Å; H280-T344 VanDerWaalsContact NE2-O 3.13Å; H280-S551 PolarHBondContact NE2-OG 3.21Å
281	F	96.8	Very high	92.9	Very high	3 Å²	3	11.7 Å²	11.7	1%	0.013	5%	0.053	C	C	.	.	H	α-helix	trans	-57.8	-41.8	173.7	170.1	-85.8	0	0	0	112.1	E217 Y218 H221 A277 F278 S279 F283 E284 R285 M341 L343	E217-F281 HydrophobicContact CB-CE1 4.43Å; E217-F281 HydrophobicContact CG-CE1 4.09Å; E217-F281 HydrophobicContact CG-CZ 4.05Å; Y218-F281 VanDerWaalsContact CA-CZ 3.48Å; Y218-F281 HydrophobicContact CD2-CB 3.93Å; Y218-F281 AromaticContact CD2-CD1 3.78Å; Y218-F281 HydrophobicContact CD2-CD1 3.78Å; Y218-F281 HydrophobicContact CD2-CD2 4.13Å; Y218-F281 HydrophobicContact CD2-CE1 4.3Å; Y218-F281 AromaticContact CD2-CG 3.7Å; Y218-F281 HydrophobicContact CD2-CG 3.7Å; Y218-F281 HydrophobicContact CE2-CB 4.32Å; Y218-F281 HydrophobicContact CE2-CG 4.47Å; Y218-F281 HydrophobicContact CG-CD1 4.36Å; H221-F281 HydrophobicContact CB-CE2 4.23Å; H221-F281 AromaticContact CE1-CZ 3.92Å; H221-F281 AromaticContact CG-CE2 3.72Å; H221-F281 AromaticContact ND1-CE2 3.63Å; H221-F281 AromaticContact ND1-CZ 3.47Å; H221-F281 WeakPolarHBondContact ND1-CZ 3.47Å; A277-F281 WeakPolarHBondContact O-CB 3.41Å; A277-F281 PolarHBondContact O-N 2.8Å; F278-F281 WeakPolarHBondContact O-CB 3.16Å; F278-F281 PolarHBondContact O-N 3.36Å; S279-F281 PolarHBondContact O-N 3.45Å; F281-F283 VanDerWaalsContact C-N 3.28Å; F281-F283 PolarHBondContact O-N 3.48Å; F281-E284 PolarHBondContact O-N 2.76Å; F281-R285 HydrophobicContact CD1-CB 4.49Å; F281-R285 HydrophobicContact CD1-CG 4.06Å; F281-R285 HydrophobicContact CD2-CG 3.75Å; F281-R285 HydrophobicContact CE1-CB 4.26Å; F281-R285 HydrophobicContact CE1-CG 3.87Å; F281-R285 HydrophobicContact CE2-CG 3.57Å; F281-R285 HydrophobicContact CG-CG 3.99Å; F281-R285 HydrophobicContact CZ-CB 4.39Å; F281-R285 HydrophobicContact CZ-CG 3.63Å; F281-R285 WeakPolarHBondContact O-CB 3.32Å; F281-R285 WeakPolarHBondContact O-CG 3.38Å; F281-R285 PolarHBondContact O-N 2.96Å; F281-M341 HydrophobicContact CD2-CE 3.45Å; F281-M341 VanDerWaalsContact CD2-CE 3.45Å; F281-M341 HydrophobicContact CE2-CE 3.62Å; F281-M341 HydrophobicContact CG-CE 4.28Å; F281-L343 HydrophobicContact CB-CD1 4.05Å; F281-L343 HydrophobicContact CB-CD2 4.42Å; F281-L343 HydrophobicContact CD2-CD2 4.23Å
282	T	96.6	Very high	94.1	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-66.3	-29.7	179.4	63.2	0	0	0	0	113.1	W214 F278 S279 H280 S286 V292	W214-T282 HydrophobicContact CB-CG2 3.8Å; W214-T282 HydrophobicContact CD2-CG2 4.18Å; W214-T282 HydrophobicContact CE3-CG2 4.09Å; W214-T282 HydrophobicContact CG-CG2 4.09Å; F278-T282 HydrophobicContact CD2-CG2 4.33Å; F278-T282 HydrophobicContact CE2-CG2 3.86Å; F278-T282 HydrophobicContact CZ-CG2 3.98Å; F278-T282 WeakPolarHBondContact O-CG2 3.29Å; F278-T282 PolarHBondContact O-N 3.03Å; S279-T282 PolarHBondContact O-N 3.22Å; S279-T282 PolarHBondContact O-OG1 2.79Å; H280-T282 VanDerWaalsContact C-N 3.32Å; H280-T282 PolarHBondContact O-N 3.11Å; T282-S286 WeakPolarHBondContact O-CB 3.44Å; T282-S286 PolarHBondContact O-N 2.92Å; T282-S286 PolarHBondContact O-OG 2.66Å; T282-V292 HydrophobicContact CG2-CB 4.1Å; T282-V292 HydrophobicContact CG2-CG2 3.79Å; T282-V292 PolarHBondContact OG1-N 3.38Å
283	F	96.6	Very high	94.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-69.5	-53.2	174.2	-177.4	-101.5	0	0	0	112.3	S279 H280 F281 R285 S286 G287 H288 L290 I291 M325 F329 S551 L573 V576	S279-F283 PolarHBondContact O-N 3.02Å; H280-F283 PolarHBondContact O-N 3.01Å; F281-F283 VanDerWaalsContact C-N 3.28Å; F281-F283 PolarHBondContact O-N 3.48Å; F283-R285 VanDerWaalsContact C-N 3.33Å; F283-R285 PolarHBondContact O-N 3.34Å; F283-S286 PolarHBondContact O-N 2.71Å; F283-S286 PolarHBondContact O-OG 3.41Å; F283-S286 VanDerWaalsContact O-OG 3.11Å; F283-G287 PolarHBondContact O-N 3.11Å; F283-H288 AromaticContact CD1-CD2 3.4Å; F283-H288 VanDerWaalsContact CD1-CD2 3.4Å; F283-H288 WeakPolarHBondContact CD1-CD2 3.24Å; F283-H288 AromaticContact CD1-NE2 4Å; F283-H288 HydrophobicContact CD2-CB 4.31Å; F283-H288 HydrophobicContact CE1-CB 4.16Å; F283-H288 AromaticContact CE1-CD2 3.08Å; F283-H288 WeakPolarHBondContact CE1-CD2 3.42Å; F283-H288 AromaticContact CE1-CG 3.61Å; F283-H288 AromaticContact CE1-NE2 3.55Å; F283-H288 HydrophobicContact CE2-CB 3.66Å; F283-H288 HydrophobicContact CZ-CB 3.59Å; F283-H288 AromaticContact CZ-CD2 3.49Å; F283-H288 VanDerWaalsContact CZ-CD2 3.49Å; F283-H288 WeakPolarHBondContact CZ-CD2 3.3Å; F283-H288 AromaticContact CZ-CG 3.5Å; F283-H288 VanDerWaalsContact CZ-CG 3.5Å; F283-H288 WeakPolarHBondContact O-CA 3.09Å; F283-H288 PolarHBondContact O-N 2.97Å; F283-L290 WeakPolarHBondContact CA-O 3.46Å; F283-I291 HydrophobicContact CB-CB 4.19Å; F283-I291 HydrophobicContact CB-CD1 4.09Å; F283-I291 HydrophobicContact CB-CG1 4.06Å; F283-I291 HydrophobicContact CD2-CB 4.35Å; F283-M325 HydrophobicContact CD2-SD 4.24Å; F283-M325 HydrophobicContact CE2-CB 4.41Å; F283-M325 HydrophobicContact CE2-CG 4.34Å; F283-M325 HydrophobicContact CE2-SD 3.76Å; F283-F329 HydrophobicContact CB-CE2 4.5Å; F283-F329 HydrophobicContact CB-CZ 4.31Å; F283-F329 AromaticContact CD1-CE2 3.52Å; F283-F329 HydrophobicContact CD1-CE2 3.52Å; F283-F329 AromaticContact CD1-CZ 3.38Å; F283-F329 HydrophobicContact CD1-CZ 3.38Å; F283-F329 HydrophobicContact CD2-CE2 4.06Å; F283-F329 AromaticContact CE1-CE2 3.51Å; F283-F329 HydrophobicContact CE1-CE2 3.51Å; F283-F329 AromaticContact CE1-CZ 3.69Å; F283-F329 HydrophobicContact CE1-CZ 3.69Å; F283-F329 HydrophobicContact CE2-CE2 4.08Å; F283-F329 AromaticContact CG-CE2 3.78Å; F283-F329 HydrophobicContact CG-CE2 3.78Å; F283-F329 AromaticContact CG-CZ 3.87Å; F283-F329 HydrophobicContact CG-CZ 3.87Å; F283-F329 AromaticContact CZ-CE2 3.8Å; F283-F329 HydrophobicContact CZ-CE2 3.8Å; F283-F329 HydrophobicContact CZ-CZ 4.43Å; F283-S551 WeakPolarHBondContact CD1-OG 3.43Å; F283-L573 HydrophobicContact CE1-CD1 4.29Å; F283-L573 HydrophobicContact CZ-CD1 4.35Å; F283-V576 HydrophobicContact CE2-CG2 4.41Å; F283-V576 HydrophobicContact CZ-CG2 4.41Å
284	E	95	Very high	95	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-65	-36.8	179.1	-69.9	-163.9	158.3	0	0	112.3	H280 F281 G287 L343 T344 H548 R549 S551	H280-E284 IonicContact NE2-OE1 3.02Å; H280-E284 PolarHBondContact NE2-OE1 3.03Å; H280-E284 PolarHBondContact O-N 2.72Å; F281-E284 PolarHBondContact O-N 2.76Å; E284-G287 PolarHBondContact O-N 2.69Å; E284-L343 WeakPolarHBondContact OE2-CA 3.42Å; E284-L343 VanDerWaalsContact OE2-CB 3.3Å; E284-L343 WeakPolarHBondContact OE2-CB 3.26Å; E284-L343 WeakPolarHBondContact OE2-CD2 3.4Å; E284-T344 PolarHBondContact OE1-N 3.17Å; E284-T344 PolarHBondContact OE1-OG1 3.17Å; E284-T344 PolarHBondContact OE2-N 3.13Å; E284-H548 CarbonylContact O-C 3.56Å; E284-H548 WeakPolarHBondContact O-CA 3.24Å; E284-H548 IonicContact OE2-NE2 3.66Å; E284-R549 WeakPolarHBondContact CA-O 3.21Å; E284-R549 WeakPolarHBondContact CB-O 3.27Å; E284-R549 WeakPolarHBondContact CG-O 3.49Å; E284-R549 PolarHBondContact O-N 3.36Å; E284-S551 WeakPolarHBondContact CG-OG 3.49Å; E284-S551 PolarHBondContact OE1-N 3.39Å; E284-S551 PolarHBondContact OE1-OG 2.97Å
285	R	92.8	Very high	95.1	Very high	41 Å²	41	9.5 Å²	9.5	16%	0.155	4%	0.044	C	C	.	.	H	α-helix	trans	-82.8	-18.1	-177.2	-62.2	-71.2	-65.4	179.4	4.9	114.4	W214 E217 H221 F281 F283 G287 R544	W214-R285 HydrophobicContact CZ3-CB 3.91Å; E217-R285 IonicContact OE1-CZ 3.96Å; E217-R285 IonicContact OE1-NE 3.93Å; E217-R285 IonicContact OE1-NH2 3.73Å; E217-R285 PolarHBondContact OE1-NH2 2.95Å; H221-R285 PolarHBondContact CE1-NH2 2.68Å; H221-R285 VanDerWaalsContact CE1-NH2 3.27Å; H221-R285 PolarHBondContact NE2-NH2 3.27Å; F281-R285 HydrophobicContact CD1-CB 4.49Å; F281-R285 HydrophobicContact CD1-CG 4.06Å; F281-R285 HydrophobicContact CD2-CG 3.75Å; F281-R285 HydrophobicContact CE1-CB 4.26Å; F281-R285 HydrophobicContact CE1-CG 3.87Å; F281-R285 HydrophobicContact CE2-CG 3.57Å; F281-R285 HydrophobicContact CG-CG 3.99Å; F281-R285 HydrophobicContact CZ-CB 4.39Å; F281-R285 HydrophobicContact CZ-CG 3.63Å; F281-R285 WeakPolarHBondContact O-CB 3.32Å; F281-R285 WeakPolarHBondContact O-CG 3.38Å; F281-R285 PolarHBondContact O-N 2.96Å; F283-R285 VanDerWaalsContact C-N 3.33Å; F283-R285 PolarHBondContact O-N 3.34Å; R285-G287 VanDerWaalsContact C-N 3.27Å; R285-R544 VanDerWaalsContact O-O 3.08Å
286	S	91.5	Very high	95.1	Very high	4 Å²	4	10.5 Å²	10.5	3%	0.028	5%	0.049	C	C	.	.	H	α-helix	trans	-82.3	-9	165.7	73.1	0	0	0	0	112.5	T282 F283 H288 Q289 L290 V547	T282-S286 WeakPolarHBondContact O-CB 3.44Å; T282-S286 PolarHBondContact O-N 2.92Å; T282-S286 PolarHBondContact O-OG 2.66Å; F283-S286 PolarHBondContact O-N 2.71Å; F283-S286 PolarHBondContact O-OG 3.41Å; F283-S286 VanDerWaalsContact O-OG 3.11Å; S286-H288 PolarHBondContact OG-N 3.3Å; S286-Q289 WeakPolarHBondContact O-CB 3.39Å; S286-Q289 WeakPolarHBondContact O-CG 3.24Å; S286-Q289 PolarHBondContact O-NE2 2.91Å; S286-Q289 PolarHBondContact OG-N 2.93Å; S286-L290 PolarHBondContact OG-N 3.23Å; S286-L290 PolarHBondContact OG-O 3.36Å; S286-V547 CarbonylContact C-O 3.54Å
287	G	91.1	Very high	95.2	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	38.1	-172.5	0	0	0	0	0	111.9	F283 E284 R285 Q289 V547 R549	F283-G287 PolarHBondContact O-N 3.11Å; E284-G287 PolarHBondContact O-N 2.69Å; R285-G287 VanDerWaalsContact C-N 3.27Å; G287-Q289 PolarHBondContact O-N 3.36Å; G287-V547 WeakPolarHBondContact CA-O 3.46Å; G287-V547 PolarHBondContact N-O 2.84Å; G287-R549 WeakPolarHBondContact O-CD 3.29Å; G287-R549 PolarHBondContact O-NE 3.31Å
288	H	93.7	Very high	95	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	2.1	-176.9	-45.7	156.4	0	0	0	114.8	F283 S286 L290 R549 P550 I572	F283-H288 AromaticContact CD1-CD2 3.4Å; F283-H288 VanDerWaalsContact CD1-CD2 3.4Å; F283-H288 WeakPolarHBondContact CD1-CD2 3.24Å; F283-H288 AromaticContact CD1-NE2 4Å; F283-H288 HydrophobicContact CD2-CB 4.31Å; F283-H288 HydrophobicContact CE1-CB 4.16Å; F283-H288 AromaticContact CE1-CD2 3.08Å; F283-H288 WeakPolarHBondContact CE1-CD2 3.42Å; F283-H288 AromaticContact CE1-CG 3.61Å; F283-H288 AromaticContact CE1-NE2 3.55Å; F283-H288 HydrophobicContact CE2-CB 3.66Å; F283-H288 HydrophobicContact CZ-CB 3.59Å; F283-H288 AromaticContact CZ-CD2 3.49Å; F283-H288 VanDerWaalsContact CZ-CD2 3.49Å; F283-H288 WeakPolarHBondContact CZ-CD2 3.3Å; F283-H288 AromaticContact CZ-CG 3.5Å; F283-H288 VanDerWaalsContact CZ-CG 3.5Å; F283-H288 WeakPolarHBondContact O-CA 3.09Å; F283-H288 PolarHBondContact O-N 2.97Å; S286-H288 PolarHBondContact OG-N 3.3Å; H288-L290 VanDerWaalsContact C-N 3.31Å; H288-L290 PolarHBondContact O-N 3.33Å; H288-R549 PolarHBondContact NE2-O 3.42Å; H288-P550 PolarHBondContact CE1-O 3.48Å; H288-P550 PolarHBondContact NE2-O 3.26Å; H288-I572 HydrophobicContact CB-CB 3.82Å; H288-I572 HydrophobicContact CB-CD1 4.26Å; H288-I572 HydrophobicContact CB-CG2 4.2Å; H288-I572 WeakPolarHBondContact O-CG2 3.11Å
289	Q	92.9	Very high	94.7	Very high	101 Å²	101	12.7 Å²	12.7	47%	0.472	7%	0.069	S	C	.	.	S	Bend	trans	-67.1	-29	-179.1	-68	177.2	94.9	0	0	113.5	S286 G287 T309 E310 I572	S286-Q289 WeakPolarHBondContact O-CB 3.39Å; S286-Q289 WeakPolarHBondContact O-CG 3.24Å; S286-Q289 PolarHBondContact O-NE2 2.91Å; S286-Q289 PolarHBondContact OG-N 2.93Å; G287-Q289 PolarHBondContact O-N 3.36Å; Q289-T309 CarbonylContact O-C 3.41Å; Q289-T309 WeakPolarHBondContact O-CA 3.27Å; Q289-E310 PolarHBondContact O-N 2.85Å; Q289-I572 HydrophobicContact CG-CD1 4.04Å
290	L	94.9	Very high	94.5	Very high	20 Å²	20	14.1 Å²	14.1	11%	0.105	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	164.3	174.9	68.1	79.1	0	0	0	112.9	W214 F283 S286 H288 V292 I307 H308 T309	W214-L290 HydrophobicContact CD2-CD1 4.46Å; W214-L290 HydrophobicContact CZ2-CD1 4.04Å; W214-L290 HydrophobicContact CZ2-CD2 4.09Å; W214-L290 HydrophobicContact CZ2-CG 4.25Å; F283-L290 WeakPolarHBondContact CA-O 3.46Å; S286-L290 PolarHBondContact OG-N 3.23Å; S286-L290 PolarHBondContact OG-O 3.36Å; H288-L290 VanDerWaalsContact C-N 3.31Å; H288-L290 PolarHBondContact O-N 3.33Å; L290-V292 HydrophobicContact CD1-CG2 4.22Å; L290-I307 HydrophobicContact CB-CG2 4.03Å; L290-I307 HydrophobicContact CD2-CG2 4.41Å; L290-H308 CarbonylContact C-O 3.52Å; L290-H308 WeakPolarHBondContact CA-O 3.47Å; L290-H308 VanDerWaalsContact CB-O 3.26Å; L290-H308 WeakPolarHBondContact CB-O 3.37Å; L290-T309 HydrophobicContact CB-CG2 4.34Å
291	I	97	Very high	94.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141.8	164.4	-168.2	175.7	0	0	0	110.3	S279 F283 V293 I307 H308 M325 F328	S279-I291 WeakPolarHBondContact O-CG1 3.39Å; F283-I291 HydrophobicContact CB-CB 4.19Å; F283-I291 HydrophobicContact CB-CD1 4.09Å; F283-I291 HydrophobicContact CB-CG1 4.06Å; F283-I291 HydrophobicContact CD2-CB 4.35Å; I291-V293 HydrophobicContact CD1-CG1 4.01Å; I291-V293 HydrophobicContact CG1-CG1 3.99Å; I291-V293 HydrophobicContact CG2-CG1 4.11Å; I291-I307 WeakPolarHBondContact O-CA 3.18Å; I291-H308 HydrophobicContact CG2-CB 3.92Å; I291-H308 PolarHBondContact N-O 2.86Å; I291-H308 PolarHBondContact O-N 3.25Å; I291-M325 HydrophobicContact CG2-CG 3.72Å; I291-F328 HydrophobicContact CD1-CB 4.27Å; I291-F328 HydrophobicContact CD1-CD1 3.36Å; I291-F328 HydrophobicContact CD1-CD2 4.27Å; I291-F328 HydrophobicContact CD1-CE1 3.72Å; I291-F328 HydrophobicContact CD1-CG 3.68Å; I291-F328 HydrophobicContact CD1-CZ 4.32Å
292	V	97.9	Very high	94.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124	172.1	-171	0	0	0	0	109.2	A211 W214 F278 S279 T282 L290 I295 P305 I307	A211-V292 HydrophobicContact CB-CG1 3.89Å; W214-V292 HydrophobicContact CB-CG2 4.12Å; W214-V292 HydrophobicContact CG-CG2 4.08Å; F278-V292 HydrophobicContact CE1-CB 4.13Å; F278-V292 HydrophobicContact CE1-CG1 3.93Å; F278-V292 HydrophobicContact CZ-CB 4.43Å; F278-V292 HydrophobicContact CZ-CG1 4.38Å; S279-V292 WeakPolarHBondContact CA-O 3.43Å; S279-V292 WeakPolarHBondContact CB-O 3.4Å; S279-V292 PolarHBondContact OG-O 3.04Å; T282-V292 HydrophobicContact CG2-CB 4.1Å; T282-V292 HydrophobicContact CG2-CG2 3.79Å; T282-V292 PolarHBondContact OG1-N 3.38Å; L290-V292 HydrophobicContact CD1-CG2 4.22Å; V292-I295 HydrophobicContact CG1-CD1 3.98Å; V292-P305 HydrophobicContact CG1-CB 4.01Å; V292-I307 HydrophobicContact CG2-CG1 4.32Å
293	V	96.8	Very high	94.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	-167.8	-174.6	-66.5	0	0	0	0	110.5	N262 I291 I295 Q306 F328	N262-V293 HydrophobicContact CB-CG2 4.17Å; I291-V293 HydrophobicContact CD1-CG1 4.01Å; I291-V293 HydrophobicContact CG1-CG1 3.99Å; I291-V293 HydrophobicContact CG2-CG1 4.11Å; V293-I295 PolarHBondContact O-N 3.04Å; V293-Q306 HydrophobicContact CG2-CB 4.17Å; V293-Q306 PolarHBondContact N-O 2.9Å; V293-Q306 PolarHBondContact O-N 3.24Å; V293-F328 HydrophobicContact CG1-CB 4.46Å; V293-F328 HydrophobicContact CG1-CD2 4.09Å; V293-F328 HydrophobicContact CG1-CG 4.39Å
294	D	95.2	Very high	94.4	Very high	17 Å²	17	17.9 Å²	17.9	9%	0.091	10%	0.096	C	C	.	.			trans	58.7	30.2	-170.7	-134	69.4	0	0	0	113.2	K258 N260 S261 N262 Q296 Q306	K258-D294 VanDerWaalsContact CE-CG 3.5Å; K258-D294 WeakPolarHBondContact CE-OD1 3.36Å; K258-D294 VanDerWaalsContact CE-OD2 3.31Å; K258-D294 WeakPolarHBondContact CE-OD2 3.2Å; K258-D294 IonicContact NZ-OD1 2.65Å; K258-D294 PolarHBondContact NZ-OD1 3.41Å; K258-D294 IonicContact NZ-OD2 2.95Å; K258-D294 PolarHBondContact NZ-OD2 3.4Å; N260-D294 PolarHBondContact OD1-N 2.97Å; S261-D294 WeakPolarHBondContact CA-OD1 3.31Å; N262-D294 HydrophobicContact CB-CB 4.46Å; N262-D294 PolarHBondContact N-OD1 2.9Å; D294-Q296 VanDerWaalsContact O-CG 3.3Å; D294-Q296 WeakPolarHBondContact O-CG 3.49Å; D294-Q296 PolarHBondContact O-N 2.85Å; D294-Q296 PolarHBondContact O-NE2 2.86Å; D294-Q296 PolarHBondContact OD2-NE2 3.43Å; D294-Q306 HydrophobicContact CB-CB 3.92Å
295	I	95.8	Very high	94.5	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.1	C	C	.	.			trans	-63.9	110.3	-169.7	-52	-57.1	0	0	0	110.6	Y259 N260 P275 F278 V292 V293 Y302	Y259-I295 WeakPolarHBondContact CB-O 3.18Å; Y259-I295 HydrophobicContact CD2-CG2 4.41Å; Y259-I295 WeakPolarHBondContact CD2-O 3.33Å; Y259-I295 PolarHBondContact N-O 3.38Å; N260-I295 PolarHBondContact OD1-N 2.99Å; P275-I295 HydrophobicContact CB-CB 4.18Å; P275-I295 HydrophobicContact CB-CG2 3.85Å; P275-I295 HydrophobicContact CG-CG2 4.44Å; F278-I295 HydrophobicContact CD1-CD1 3.71Å; F278-I295 HydrophobicContact CD1-CG1 4.26Å; F278-I295 HydrophobicContact CE1-CD1 3.7Å; V292-I295 HydrophobicContact CG1-CD1 3.98Å; V293-I295 PolarHBondContact O-N 3.04Å; I295-Y302 HydrophobicContact CG2-CD1 3.88Å; I295-Y302 HydrophobicContact CG2-CD2 3.61Å; I295-Y302 HydrophobicContact CG2-CE1 3.86Å; I295-Y302 HydrophobicContact CG2-CE2 3.56Å; I295-Y302 HydrophobicContact CG2-CG 3.79Å
296	Q	93.3	Very high	94.7	Very high	21 Å²	21	17.6 Å²	17.6	10%	0.098	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.1	-174.3	62.6	-166.9	-41.3	0	0	112.5	Y256 I257 K258 D294 Y302 T303 D304	Y256-Q296 HydrophobicContact CE1-CB 4.14Å; Y256-Q296 HydrophobicContact CE1-CG 4.38Å; Y256-Q296 VanDerWaalsContact OH-CG 3.23Å; Y256-Q296 WeakPolarHBondContact OH-CG 3.13Å; Y256-Q296 PolarHBondContact OH-OE1 2.98Å; I257-Q296 CarbonylContact O-C 3.51Å; I257-Q296 VanDerWaalsContact O-CA 3.27Å; I257-Q296 WeakPolarHBondContact O-CA 3.37Å; K258-Q296 HydrophobicContact CB-CB 3.88Å; K258-Q296 HydrophobicContact CG-CB 4.11Å; D294-Q296 VanDerWaalsContact O-CG 3.3Å; D294-Q296 WeakPolarHBondContact O-CG 3.49Å; D294-Q296 PolarHBondContact O-N 2.85Å; D294-Q296 PolarHBondContact O-NE2 2.86Å; D294-Q296 PolarHBondContact OD2-NE2 3.43Å; Q296-Y302 CarbonylContact O-C 3.02Å; Q296-Y302 WeakPolarHBondContact O-CA 3.49Å; Q296-Y302 VanDerWaalsContact O-CB 3.28Å; Q296-Y302 WeakPolarHBondContact O-CB 3.35Å; Q296-T303 WeakPolarHBondContact CG-O 3.36Å; Q296-T303 PolarHBondContact O-N 2.77Å; Q296-D304 HydrophobicContact CG-CB 4.47Å; Q296-D304 PolarHBondContact NE2-O 2.8Å
297	G	93.5	Very high	94.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.8	-148.2	179.5	0	0	0	0	0	112.5	Y256 I257	Y256-G297 CarbonylContact C-O 3.45Å; Y256-G297 WeakPolarHBondContact CA-O 3.38Å; I257-G297 PolarHBondContact N-O 3.27Å; I257-G297 PolarHBondContact O-N 2.94Å
298	V	92.2	Very high	95.2	Very high	28 Å²	28	17.5 Å²	17.5	17%	0.17	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.6	-178.9	-173.3	0	0	0	0	110.2	I252 D300 L301	I252-V298 HydrophobicContact CB-CG2 4.15Å; I252-V298 HydrophobicContact CG2-CB 3.61Å; I252-V298 HydrophobicContact CG2-CG2 3.6Å; V298-D300 PolarHBondContact O-N 3.23Å; V298-L301 PolarHBondContact N-O 3.05Å; V298-L301 PolarHBondContact O-N 2.85Å
299	G	91.1	Very high	95.2	Very high	30 Å²	30	18 Å²	18	31%	0.309	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	-121.1	-178.9	0	0	0	0	0	111.1	Y259 R272 Y302	Y259-G299 PolarHBondContact OH-O 2.86Å; R272-G299 VanDerWaalsContact NH1-C 3.33Å; R272-G299 PolarHBondContact NH1-O 2.63Å; G299-Y302 WeakPolarHBondContact O-CE1 3.21Å
300	D	93.3	Very high	95.1	Very high	30 Å²	30	16.1 Å²	16.1	16%	0.16	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	18.3	179.1	-57.8	-90.2	0	0	0	111.9	K225 Q226 V227 D228 R272 T274 V298	K225-D300 IonicContact NZ-OD2 3.36Å; K225-D300 PolarHBondContact NZ-OD2 3.05Å; Q226-D300 WeakPolarHBondContact O-CB 3.36Å; V227-D300 CarbonylContact C-O 3.48Å; V227-D300 VanDerWaalsContact CA-O 3.24Å; V227-D300 WeakPolarHBondContact CA-O 3.49Å; V227-D300 HydrophobicContact CG1-CB 4.46Å; D228-D300 PolarHBondContact N-O 3.12Å; R272-D300 IonicContact CZ-OD1 2.91Å; R272-D300 IonicContact CZ-OD2 3.94Å; R272-D300 IonicContact NH1-OD1 2.77Å; R272-D300 IonicContact NH1-OD2 3.83Å; R272-D300 IonicContact NH2-OD1 3.83Å; R272-D300 PolarHBondContact NH2-OD1 2.65Å; R272-D300 IonicContact NH2-OD2 2.62Å; R272-D300 PolarHBondContact NH2-OD2 2.94Å; T274-D300 PolarHBondContact OG1-OD1 2.81Å; V298-D300 PolarHBondContact O-N 3.23Å
301	L	95.3	Very high	94.7	Very high	54 Å²	54	22.3 Å²	22.3	28%	0.283	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.7	170.2	176.3	59.2	0	0	0	108.7	D228 M230 I252 V298	D228-L301 HydrophobicContact CB-CD1 4.07Å; D228-L301 WeakPolarHBondContact O-CA 3.4Å; M230-L301 HydrophobicContact CE-CD1 4.32Å; M230-L301 HydrophobicContact CE-CD2 3.93Å; M230-L301 HydrophobicContact CE-CG 4.41Å; I252-L301 HydrophobicContact CD1-CD2 4.42Å; I252-L301 HydrophobicContact CD1-CG 4.17Å; I252-L301 HydrophobicContact CG1-CD2 4.34Å; I252-L301 HydrophobicContact CG2-CD2 4.01Å; I252-L301 HydrophobicContact CG2-CG 4.49Å; V298-L301 PolarHBondContact N-O 3.05Å; V298-L301 PolarHBondContact O-N 2.85Å
302	Y	97.3	Very high	94.3	Very high	1 Å²	1	23.6 Å²	23.6	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	161.8	-169.7	-50.5	-40.6	0	0	0	112.6	V227 D228 I229 M230 Y259 I295 Q296 G299	V227-Y302 HydrophobicContact CB-CD2 4.31Å; V227-Y302 HydrophobicContact CB-CE2 3.66Å; V227-Y302 HydrophobicContact CG1-CE2 3.67Å; V227-Y302 HydrophobicContact CG2-CE2 4.32Å; D228-Y302 PolarHBondContact O-N 2.75Å; I229-Y302 CarbonylContact C-O 3.59Å; I229-Y302 WeakPolarHBondContact CA-O 3.48Å; I229-Y302 HydrophobicContact CG1-CD2 4.48Å; M230-Y302 PolarHBondContact N-O 2.99Å; Y259-Y302 HydrophobicContact CD2-CE1 4.27Å; Y259-Y302 AromaticContact CE2-CE1 3.99Å; Y259-Y302 HydrophobicContact CE2-CE1 3.99Å; I295-Y302 HydrophobicContact CG2-CD1 3.88Å; I295-Y302 HydrophobicContact CG2-CD2 3.61Å; I295-Y302 HydrophobicContact CG2-CE1 3.86Å; I295-Y302 HydrophobicContact CG2-CE2 3.56Å; I295-Y302 HydrophobicContact CG2-CG 3.79Å; Q296-Y302 CarbonylContact O-C 3.02Å; Q296-Y302 WeakPolarHBondContact O-CA 3.49Å; Q296-Y302 VanDerWaalsContact O-CB 3.28Å; Q296-Y302 WeakPolarHBondContact O-CB 3.35Å; G299-Y302 WeakPolarHBondContact O-CE1 3.21Å
303	T	96.8	Very high	93.8	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	171.5	167.6	-163.3	0	0	0	0	109.9	Q208 E249 I252 Y256 Q296 P305	Q208-T303 PolarHBondContact NE2-OG1 3Å; Q208-T303 PolarHBondContact OE1-OG1 2.81Å; E249-T303 WeakPolarHBondContact OE2-CB 3.21Å; E249-T303 PolarHBondContact OE2-OG1 2.87Å; I252-T303 HydrophobicContact CD1-CG2 4.46Å; Y256-T303 HydrophobicContact CE2-CG2 4.2Å; Q296-T303 WeakPolarHBondContact CG-O 3.36Å; Q296-T303 PolarHBondContact O-N 2.77Å; T303-P305 VanDerWaalsContact C-CD 3.47Å
304	D	95.3	Very high	93.3	Very high	26 Å²	26	31.3 Å²	31.3	14%	0.139	18%	0.176	C	C	.	.	S	Bend	trans	46.9	51.1	-178	-61.8	-27.8	0	0	0	114.5	R164 K190 Q208 Q296	R164-D304 IonicContact CZ-OD1 2.64Å; R164-D304 IonicContact NH1-OD1 2.83Å; R164-D304 IonicContact NH2-OD1 1.82Å; R164-D304 PolarHBondContact NH2-OD1 3.27Å; R164-D304 IonicContact NH2-OD2 3.51Å; R164-D304 PolarHBondContact NH2-OD2 3.26Å; K190-D304 IonicContact NZ-OD1 2.72Å; K190-D304 PolarHBondContact NZ-OD1 3.29Å; K190-D304 IonicContact NZ-OD2 2.77Å; K190-D304 PolarHBondContact NZ-OD2 3.15Å; Q208-D304 VanDerWaalsContact OE1-N 3.11Å; Q296-D304 HydrophobicContact CG-CB 4.47Å; Q296-D304 PolarHBondContact NE2-O 2.8Å
305	P	96.9	Very high	93	Very high	10 Å²	10	32.5 Å²	32.5	7%	0.065	18%	0.18	C	C	.	.			trans	-72.2	164	171.7	34.3	-35.2	0	0	0	111.1	L207 Q208 A211 I229 V292 T303	L207-P305 HydrophobicContact CD2-CG 4.02Å; L207-P305 WeakPolarHBondContact CD2-O 3.26Å; Q208-P305 HydrophobicContact CG-CG 4.36Å; A211-P305 HydrophobicContact CB-CB 4.16Å; A211-P305 HydrophobicContact CB-CG 3.6Å; I229-P305 HydrophobicContact CD1-CB 4.44Å; I229-P305 HydrophobicContact CD1-CG 4.24Å; I229-P305 HydrophobicContact CG2-CG 4.26Å; V292-P305 HydrophobicContact CG1-CB 4.01Å; T303-P305 VanDerWaalsContact C-CD 3.47Å
306	Q	96.9	Very high	92.5	Very high	26 Å²	26	34 Å²	34	12%	0.121	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	149.1	162.8	-177.5	60.4	51.9	0	0	109.8	N262 V293 D294 F315 G318	N262-Q306 HydrophobicContact CB-CB 3.94Å; N262-Q306 HydrophobicContact CB-CG 3.89Å; V293-Q306 HydrophobicContact CG2-CB 4.17Å; V293-Q306 PolarHBondContact N-O 2.9Å; V293-Q306 PolarHBondContact O-N 3.24Å; D294-Q306 HydrophobicContact CB-CB 3.92Å; Q306-F315 PolarHBondContact NE2-O 3.19Å; Q306-G318 WeakPolarHBondContact CG-O 3.48Å
307	I	96.2	Very high	92.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.4	167.1	-62.8	173.3	0	0	0	108.4	L207 E210 A211 L290 I291 V292 T309 F315	L207-I307 HydrophobicContact CD2-CB 4.46Å; L207-I307 HydrophobicContact CD2-CD1 4.02Å; L207-I307 HydrophobicContact CD2-CG1 3.78Å; L207-I307 HydrophobicContact CG-CB 4.44Å; L207-I307 HydrophobicContact CG-CD1 4.19Å; L207-I307 HydrophobicContact CG-CG1 4.15Å; E210-I307 HydrophobicContact CB-CD1 4.06Å; A211-I307 HydrophobicContact CB-CD1 4.36Å; L290-I307 HydrophobicContact CB-CG2 4.03Å; L290-I307 HydrophobicContact CD2-CG2 4.41Å; I291-I307 WeakPolarHBondContact O-CA 3.18Å; V292-I307 HydrophobicContact CG2-CG1 4.32Å; I307-T309 HydrophobicContact CG2-CG2 4.09Å; I307-F315 HydrophobicContact CB-CB 4.4Å; I307-F315 HydrophobicContact CB-CD2 3.86Å; I307-F315 HydrophobicContact CB-CE2 4.29Å; I307-F315 HydrophobicContact CB-CG 4.11Å; I307-F315 HydrophobicContact CD1-CD1 4.3Å; I307-F315 HydrophobicContact CD1-CD2 4.45Å; I307-F315 HydrophobicContact CD1-CE1 4.09Å; I307-F315 HydrophobicContact CD1-CE2 4.26Å; I307-F315 HydrophobicContact CD1-CG 4.47Å; I307-F315 HydrophobicContact CD1-CZ 4.07Å; I307-F315 HydrophobicContact CG2-CD2 3.7Å; I307-F315 HydrophobicContact CG2-CE2 3.8Å; I307-F315 HydrophobicContact CG2-CG 4.45Å
308	H	96.9	Very high	92	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.6	161.6	-58.9	-47	0	0	0	109.5	N262 L290 I291 G318 N319 L320 G324 M325	N262-H308 PolarHBondContact O-CE1 3Å; N262-H308 PolarHBondContact O-NE2 3.37Å; L290-H308 CarbonylContact C-O 3.52Å; L290-H308 WeakPolarHBondContact CA-O 3.47Å; L290-H308 VanDerWaalsContact CB-O 3.26Å; L290-H308 WeakPolarHBondContact CB-O 3.37Å; I291-H308 HydrophobicContact CG2-CB 3.92Å; I291-H308 PolarHBondContact N-O 2.86Å; I291-H308 PolarHBondContact O-N 3.25Å; H308-G318 PolarHBondContact CE1-O 3.06Å; H308-G318 VanDerWaalsContact CE1-O 3.27Å; H308-N319 VanDerWaalsContact CA-OD1 3.24Å; H308-N319 WeakPolarHBondContact CA-OD1 3.46Å; H308-N319 WeakPolarHBondContact ND1-CA 3.37Å; H308-L320 PolarHBondContact CE1-N 2.82Å; H308-L320 PolarHBondContact ND1-N 3.47Å; H308-G324 VanDerWaalsContact CD2-CA 3.46Å; H308-G324 WeakPolarHBondContact CD2-CA 3.43Å; H308-G324 WeakPolarHBondContact NE2-CA 3.38Å; H308-M325 HydrophobicContact CB-CE 4.36Å; H308-M325 HydrophobicContact CB-CG 4.33Å
309	T	94.2	Very high	92.1	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	163.2	176.5	63.6	0	0	0	0	111.3	Q289 L290 I307 K311 G312 D314 F315 N319 G321 M325	Q289-T309 CarbonylContact O-C 3.41Å; Q289-T309 WeakPolarHBondContact O-CA 3.27Å; L290-T309 HydrophobicContact CB-CG2 4.34Å; I307-T309 HydrophobicContact CG2-CG2 4.09Å; T309-K311 PolarHBondContact O-N 3.49Å; T309-G312 PolarHBondContact O-N 3.25Å; T309-G312 PolarHBondContact OG1-N 3.4Å; T309-D314 WeakPolarHBondContact CB-OD2 3.4Å; T309-D314 PolarHBondContact OG1-OD2 3.36Å; T309-F315 HydrophobicContact CG2-CD2 3.7Å; T309-F315 HydrophobicContact CG2-CE2 3.65Å; T309-N319 PolarHBondContact N-ND2 3.45Å; T309-N319 PolarHBondContact N-OD1 2.89Å; T309-N319 VanDerWaalsContact N-OD1 3.11Å; T309-N319 PolarHBondContact OG1-ND2 2.94Å; T309-G321 CarbonylContact O-C 3.43Å; T309-G321 VanDerWaalsContact O-CA 3.24Å; T309-G321 WeakPolarHBondContact O-CA 3.49Å; T309-M325 VanDerWaalsContact C-CE 3.46Å
310	E	89.9	Confident	92.3	Very high	62 Å²	62	41.3 Å²	41.3	29%	0.29	23%	0.232	S	C	.	.	S	Bend	trans	-56.7	-37.1	175.4	-177.2	-95.5	173.4	0	0	112.7	Q289 V322 I572 K575	Q289-E310 PolarHBondContact O-N 2.85Å; E310-V322 HydrophobicContact CG-CG1 4.44Å; E310-I572 HydrophobicContact CB-CD1 4.17Å; E310-I572 HydrophobicContact CB-CG2 4.02Å; E310-I572 HydrophobicContact CG-CB 4.36Å; E310-I572 HydrophobicContact CG-CD1 3.94Å; E310-I572 HydrophobicContact CG-CG1 3.93Å; E310-I572 HydrophobicContact CG-CG2 3.6Å; E310-K575 IonicContact OE1-NZ 3.71Å; E310-K575 PolarHBondContact OE1-NZ 3.42Å
311	K	87.5	Confident	92.4	Very high	150 Å²	150	40.1 Å²	40.1	65%	0.652	23%	0.227	S	C	*	.	S	Bend	trans	-77	-34.4	179.7	-62.5	-174.8	177.6	-174.7	0	114.5	T309 T313	T309-K311 PolarHBondContact O-N 3.49Å; K311-T313 VanDerWaalsContact C-N 3.26Å; K311-T313 HydrophobicContact CB-CG2 4.39Å; K311-T313 WeakPolarHBondContact CB-OG1 3.49Å; K311-T313 PolarHBondContact O-N 3.18Å
312	G	88.9	Confident	92.5	Very high	27 Å²	27	38.8 Å²	38.8	28%	0.278	22%	0.221	S	C	.	.	S	Bend	trans	74	7.4	-172.5	0	0	0	0	0	115.6	T309	T309-G312 PolarHBondContact O-N 3.25Å; T309-G312 PolarHBondContact OG1-N 3.4Å
313	T	87.5	Confident	92.4	Very high	107 Å²	107	45.7 Å²	45.7	66%	0.656	25%	0.247	S	C	*	.			trans	-99.5	-6.4	-171.8	50.2	0	0	0	0	115.2	K311	K311-T313 VanDerWaalsContact C-N 3.26Å; K311-T313 HydrophobicContact CB-CG2 4.39Å; K311-T313 WeakPolarHBondContact CB-OG1 3.49Å; K311-T313 PolarHBondContact O-N 3.18Å
314	D	85.8	Confident	92.4	Very high	56 Å²	56	45.7 Å²	45.7	30%	0.299	25%	0.248	S	C	.	.	S	Bend	trans	-123.7	156.7	-167.4	-15.4	-77.4	0	0	0	109.8	T309 N319	T309-D314 WeakPolarHBondContact CB-OD2 3.4Å; T309-D314 PolarHBondContact OG1-OD2 3.36Å; D314-N319 VanDerWaalsContact O-CB 3.27Å; D314-N319 WeakPolarHBondContact O-CB 3.08Å; D314-N319 PolarHBondContact O-ND2 3.38Å
315	F	88.2	Confident	92.5	Very high	41 Å²	41	44.5 Å²	44.5	18%	0.18	24%	0.241	C	C	.	.	S	Bend	trans	66.5	33.8	-179.3	-49.3	-70.7	0	0	0	114.7	E203 L207 E210 Q306 I307 T309	E203-F315 VanDerWaalsContact OE1-CA 3.26Å; E203-F315 WeakPolarHBondContact OE1-CA 3.11Å; E203-F315 PolarHBondContact OE1-N 3.35Å; L207-F315 HydrophobicContact CB-CB 4.4Å; L207-F315 HydrophobicContact CB-CD1 3.73Å; L207-F315 HydrophobicContact CB-CE1 4.49Å; L207-F315 HydrophobicContact CB-CG 4.45Å; L207-F315 HydrophobicContact CD1-CB 3.89Å; L207-F315 HydrophobicContact CG-CB 3.92Å; L207-F315 HydrophobicContact CG-CD1 3.91Å; L207-F315 HydrophobicContact CG-CG 4.18Å; E210-F315 HydrophobicContact CG-CE1 4.34Å; Q306-F315 PolarHBondContact NE2-O 3.19Å; I307-F315 HydrophobicContact CB-CB 4.4Å; I307-F315 HydrophobicContact CB-CD2 3.86Å; I307-F315 HydrophobicContact CB-CE2 4.29Å; I307-F315 HydrophobicContact CB-CG 4.11Å; I307-F315 HydrophobicContact CD1-CD1 4.3Å; I307-F315 HydrophobicContact CD1-CD2 4.45Å; I307-F315 HydrophobicContact CD1-CE1 4.09Å; I307-F315 HydrophobicContact CD1-CE2 4.26Å; I307-F315 HydrophobicContact CD1-CG 4.47Å; I307-F315 HydrophobicContact CD1-CZ 4.07Å; I307-F315 HydrophobicContact CG2-CD2 3.7Å; I307-F315 HydrophobicContact CG2-CE2 3.8Å; I307-F315 HydrophobicContact CG2-CG 4.45Å; T309-F315 HydrophobicContact CG2-CD2 3.7Å; T309-F315 HydrophobicContact CG2-CE2 3.65Å
316	G	85.3	Confident	92.5	Very high	33 Å²	33	44 Å²	44	34%	0.34	24%	0.238	S	C	.	.			trans	66.7	177.3	173	0	0	0	0	0	116.3	E203 G318 N319	E203-G316 PolarHBondContact OE1-N 2.77Å; G316-G318 PolarHBondContact O-N 3.38Å; G316-N319 WeakPolarHBondContact O-CB 3.44Å; G316-N319 PolarHBondContact O-N 3.22Å
317	D	87.6	Confident	92.4	Very high	156 Å²	156	43.2 Å²	43.2	83%	0.834	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-16.1	-174.2	-54.7	-30	0	0	0	115	N319	D317-N319 PolarHBondContact O-N 3.35Å
318	G	90.1	Very high	92.4	Very high	19 Å²	19	43.3 Å²	43.3	20%	0.196	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-16.1	174	0	0	0	0	0	114.1	N262 Q306 H308 G316 L320	N262-G318 PolarHBondContact ND2-O 3.03Å; Q306-G318 WeakPolarHBondContact CG-O 3.48Å; H308-G318 PolarHBondContact CE1-O 3.06Å; H308-G318 VanDerWaalsContact CE1-O 3.27Å; G316-G318 PolarHBondContact O-N 3.38Å; G318-L320 PolarHBondContact O-N 3.44Å
319	N	93.4	Very high	92.3	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.053	24%	0.235	C	C	.	.			trans	-77.4	107.6	174.8	-176.8	-4.4	0	0	0	110.5	H308 T309 D314 G316 D317 G321	H308-N319 VanDerWaalsContact CA-OD1 3.24Å; H308-N319 WeakPolarHBondContact CA-OD1 3.46Å; H308-N319 WeakPolarHBondContact ND1-CA 3.37Å; T309-N319 PolarHBondContact N-ND2 3.45Å; T309-N319 PolarHBondContact N-OD1 2.89Å; T309-N319 VanDerWaalsContact N-OD1 3.11Å; T309-N319 PolarHBondContact OG1-ND2 2.94Å; D314-N319 VanDerWaalsContact O-CB 3.27Å; D314-N319 WeakPolarHBondContact O-CB 3.08Å; D314-N319 PolarHBondContact O-ND2 3.38Å; G316-N319 WeakPolarHBondContact O-CB 3.44Å; G316-N319 PolarHBondContact O-N 3.22Å; D317-N319 PolarHBondContact O-N 3.35Å; N319-G321 VanDerWaalsContact C-N 3.31Å; N319-G321 WeakPolarHBondContact OD1-CA 3.13Å; N319-G321 PolarHBondContact OD1-N 2.96Å
320	L	95.4	Very high	92.2	Very high	47 Å²	47	44.4 Å²	44.4	25%	0.246	24%	0.239	C	C	.	.			trans	-90.6	5.4	179.8	-58.4	179.6	0	0	0	112.9	H308 G318 R323 G324 L327	H308-L320 PolarHBondContact CE1-N 2.82Å; H308-L320 PolarHBondContact ND1-N 3.47Å; G318-L320 PolarHBondContact O-N 3.44Å; L320-R323 WeakPolarHBondContact O-CB 3.26Å; L320-R323 PolarHBondContact O-N 3.34Å; L320-R323 PolarHBondContact O-NE 3.13Å; L320-G324 PolarHBondContact O-N 3.42Å; L320-L327 HydrophobicContact CD1-CD1 4.25Å
321	G	95.8	Very high	92.1	Very high	6 Å²	6	42.6 Å²	42.6	6%	0.062	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	-151.1	-178.4	0	0	0	0	0	113.4	T309 N319 R323 G324 M325	T309-G321 CarbonylContact O-C 3.43Å; T309-G321 VanDerWaalsContact O-CA 3.24Å; T309-G321 WeakPolarHBondContact O-CA 3.49Å; N319-G321 VanDerWaalsContact C-N 3.31Å; N319-G321 WeakPolarHBondContact OD1-CA 3.13Å; N319-G321 PolarHBondContact OD1-N 2.96Å; G321-R323 PolarHBondContact O-N 3.04Å; G321-R323 VanDerWaalsContact O-N 3.08Å; G321-G324 PolarHBondContact O-N 3.46Å; G321-M325 PolarHBondContact O-N 3Å
322	V	96.4	Very high	92.3	Very high	26 Å²	26	35.9 Å²	35.9	16%	0.158	20%	0.204	C	C	.	.	H	α-helix	trans	-55.1	-24	170.8	-63	0	0	0	0	113.5	E310 M325 A326 I572 K575 V576	E310-V322 HydrophobicContact CG-CG1 4.44Å; V322-M325 HydrophobicContact CG1-SD 4.3Å; V322-M325 WeakPolarHBondContact O-CB 3.32Å; V322-M325 PolarHBondContact O-N 3.01Å; V322-A326 PolarHBondContact O-N 2.77Å; V322-I572 HydrophobicContact CG1-CG2 4.01Å; V322-K575 HydrophobicContact CB-CB 4.37Å; V322-K575 HydrophobicContact CG1-CB 4.05Å; V322-K575 HydrophobicContact CG2-CB 4.38Å; V322-V576 HydrophobicContact CB-CG2 4.14Å; V322-V576 HydrophobicContact CG1-CG2 4.45Å
323	R	96.1	Very high	92.2	Very high	146 Å²	146	36.4 Å²	36.4	55%	0.551	20%	0.2	S	C	*	.	H	α-helix	trans	-68.7	-40.2	174.5	-47.7	177.5	-68.9	-171.6	-3.1	111.4	L320 G321 M325 A326 L327 A579 Y583	L320-R323 WeakPolarHBondContact O-CB 3.26Å; L320-R323 PolarHBondContact O-N 3.34Å; L320-R323 PolarHBondContact O-NE 3.13Å; G321-R323 PolarHBondContact O-N 3.04Å; G321-R323 VanDerWaalsContact O-N 3.08Å; R323-M325 VanDerWaalsContact C-N 3.29Å; R323-M325 PolarHBondContact O-N 2.7Å; R323-A326 WeakPolarHBondContact O-CB 3.46Å; R323-A326 PolarHBondContact O-N 2.95Å; R323-L327 WeakPolarHBondContact O-CG 3.35Å; R323-L327 PolarHBondContact O-N 3.34Å; R323-A579 HydrophobicContact CG-CB 4.4Å; R323-Y583 HydrophobicContact CB-CE2 3.89Å; R323-Y583 WeakPolarHBondContact CB-OH 3.31Å; R323-Y583 WeakPolarHBondContact O-CE2 3.31Å
324	G	96.2	Very high	92.4	Very high	1 Å²	1	32 Å²	32	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-64.2	-33.2	172.9	0	0	0	0	0	113.4	H308 L320 G321 F328	H308-G324 VanDerWaalsContact CD2-CA 3.46Å; H308-G324 WeakPolarHBondContact CD2-CA 3.43Å; H308-G324 WeakPolarHBondContact NE2-CA 3.38Å; L320-G324 PolarHBondContact O-N 3.42Å; G321-G324 PolarHBondContact O-N 3.46Å; G324-F328 PolarHBondContact O-N 2.98Å
325	M	97.4	Very high	92.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67	-44.5	172.7	-59.5	171.4	-177	0	0	111.3	F283 I291 H308 T309 G321 V322 R323 F328 F329 V576	F283-M325 HydrophobicContact CD2-SD 4.24Å; F283-M325 HydrophobicContact CE2-CB 4.41Å; F283-M325 HydrophobicContact CE2-CG 4.34Å; F283-M325 HydrophobicContact CE2-SD 3.76Å; I291-M325 HydrophobicContact CG2-CG 3.72Å; H308-M325 HydrophobicContact CB-CE 4.36Å; H308-M325 HydrophobicContact CB-CG 4.33Å; T309-M325 VanDerWaalsContact C-CE 3.46Å; G321-M325 PolarHBondContact O-N 3Å; V322-M325 HydrophobicContact CG1-SD 4.3Å; V322-M325 WeakPolarHBondContact O-CB 3.32Å; V322-M325 PolarHBondContact O-N 3.01Å; R323-M325 VanDerWaalsContact C-N 3.29Å; R323-M325 PolarHBondContact O-N 2.7Å; M325-F328 WeakPolarHBondContact O-CB 3.44Å; M325-F328 PolarHBondContact O-N 3.08Å; M325-F329 VanDerWaalsContact O-CD2 3.31Å; M325-F329 WeakPolarHBondContact O-CD2 3.39Å; M325-F329 PolarHBondContact O-N 2.83Å; M325-V576 HydrophobicContact CB-CG1 4.43Å; M325-V576 HydrophobicContact CB-CG2 3.68Å; M325-V576 HydrophobicContact CG-CG2 4.47Å; M325-V576 HydrophobicContact SD-CG2 4Å
326	A	97.1	Very high	92.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-47.8	175	0	0	0	0	0	112.1	V322 R323 F328 F329 H330 V576 A579 M580 Y583	V322-A326 PolarHBondContact O-N 2.77Å; R323-A326 WeakPolarHBondContact O-CB 3.46Å; R323-A326 PolarHBondContact O-N 2.95Å; A326-F328 VanDerWaalsContact C-N 3.28Å; A326-F328 PolarHBondContact O-N 3.3Å; A326-F329 PolarHBondContact O-N 3.46Å; A326-H330 PolarHBondContact O-N 3.44Å; A326-V576 HydrophobicContact CB-CG1 4.17Å; A326-A579 HydrophobicContact CB-CB 3.85Å; A326-M580 HydrophobicContact CB-CG 3.9Å; A326-M580 HydrophobicContact CB-SD 3.8Å; A326-M580 VanDerWaalsContact O-SD 3.37Å; A326-Y583 HydrophobicContact CB-CD2 4.35Å; A326-Y583 HydrophobicContact CB-CE2 4.39Å
327	L	95.6	Very high	92.9	Very high	10 Å²	10	30 Å²	30	5%	0.052	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-36.9	175.8	-69.5	178.8	0	0	0	113	G264 L320 R323 Y583 F589	G264-L327 WeakPolarHBondContact CA-O 3.31Å; L320-L327 HydrophobicContact CD1-CD1 4.25Å; R323-L327 WeakPolarHBondContact O-CG 3.35Å; R323-L327 PolarHBondContact O-N 3.34Å; L327-Y583 HydrophobicContact CD1-CE2 4.33Å; L327-Y583 WeakPolarHBondContact CD1-OH 3.43Å; L327-Y583 HydrophobicContact CD2-CD1 4.4Å; L327-Y583 HydrophobicContact CD2-CD2 4Å; L327-Y583 HydrophobicContact CD2-CE1 4.11Å; L327-Y583 HydrophobicContact CD2-CE2 3.69Å; L327-Y583 HydrophobicContact CD2-CG 4.35Å; L327-Y583 HydrophobicContact CG-CD2 4.36Å; L327-Y583 HydrophobicContact CG-CE2 3.63Å; L327-F589 HydrophobicContact CD2-CE1 3.83Å; L327-F589 HydrophobicContact CD2-CZ 4.13Å
328	F	95.4	Very high	93.2	Very high	3 Å²	3	22.6 Å²	22.6	1%	0.013	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-45.9	172.6	170	-94.5	0	0	0	111.7	S279 H280 I291 V293 G324 M325 A326 S331 H332	S279-F328 VanDerWaalsContact CB-CE2 3.44Å; H280-F328 HydrophobicContact CB-CE1 4.2Å; H280-F328 HydrophobicContact CB-CZ 4.21Å; I291-F328 HydrophobicContact CD1-CB 4.27Å; I291-F328 HydrophobicContact CD1-CD1 3.36Å; I291-F328 HydrophobicContact CD1-CD2 4.27Å; I291-F328 HydrophobicContact CD1-CE1 3.72Å; I291-F328 HydrophobicContact CD1-CG 3.68Å; I291-F328 HydrophobicContact CD1-CZ 4.32Å; V293-F328 HydrophobicContact CG1-CB 4.46Å; V293-F328 HydrophobicContact CG1-CD2 4.09Å; V293-F328 HydrophobicContact CG1-CG 4.39Å; G324-F328 PolarHBondContact O-N 2.98Å; M325-F328 WeakPolarHBondContact O-CB 3.44Å; M325-F328 PolarHBondContact O-N 3.08Å; A326-F328 VanDerWaalsContact C-N 3.28Å; A326-F328 PolarHBondContact O-N 3.3Å; F328-S331 PolarHBondContact O-N 3.2Å; F328-S331 PolarHBondContact O-OG 2.77Å; F328-H332 HydrophobicContact CD1-CB 4.25Å; F328-H332 HydrophobicContact CE1-CB 3.74Å; F328-H332 AromaticContact CE1-CD2 3.73Å; F328-H332 AromaticContact CE1-CG 3.63Å; F328-H332 HydrophobicContact CE2-CB 4.22Å; F328-H332 HydrophobicContact CZ-CB 3.71Å; F328-H332 AromaticContact CZ-CD2 3.95Å; F328-H332 AromaticContact CZ-CG 3.5Å; F328-H332 VanDerWaalsContact CZ-CG 3.5Å; F328-H332 AromaticContact CZ-ND1 3.68Å; F328-H332 VanDerWaalsContact O-CB 3.25Å; F328-H332 WeakPolarHBondContact O-CB 3.16Å; F328-H332 PolarHBondContact O-N 2.92Å
329	F	94.9	Very high	93.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70.5	-35.2	-174.8	-83.7	-64.8	0	0	0	114	H280 F283 M325 A326 S331 H332 F346 V576	H280-F329 AromaticContact CD2-CE1 3.83Å; H280-F329 AromaticContact CD2-CZ 3.95Å; F283-F329 HydrophobicContact CB-CE2 4.5Å; F283-F329 HydrophobicContact CB-CZ 4.31Å; F283-F329 AromaticContact CD1-CE2 3.52Å; F283-F329 HydrophobicContact CD1-CE2 3.52Å; F283-F329 AromaticContact CD1-CZ 3.38Å; F283-F329 HydrophobicContact CD1-CZ 3.38Å; F283-F329 HydrophobicContact CD2-CE2 4.06Å; F283-F329 AromaticContact CE1-CE2 3.51Å; F283-F329 HydrophobicContact CE1-CE2 3.51Å; F283-F329 AromaticContact CE1-CZ 3.69Å; F283-F329 HydrophobicContact CE1-CZ 3.69Å; F283-F329 HydrophobicContact CE2-CE2 4.08Å; F283-F329 AromaticContact CG-CE2 3.78Å; F283-F329 HydrophobicContact CG-CE2 3.78Å; F283-F329 AromaticContact CG-CZ 3.87Å; F283-F329 HydrophobicContact CG-CZ 3.87Å; F283-F329 AromaticContact CZ-CE2 3.8Å; F283-F329 HydrophobicContact CZ-CE2 3.8Å; F283-F329 HydrophobicContact CZ-CZ 4.43Å; M325-F329 VanDerWaalsContact O-CD2 3.31Å; M325-F329 WeakPolarHBondContact O-CD2 3.39Å; M325-F329 PolarHBondContact O-N 2.83Å; A326-F329 PolarHBondContact O-N 3.46Å; F329-S331 PolarHBondContact O-N 3.34Å; F329-H332 AromaticContact CE1-CD2 3.98Å; F329-H332 PolarHBondContact O-N 3.33Å; F329-H332 VanDerWaalsContact O-N 3.17Å; F329-F346 HydrophobicContact CB-CD1 3.67Å; F329-F346 HydrophobicContact CB-CD2 4.25Å; F329-F346 HydrophobicContact CB-CE1 3.67Å; F329-F346 HydrophobicContact CB-CE2 4.26Å; F329-F346 HydrophobicContact CB-CG 3.96Å; F329-F346 HydrophobicContact CB-CZ 3.98Å; F329-F346 HydrophobicContact CD1-CB 3.46Å; F329-F346 VanDerWaalsContact CD1-CB 3.46Å; F329-F346 HydrophobicContact CD1-CD1 4.08Å; F329-F346 AromaticContact CD1-CD2 3.91Å; F329-F346 HydrophobicContact CD1-CD2 3.91Å; F329-F346 AromaticContact CD1-CG 3.57Å; F329-F346 HydrophobicContact CD1-CG 3.57Å; F329-F346 HydrophobicContact CD2-CD2 4.14Å; F329-F346 HydrophobicContact CD2-CE2 4.23Å; F329-F346 HydrophobicContact CE1-CB 3.81Å; F329-F346 HydrophobicContact CE1-CD2 4.3Å; F329-F346 HydrophobicContact CE1-CG 4.21Å; F329-F346 HydrophobicContact CG-CB 4.19Å; F329-F346 HydrophobicContact CG-CD1 4.03Å; F329-F346 AromaticContact CG-CD2 3.83Å; F329-F346 HydrophobicContact CG-CD2 3.83Å; F329-F346 HydrophobicContact CG-CE1 4.31Å; F329-F346 HydrophobicContact CG-CE2 4.13Å; F329-F346 AromaticContact CG-CG 3.77Å; F329-F346 HydrophobicContact CG-CG 3.77Å; F329-F346 HydrophobicContact CG-CZ 4.36Å; F329-V576 HydrophobicContact CD2-CG1 4.29Å
330	H	92	Very high	93.1	Very high	33 Å²	33	31.1 Å²	31.1	15%	0.153	15%	0.153	C	C	.	.	H	α-helix	trans	-54.2	-35	171.5	-179.8	73.3	0	0	0	112.7	A326 E352 M580 F589	A326-H330 PolarHBondContact O-N 3.44Å; H330-E352 IonicContact ND1-OE1 2.85Å; H330-E352 PolarHBondContact ND1-OE1 3.45Å; H330-M580 HydrophobicContact CB-CE 3.8Å; H330-M580 HydrophobicContact CB-SD 4.01Å; H330-F589 HydrophobicContact CB-CE1 4.03Å; H330-F589 HydrophobicContact CB-CZ 3.88Å; H330-F589 AromaticContact CD2-CD1 3.4Å; H330-F589 WeakPolarHBondContact CD2-CD1 3.27Å; H330-F589 AromaticContact CD2-CE1 3.44Å; H330-F589 VanDerWaalsContact CD2-CE1 3.44Å; H330-F589 WeakPolarHBondContact CD2-CE1 3.17Å; H330-F589 AromaticContact CE1-CD1 3.72Å; H330-F589 AromaticContact CE1-CD2 3.84Å; H330-F589 AromaticContact CE1-CG 3.5Å; H330-F589 VanDerWaalsContact CE1-CG 3.5Å; H330-F589 WeakPolarHBondContact CE1-CG 3.24Å; H330-F589 AromaticContact CG-CD1 3.82Å; H330-F589 AromaticContact CG-CE1 3.56Å; H330-F589 AromaticContact CG-CZ 3.67Å; H330-F589 AromaticContact ND1-CD1 4Å; H330-F589 AromaticContact ND1-CD2 3.84Å; H330-F589 AromaticContact ND1-CE2 3.87Å; H330-F589 AromaticContact ND1-CG 3.89Å; H330-F589 AromaticContact ND1-CZ 3.97Å; H330-F589 AromaticContact NE2-CD1 3.33Å; H330-F589 VanDerWaalsContact NE2-CD1 3.33Å; H330-F589 WeakPolarHBondContact NE2-CD1 3.42Å; H330-F589 AromaticContact NE2-CE1 3.89Å; H330-F589 AromaticContact NE2-CG 3.57Å
331	S	88	Confident	92.8	Very high	23 Å²	23	30.6 Å²	30.6	16%	0.161	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-1.6	180	68.6	0	0	0	0	115.5	G264 F328 F329	G264-S331 WeakPolarHBondContact O-CB 3.47Å; G264-S331 PolarHBondContact O-OG 3.39Å; F328-S331 PolarHBondContact O-N 3.2Å; F328-S331 PolarHBondContact O-OG 2.77Å; F329-S331 PolarHBondContact O-N 3.34Å
332	H	90.8	Very high	92.6	Very high	9 Å²	9	32.9 Å²	32.9	4%	0.042	17%	0.174	C	C	.	.			trans	-105.9	109.6	-169	170.9	65.7	0	0	0	113.6	H280 F328 F329	H280-H332 WeakPolarHBondContact CB-NE2 3.47Å; H280-H332 AromaticContact CE1-NE2 3.89Å; H280-H332 AromaticContact CG-NE2 3.25Å; H280-H332 VanDerWaalsContact CG-NE2 3.25Å; H280-H332 AromaticContact ND1-CE1 3.84Å; H280-H332 AromaticContact ND1-NE2 3.04Å; H280-H332 PolarHBondContact ND1-NE2 3.12Å; F328-H332 HydrophobicContact CD1-CB 4.25Å; F328-H332 HydrophobicContact CE1-CB 3.74Å; F328-H332 AromaticContact CE1-CD2 3.73Å; F328-H332 AromaticContact CE1-CG 3.63Å; F328-H332 HydrophobicContact CE2-CB 4.22Å; F328-H332 HydrophobicContact CZ-CB 3.71Å; F328-H332 AromaticContact CZ-CD2 3.95Å; F328-H332 AromaticContact CZ-CG 3.5Å; F328-H332 VanDerWaalsContact CZ-CG 3.5Å; F328-H332 AromaticContact CZ-ND1 3.68Å; F328-H332 VanDerWaalsContact O-CB 3.25Å; F328-H332 WeakPolarHBondContact O-CB 3.16Å; F328-H332 PolarHBondContact O-N 2.92Å; F329-H332 AromaticContact CE1-CD2 3.98Å; F329-H332 PolarHBondContact O-N 3.33Å; F329-H332 VanDerWaalsContact O-N 3.17Å
333	L	88.1	Confident	92.5	Very high	38 Å²	38	32.2 Å²	32.2	20%	0.199	17%	0.169	C	C	.	.			trans	-97.9	124.8	171	-167.1	148	0	0	0	112.3	N335 L356 N360 L363	L333-N335 PolarHBondContact O-N 3.19Å; L333-L356 HydrophobicContact CB-CD1 4.48Å; L333-L356 HydrophobicContact CD1-CB 3.96Å; L333-N360 HydrophobicContact CD1-CB 3.96Å; L333-L363 HydrophobicContact CB-CD1 3.86Å; L333-L363 HydrophobicContact CD2-CD1 3.82Å; L333-L363 HydrophobicContact CG-CD1 4.43Å
334	C	91	Very high	92.4	Very high	14 Å²	14	26.7 Å²	26.7	10%	0.095	15%	0.151	C	C	.	.			trans	-61.3	102.3	-173.2	-142.9	0	0	0	0	113.2	C338 K339 P345	C334-C338 WeakPolarHBondContact SG-CB 3.37Å; C334-K339 VanDerWaalsContact O-CE 3.23Å; C334-K339 WeakPolarHBondContact O-CE 3.48Å; C334-K339 PolarHBondContact O-NZ 3.3Å; C334-P345 HydrophobicContact CB-CB 4.33Å; C334-P345 HydrophobicContact CB-CG 4.38Å
335	N	89.6	Confident	92.4	Very high	7 Å²	7	30.2 Å²	30.2	4%	0.037	17%	0.174	C	C	.	.			trans	-89.1	178.4	-170.2	79.5	65.2	0	0	0	113.8	L273 L333 I337 C338 K339 L363	L273-N335 HydrophobicContact CD2-CB 4.1Å; L273-N335 PolarHBondContact O-ND2 2.99Å; L273-N335 VanDerWaalsContact O-ND2 3.12Å; L333-N335 PolarHBondContact O-N 3.19Å; N335-I337 PolarHBondContact O-N 3.49Å; N335-I337 WeakPolarHBondContact OD1-CB 3.17Å; N335-I337 PolarHBondContact OD1-N 2.96Å; N335-C338 WeakPolarHBondContact O-CB 3.24Å; N335-C338 PolarHBondContact O-N 3.34Å; N335-C338 VanDerWaalsContact O-N 3.17Å; N335-K339 WeakPolarHBondContact O-CG 3.5Å; N335-K339 PolarHBondContact O-N 2.79Å; N335-L363 HydrophobicContact CB-CD1 4.46Å; N335-L363 HydrophobicContact CB-CD2 4.08Å
336	K	89.4	Confident	92.3	Very high	83 Å²	83	31 Å²	31	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-64.7	-21.1	-175.1	77	-160.3	-176.5	-157.8	0	114.5	L273 S340 T368 L370	L273-K336 HydrophobicContact CD1-CD 3.99Å; L273-K336 VanDerWaalsContact CD1-CE 3.44Å; L273-K336 HydrophobicContact CD1-CG 3.91Å; K336-S340 WeakPolarHBondContact O-CB 3.45Å; K336-S340 PolarHBondContact O-N 3.23Å; K336-S340 PolarHBondContact O-OG 3.46Å; K336-T368 WeakPolarHBondContact CE-O 3.5Å; K336-T368 PolarHBondContact NZ-O 3Å; K336-L370 HydrophobicContact CG-CD2 4.26Å
337	I	91.1	Very high	92.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-74.4	-48.6	172	-57.8	-173.2	0	0	0	110.1	P224 L273 A277 N335 K339 S340 M341 T368	P224-I337 HydrophobicContact CG-CG1 4.32Å; L273-I337 HydrophobicContact CB-CD1 3.65Å; L273-I337 HydrophobicContact CB-CG1 4Å; A277-I337 HydrophobicContact CB-CB 3.73Å; A277-I337 HydrophobicContact CB-CG2 3.64Å; N335-I337 PolarHBondContact O-N 3.49Å; N335-I337 WeakPolarHBondContact OD1-CB 3.17Å; N335-I337 PolarHBondContact OD1-N 2.96Å; I337-K339 VanDerWaalsContact C-N 3.27Å; I337-K339 PolarHBondContact O-N 2.91Å; I337-S340 WeakPolarHBondContact CA-OG 3.46Å; I337-S340 WeakPolarHBondContact O-CA 3.44Å; I337-S340 PolarHBondContact O-N 2.97Å; I337-S340 PolarHBondContact O-OG 3.14Å; I337-M341 HydrophobicContact CG2-CG 4.37Å; I337-M341 HydrophobicContact CG2-SD 3.87Å; I337-M341 WeakPolarHBondContact O-CG 3.24Å; I337-M341 PolarHBondContact O-N 3.06Å; I337-T368 HydrophobicContact CD1-CG2 4.39Å
338	C	93.8	Very high	92.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-49.1	-51.2	172.9	-53.3	0	0	0	0	110.8	C334 N335 S340 M341 G342 L343	C334-C338 WeakPolarHBondContact SG-CB 3.37Å; N335-C338 WeakPolarHBondContact O-CB 3.24Å; N335-C338 PolarHBondContact O-N 3.34Å; N335-C338 VanDerWaalsContact O-N 3.17Å; C338-S340 PolarHBondContact O-N 3Å; C338-M341 CarbonylContact O-C 3.58Å; C338-M341 PolarHBondContact O-N 2.94Å; C338-M341 VanDerWaalsContact O-N 3.09Å; C338-G342 PolarHBondContact O-N 2.88Å; C338-L343 HydrophobicContact CB-CB 4.16Å; C338-L343 HydrophobicContact CB-CD1 4.02Å; C338-L343 HydrophobicContact CB-CG 4.41Å; C338-L343 PolarHBondContact O-N 2.94Å
339	K	91.8	Very high	92.2	Very high	143 Å²	143	33.8 Å²	33.8	62%	0.622	19%	0.193	S	C	*	.	H	α-helix	trans	-61.8	-37.6	178	-65.7	172.9	-178	174.4	0	113	C334 N335 I337 M341 G342	C334-K339 VanDerWaalsContact O-CE 3.23Å; C334-K339 WeakPolarHBondContact O-CE 3.48Å; C334-K339 PolarHBondContact O-NZ 3.3Å; N335-K339 WeakPolarHBondContact O-CG 3.5Å; N335-K339 PolarHBondContact O-N 2.79Å; I337-K339 VanDerWaalsContact C-N 3.27Å; I337-K339 PolarHBondContact O-N 2.91Å; K339-M341 VanDerWaalsContact C-N 3.29Å; K339-M341 PolarHBondContact O-N 2.83Å; K339-G342 PolarHBondContact O-N 3.1Å
340	S	89.1	Confident	92.1	Very high	64 Å²	64	41.8 Å²	41.8	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-71.8	-21.1	175.7	72.3	0	0	0	0	114.2	K336 I337 C338	K336-S340 WeakPolarHBondContact O-CB 3.45Å; K336-S340 PolarHBondContact O-N 3.23Å; K336-S340 PolarHBondContact O-OG 3.46Å; I337-S340 WeakPolarHBondContact CA-OG 3.46Å; I337-S340 WeakPolarHBondContact O-CA 3.44Å; I337-S340 PolarHBondContact O-N 2.97Å; I337-S340 PolarHBondContact O-OG 3.14Å; C338-S340 PolarHBondContact O-N 3Å
341	M	89.5	Confident	92	Very high	36 Å²	36	42.2 Å²	42.2	18%	0.177	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-0.2	177.7	-64.9	-177.5	76.1	0	0	112.8	Y218 H221 P223 F281 I337 C338 K339 L343	Y218-M341 HydrophobicContact CD2-CE 3.66Å; Y218-M341 HydrophobicContact CD2-SD 4.13Å; Y218-M341 HydrophobicContact CE2-CE 3.65Å; Y218-M341 HydrophobicContact CE2-SD 3.46Å; Y218-M341 WeakPolarHBondContact CE2-SD 3.32Å; Y218-M341 HydrophobicContact CG-CE 4.45Å; H221-M341 HydrophobicContact CB-CE 3.68Å; P223-M341 HydrophobicContact CB-CE 4.39Å; P223-M341 HydrophobicContact CB-SD 4.11Å; F281-M341 HydrophobicContact CD2-CE 3.45Å; F281-M341 VanDerWaalsContact CD2-CE 3.45Å; F281-M341 HydrophobicContact CE2-CE 3.62Å; F281-M341 HydrophobicContact CG-CE 4.28Å; I337-M341 HydrophobicContact CG2-CG 4.37Å; I337-M341 HydrophobicContact CG2-SD 3.87Å; I337-M341 WeakPolarHBondContact O-CG 3.24Å; I337-M341 PolarHBondContact O-N 3.06Å; C338-M341 CarbonylContact O-C 3.58Å; C338-M341 PolarHBondContact O-N 2.94Å; C338-M341 VanDerWaalsContact O-N 3.09Å; K339-M341 VanDerWaalsContact C-N 3.29Å; K339-M341 PolarHBondContact O-N 2.83Å; M341-L343 HydrophobicContact CB-CG 4.23Å
342	G	91.6	Very high	92.1	Very high	55 Å²	55	41.2 Å²	41.2	57%	0.567	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	7.4	179.8	0	0	0	0	0	115	C338 K339	C338-G342 PolarHBondContact O-N 2.88Å; K339-G342 PolarHBondContact O-N 3.1Å
343	L	94.4	Very high	92	Very high	11 Å²	11	43.1 Å²	43.1	6%	0.058	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-66.5	145.3	-177.1	-48.7	-177.7	0	0	0	111.6	H280 F281 E284 C338 M341	H280-L343 HydrophobicContact CB-CD1 4.25Å; F281-L343 HydrophobicContact CB-CD1 4.05Å; F281-L343 HydrophobicContact CB-CD2 4.42Å; F281-L343 HydrophobicContact CD2-CD2 4.23Å; E284-L343 WeakPolarHBondContact OE2-CA 3.42Å; E284-L343 VanDerWaalsContact OE2-CB 3.3Å; E284-L343 WeakPolarHBondContact OE2-CB 3.26Å; E284-L343 WeakPolarHBondContact OE2-CD2 3.4Å; C338-L343 HydrophobicContact CB-CB 4.16Å; C338-L343 HydrophobicContact CB-CD1 4.02Å; C338-L343 HydrophobicContact CB-CG 4.41Å; C338-L343 PolarHBondContact O-N 2.94Å; M341-L343 HydrophobicContact CB-CG 4.23Å
344	T	94.7	Very high	91.9	Very high	30 Å²	30	45.3 Å²	45.3	18%	0.184	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-92	141.6	-179.8	60.8	0	0	0	0	112.3	H280 E284 P550 S551 C552	H280-T344 PolarHBondContact CE1-O 3.26Å; H280-T344 PolarHBondContact NE2-O 3.39Å; H280-T344 VanDerWaalsContact NE2-O 3.13Å; E284-T344 PolarHBondContact OE1-N 3.17Å; E284-T344 PolarHBondContact OE1-OG1 3.17Å; E284-T344 PolarHBondContact OE2-N 3.13Å; T344-P550 HydrophobicContact CG2-CB 3.84Å; T344-P550 WeakPolarHBondContact OG1-CA 3.5Å; T344-P550 VanDerWaalsContact OG1-CB 3.32Å; T344-P550 WeakPolarHBondContact OG1-CB 3.19Å; T344-S551 PolarHBondContact OG1-N 3.42Å; T344-C552 PolarHBondContact OG1-N 3.47Å
345	P	94.7	Very high	91.4	Very high	76 Å²	76	49.6 Å²	49.6	49%	0.494	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-60.3	140.5	170.3	-19.9	32.8	0	0	0	110.7	C334 C552	C334-P345 HydrophobicContact CB-CB 4.33Å; C334-P345 HydrophobicContact CB-CG 4.38Å; P345-C552 WeakPolarHBondContact O-CB 3.4Å
346	F	96.4	Very high	91.1	Very high	17 Å²	17	50 Å²	50	8%	0.075	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-69.6	145.9	165.3	-179.8	-103.1	0	0	0	109.8	F329 L348 L573 V576 H577 M580 H604	F329-F346 HydrophobicContact CB-CD1 3.67Å; F329-F346 HydrophobicContact CB-CD2 4.25Å; F329-F346 HydrophobicContact CB-CE1 3.67Å; F329-F346 HydrophobicContact CB-CE2 4.26Å; F329-F346 HydrophobicContact CB-CG 3.96Å; F329-F346 HydrophobicContact CB-CZ 3.98Å; F329-F346 HydrophobicContact CD1-CB 3.46Å; F329-F346 VanDerWaalsContact CD1-CB 3.46Å; F329-F346 HydrophobicContact CD1-CD1 4.08Å; F329-F346 AromaticContact CD1-CD2 3.91Å; F329-F346 HydrophobicContact CD1-CD2 3.91Å; F329-F346 AromaticContact CD1-CG 3.57Å; F329-F346 HydrophobicContact CD1-CG 3.57Å; F329-F346 HydrophobicContact CD2-CD2 4.14Å; F329-F346 HydrophobicContact CD2-CE2 4.23Å; F329-F346 HydrophobicContact CE1-CB 3.81Å; F329-F346 HydrophobicContact CE1-CD2 4.3Å; F329-F346 HydrophobicContact CE1-CG 4.21Å; F329-F346 HydrophobicContact CG-CB 4.19Å; F329-F346 HydrophobicContact CG-CD1 4.03Å; F329-F346 AromaticContact CG-CD2 3.83Å; F329-F346 HydrophobicContact CG-CD2 3.83Å; F329-F346 HydrophobicContact CG-CE1 4.31Å; F329-F346 HydrophobicContact CG-CE2 4.13Å; F329-F346 AromaticContact CG-CG 3.77Å; F329-F346 HydrophobicContact CG-CG 3.77Å; F329-F346 HydrophobicContact CG-CZ 4.36Å; F346-L348 HydrophobicContact CD1-CD2 3.67Å; F346-L348 HydrophobicContact CD1-CG 4.02Å; F346-L348 HydrophobicContact CE1-CD2 3.89Å; F346-L348 PolarHBondContact O-N 2.98Å; F346-L573 HydrophobicContact CD2-CD1 3.93Å; F346-L573 HydrophobicContact CE2-CD1 3.76Å; F346-V576 HydrophobicContact CE2-CG1 3.9Å; F346-V576 HydrophobicContact CZ-CG1 3.99Å; F346-H577 AromaticContact CE1-CE1 3.82Å; F346-H577 AromaticContact CE2-CE1 3.43Å; F346-H577 VanDerWaalsContact CE2-CE1 3.43Å; F346-H577 WeakPolarHBondContact CE2-CE1 3.4Å; F346-H577 AromaticContact CE2-NE2 3.46Å; F346-H577 WeakPolarHBondContact CE2-NE2 3.16Å; F346-H577 AromaticContact CZ-CE1 3.25Å; F346-H577 WeakPolarHBondContact CZ-CE1 3.47Å; F346-H577 AromaticContact CZ-ND1 3.62Å; F346-H577 AromaticContact CZ-NE2 3.76Å; F346-M580 HydrophobicContact CZ-CG 4.42Å; F346-H604 AromaticContact CD1-CE1 3.81Å; F346-H604 AromaticContact CE1-CE1 2.89Å; F346-H604 WeakPolarHBondContact CE1-CE1 3.3Å; F346-H604 AromaticContact CZ-CE1 3.46Å; F346-H604 VanDerWaalsContact CZ-CE1 3.46Å; F346-H604 WeakPolarHBondContact CZ-CE1 3.14Å
347	D	96.7	Very high	90.3	Very high	27 Å²	27	48.5 Å²	48.5	14%	0.144	28%	0.281	C	S	.	.			trans	-70.5	112.5	176.4	-73.9	-120.4	0	0	0	109.7	C552 V553 H577 F603 H604 R607	D347-C552 VanDerWaalsContact OD2-CA 3.27Å; D347-C552 WeakPolarHBondContact OD2-CA 3.4Å; D347-V553 HydrophobicContact CB-CG2 4.04Å; D347-V553 PolarHBondContact OD2-N 3.36Å; D347-H577 PolarHBondContact O-CE1 3.28Å; D347-F603 HydrophobicContact CB-CE1 4.21Å; D347-F603 HydrophobicContact CB-CZ 4.12Å; D347-H604 PolarHBondContact O-CE1 3.27Å; D347-R607 HydrophobicContact CB-CG 4.16Å; D347-R607 IonicContact OD1-CZ 2.72Å; D347-R607 IonicContact OD1-NE 3.38Å; D347-R607 IonicContact OD1-NH1 3.9Å; D347-R607 PolarHBondContact OD1-NH1 3.12Å
348	L	94.5	Very high	89.1	Confident	38 Å²	38	52 Å²	52	20%	0.199	31%	0.306	C	S	.	.			trans	-118.7	156.1	174.4	-67.1	174.1	0	0	0	110.1	F346 E352 L356 F603	F346-L348 HydrophobicContact CD1-CD2 3.67Å; F346-L348 HydrophobicContact CD1-CG 4.02Å; F346-L348 HydrophobicContact CE1-CD2 3.89Å; F346-L348 PolarHBondContact O-N 2.98Å; L348-E352 HydrophobicContact CB-CB 4.25Å; L348-E352 HydrophobicContact CD2-CB 4.44Å; L348-E352 WeakPolarHBondContact CD2-OE2 3.4Å; L348-L356 HydrophobicContact CD1-CD1 3.67Å; L348-F603 VanDerWaalsContact O-CZ 3.23Å; L348-F603 WeakPolarHBondContact O-CZ 3.48Å
349	S	94.8	Very high	88	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.035	31%	0.312	C	S	.	.			trans	-72.7	168.8	175.6	77.3	0	0	0	0	112.6	P351 E352 A353 S600	S349-P351 WeakPolarHBondContact OG-CD 3.4Å; S349-E352 PolarHBondContact N-OE2 3.09Å; S349-E352 VanDerWaalsContact N-OE2 3.11Å; S349-E352 WeakPolarHBondContact OG-CB 3.48Å; S349-E352 VanDerWaalsContact OG-CG 3.32Å; S349-E352 WeakPolarHBondContact OG-CG 3.34Å; S349-E352 PolarHBondContact OG-N 3.05Å; S349-A353 WeakPolarHBondContact O-CB 3.4Å; S349-A353 PolarHBondContact O-N 3Å; S349-S600 WeakPolarHBondContact CB-OG 3.47Å; S349-S600 PolarHBondContact OG-OG 3.11Å
350	E	91.7	Very high	87	Confident	168 Å²	168	48.4 Å²	48.4	79%	0.785	29%	0.294	S	S	*	.	H	α-helix	trans	-65.3	-41.2	171.2	-66	-166.3	170.3	0	0	113.2	S354	E350-S354 VanDerWaalsContact O-CB 3.31Å; E350-S354 WeakPolarHBondContact O-CB 3.03Å; E350-S354 PolarHBondContact O-N 3.33Å; E350-S354 PolarHBondContact O-OG 3.39Å
351	P	90.4	Very high	86.1	Confident	43 Å²	43	51.2 Å²	51.2	28%	0.279	30%	0.298	S	S	.	.	H	α-helix	trans	-55.2	-52.2	168.6	-29.5	35.6	0	0	0	114.3	S349 A353 S354 Q355 D597	S349-P351 WeakPolarHBondContact OG-CD 3.4Å; P351-A353 PolarHBondContact O-N 2.74Å; P351-S354 WeakPolarHBondContact O-CA 3.36Å; P351-S354 WeakPolarHBondContact O-CB 3.41Å; P351-S354 PolarHBondContact O-N 3.26Å; P351-S354 VanDerWaalsContact O-N 3.07Å; P351-Q355 WeakPolarHBondContact O-CG 3.46Å; P351-Q355 PolarHBondContact O-N 3.44Å; P351-D597 WeakPolarHBondContact CB-OD2 3.17Å
352	E	90.8	Very high	85	Confident	1 Å²	1	52 Å²	52	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-45.5	-179.1	-71.6	176.7	138.7	0	0	111.5	H330 L348 S349 S354 Q355 L356 M580 H584 H604	H330-E352 IonicContact ND1-OE1 2.85Å; H330-E352 PolarHBondContact ND1-OE1 3.45Å; L348-E352 HydrophobicContact CB-CB 4.25Å; L348-E352 HydrophobicContact CD2-CB 4.44Å; L348-E352 WeakPolarHBondContact CD2-OE2 3.4Å; S349-E352 PolarHBondContact N-OE2 3.09Å; S349-E352 VanDerWaalsContact N-OE2 3.11Å; S349-E352 WeakPolarHBondContact OG-CB 3.48Å; S349-E352 VanDerWaalsContact OG-CG 3.32Å; S349-E352 WeakPolarHBondContact OG-CG 3.34Å; S349-E352 PolarHBondContact OG-N 3.05Å; E352-S354 PolarHBondContact O-N 2.93Å; E352-Q355 PolarHBondContact O-N 3.25Å; E352-L356 WeakPolarHBondContact O-CG 3.11Å; E352-L356 PolarHBondContact O-N 3.23Å; E352-M580 WeakPolarHBondContact OE1-CE 3.13Å; E352-H584 IonicContact OE1-CE1 3.49Å; E352-H584 IonicContact OE1-NE2 3.9Å; E352-H584 PolarHBondContact OE1-NE2 2.86Å; E352-H604 IonicContact OE1-CD2 2.78Å; E352-H604 IonicContact OE1-NE2 2.71Å; E352-H604 PolarHBondContact OE1-NE2 2.9Å; E352-H604 IonicContact OE2-CD2 2.81Å; E352-H604 IonicContact OE2-CE1 3.8Å; E352-H604 CovalentContact OE2-NE2 1.82Å; E352-H604 IonicContact OE2-NE2 2.68Å; E352-H604 PolarHBondContact OE2-NE2 3.37Å
353	A	88.1	Confident	83.9	Confident	50 Å²	50	50.1 Å²	50.1	41%	0.413	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-27.9	176.2	0	0	0	0	0	112.8	S349 P351	S349-A353 WeakPolarHBondContact O-CB 3.4Å; S349-A353 PolarHBondContact O-N 3Å; P351-A353 PolarHBondContact O-N 2.74Å
354	S	85.3	Confident	82.7	Confident	84 Å²	84	56.1 Å²	56.1	59%	0.587	31%	0.305	S	S	*	.	H	α-helix	trans	-78.9	-42.8	176.3	-60.6	0	0	0	0	112.4	E350 P351 E352 L356 D357	E350-S354 VanDerWaalsContact O-CB 3.31Å; E350-S354 WeakPolarHBondContact O-CB 3.03Å; E350-S354 PolarHBondContact O-N 3.33Å; E350-S354 PolarHBondContact O-OG 3.39Å; P351-S354 WeakPolarHBondContact O-CA 3.36Å; P351-S354 WeakPolarHBondContact O-CB 3.41Å; P351-S354 PolarHBondContact O-N 3.26Å; P351-S354 VanDerWaalsContact O-N 3.07Å; E352-S354 PolarHBondContact O-N 2.93Å; S354-L356 VanDerWaalsContact C-N 3.26Å; S354-L356 PolarHBondContact O-N 3.42Å; S354-D357 WeakPolarHBondContact O-CB 3.16Å; S354-D357 PolarHBondContact O-N 3.38Å
355	Q	81.7	Confident	81.3	Confident	103 Å²	103	58.7 Å²	58.7	48%	0.481	32%	0.324	S	S	.	.	H	α-helix	trans	-56.5	-42.6	172.6	-69.1	169.8	6.1	0	0	110.8	P351 E352 D357	P351-Q355 WeakPolarHBondContact O-CG 3.46Å; P351-Q355 PolarHBondContact O-N 3.44Å; E352-Q355 PolarHBondContact O-N 3.25Å; Q355-D357 PolarHBondContact O-N 2.9Å; Q355-D357 VanDerWaalsContact O-N 3.12Å
356	L	82.1	Confident	80	Confident	15 Å²	15	55.8 Å²	55.8	8%	0.079	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	1.7	176.9	-67	174.1	0	0	0	114.9	L333 L348 E352 S354 C358 T359 N360	L333-L356 HydrophobicContact CB-CD1 4.48Å; L333-L356 HydrophobicContact CD1-CB 3.96Å; L348-L356 HydrophobicContact CD1-CD1 3.67Å; E352-L356 WeakPolarHBondContact O-CG 3.11Å; E352-L356 PolarHBondContact O-N 3.23Å; S354-L356 VanDerWaalsContact C-N 3.26Å; S354-L356 PolarHBondContact O-N 3.42Å; L356-C358 VanDerWaalsContact C-N 3.27Å; L356-C358 PolarHBondContact O-N 2.62Å; L356-T359 CarbonylContact O-C 3.47Å; L356-T359 WeakPolarHBondContact O-CB 3.16Å; L356-T359 PolarHBondContact O-N 2.94Å; L356-N360 WeakPolarHBondContact O-CB 3.31Å; L356-N360 PolarHBondContact O-N 3.49Å
357	D	73.8	Confident	78.3	Confident	52 Å²	52	64.8 Å²	64.8	28%	0.278	35%	0.346	S	S	.	.	H	α-helix	trans	-69.5	-22.1	178.1	-170.7	47.5	0	0	0	113.2	S354 Q355 N360 K361 K364	S354-D357 WeakPolarHBondContact O-CB 3.16Å; S354-D357 PolarHBondContact O-N 3.38Å; Q355-D357 PolarHBondContact O-N 2.9Å; Q355-D357 VanDerWaalsContact O-N 3.12Å; D357-N360 WeakPolarHBondContact O-CB 3.06Å; D357-N360 PolarHBondContact O-N 3.01Å; D357-N360 PolarHBondContact OD1-ND2 3.4Å; D357-K361 WeakPolarHBondContact O-CD 3.34Å; D357-K361 VanDerWaalsContact O-CG 3.27Å; D357-K361 WeakPolarHBondContact O-CG 3.45Å; D357-K361 PolarHBondContact O-N 3.17Å; D357-K361 WeakPolarHBondContact OD2-CE 3.31Å; D357-K361 IonicContact OD2-NZ 2.86Å; D357-K361 PolarHBondContact OD2-NZ 3.2Å; D357-K364 IonicContact OD1-NZ 3.75Å
358	C	65.6	Low	76.6	Confident	75 Å²	75	64.4 Å²	64.4	51%	0.507	35%	0.345	S	S	.	.	H	α-helix	trans	-63.8	-52.2	167.1	-168.6	0	0	0	0	110.6	L356 N360 K361 L362	L356-C358 VanDerWaalsContact C-N 3.27Å; L356-C358 PolarHBondContact O-N 2.62Å; C358-N360 PolarHBondContact O-N 2.73Å; C358-K361 WeakPolarHBondContact O-CB 3.38Å; C358-K361 PolarHBondContact O-N 2.85Å; C358-L362 PolarHBondContact O-N 3.22Å
359	T	69.5	Low	74.6	Confident	23 Å²	23	67 Å²	67	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-55.9	-40.4	174	-37.3	0	0	0	0	111	I271 L356 K361 L362 L363	I271-T359 HydrophobicContact CD1-CG2 4Å; L356-T359 CarbonylContact O-C 3.47Å; L356-T359 WeakPolarHBondContact O-CB 3.16Å; L356-T359 PolarHBondContact O-N 2.94Å; T359-K361 PolarHBondContact O-N 2.91Å; T359-L362 PolarHBondContact O-N 3.47Å; T359-L363 HydrophobicContact CG2-CD1 4.16Å; T359-L363 HydrophobicContact CG2-CG 4.5Å; T359-L363 WeakPolarHBondContact O-CB 3.25Å; T359-L363 WeakPolarHBondContact O-CG 3.28Å; T359-L363 PolarHBondContact O-N 3.38Å
360	N	71.6	Confident	72.5	Confident	43 Å²	43	69 Å²	69	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-60.6	-44	175.7	-161.7	0	0	0	0	112.1	L333 L356 D357 C358 L363 K364	L333-N360 HydrophobicContact CD1-CB 3.96Å; L356-N360 WeakPolarHBondContact O-CB 3.31Å; L356-N360 PolarHBondContact O-N 3.49Å; D357-N360 WeakPolarHBondContact O-CB 3.06Å; D357-N360 PolarHBondContact O-N 3.01Å; D357-N360 PolarHBondContact OD1-ND2 3.4Å; C358-N360 PolarHBondContact O-N 2.73Å; N360-L363 PolarHBondContact O-N 2.79Å; N360-K364 PolarHBondContact ND2-NZ 3.28Å; N360-K364 VanDerWaalsContact ND2-NZ 3.16Å; N360-K364 WeakPolarHBondContact O-CB 3.39Å; N360-K364 WeakPolarHBondContact O-CD 3.3Å; N360-K364 WeakPolarHBondContact O-CG 3.34Å; N360-K364 PolarHBondContact O-N 3.4Å; N360-K364 WeakPolarHBondContact OD1-CE 3.42Å; N360-K364 PolarHBondContact OD1-NZ 3.07Å; N360-K364 VanDerWaalsContact OD1-NZ 3.17Å
361	K	69.7	Low	70.3	Confident	123 Å²	123	69 Å²	69	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-40.8	174.7	-69.6	156.7	-170.6	146.5	0	111.8	D357 C358 T359 K364 S365	D357-K361 WeakPolarHBondContact O-CD 3.34Å; D357-K361 VanDerWaalsContact O-CG 3.27Å; D357-K361 WeakPolarHBondContact O-CG 3.45Å; D357-K361 PolarHBondContact O-N 3.17Å; D357-K361 WeakPolarHBondContact OD2-CE 3.31Å; D357-K361 IonicContact OD2-NZ 2.86Å; D357-K361 PolarHBondContact OD2-NZ 3.2Å; C358-K361 WeakPolarHBondContact O-CB 3.38Å; C358-K361 PolarHBondContact O-N 2.85Å; T359-K361 PolarHBondContact O-N 2.91Å; K361-K364 PolarHBondContact O-N 2.7Å; K361-S365 PolarHBondContact O-N 2.98Å; K361-S365 VanDerWaalsContact O-N 3.09Å
362	L	66.9	Low	68.4	Low	52 Å²	52	70.1 Å²	70.1	27%	0.272	38%	0.384	S	S	.	.	H	α-helix	trans	-68.3	-41.5	176	-64.6	171.8	0	0	0	112.3	D268 I271 C358 T359 K364 S365 A366	D268-L362 HydrophobicContact CB-CD1 3.75Å; I271-L362 HydrophobicContact CD1-CB 4.09Å; I271-L362 HydrophobicContact CD1-CD1 3.81Å; C358-L362 PolarHBondContact O-N 3.22Å; T359-L362 PolarHBondContact O-N 3.47Å; L362-K364 VanDerWaalsContact C-N 3.29Å; L362-K364 PolarHBondContact O-N 3.44Å; L362-S365 PolarHBondContact O-N 3.19Å; L362-S365 PolarHBondContact O-OG 3.1Å; L362-S365 VanDerWaalsContact O-OG 3.06Å; L362-A366 PolarHBondContact O-N 3.17Å; L362-A366 VanDerWaalsContact O-N 3.1Å
363	L	69.3	Low	66.4	Low	17 Å²	17	74.4 Å²	74.4	9%	0.089	41%	0.413	C	S	.	.	H	α-helix	trans	-64.7	-31.9	174.4	-69.5	168.3	0	0	0	112.4	I271 L273 L333 N335 T359 N360	I271-L363 HydrophobicContact CG2-CD2 3.59Å; I271-L363 HydrophobicContact CG2-CG 4.22Å; L273-L363 HydrophobicContact CD2-CB 4.36Å; L273-L363 HydrophobicContact CD2-CD2 3.38Å; L273-L363 HydrophobicContact CD2-CG 4.48Å; L333-L363 HydrophobicContact CB-CD1 3.86Å; L333-L363 HydrophobicContact CD2-CD1 3.82Å; L333-L363 HydrophobicContact CG-CD1 4.43Å; N335-L363 HydrophobicContact CB-CD1 4.46Å; N335-L363 HydrophobicContact CB-CD2 4.08Å; T359-L363 HydrophobicContact CG2-CD1 4.16Å; T359-L363 HydrophobicContact CG2-CG 4.5Å; T359-L363 WeakPolarHBondContact O-CB 3.25Å; T359-L363 WeakPolarHBondContact O-CG 3.28Å; T359-L363 PolarHBondContact O-N 3.38Å; N360-L363 PolarHBondContact O-N 2.79Å
364	K	68.5	Low	64.8	Low	136 Å²	136	77.6 Å²	77.6	59%	0.591	42%	0.419	S	S	*	.	H	α-helix	trans	-69.8	-39	172.7	-73.4	159.7	-175.1	155.4	0	112.3	D357 N360 K361 L362 A366	D357-K364 IonicContact OD1-NZ 3.75Å; N360-K364 PolarHBondContact ND2-NZ 3.28Å; N360-K364 VanDerWaalsContact ND2-NZ 3.16Å; N360-K364 WeakPolarHBondContact O-CB 3.39Å; N360-K364 WeakPolarHBondContact O-CD 3.3Å; N360-K364 WeakPolarHBondContact O-CG 3.34Å; N360-K364 PolarHBondContact O-N 3.4Å; N360-K364 WeakPolarHBondContact OD1-CE 3.42Å; N360-K364 PolarHBondContact OD1-NZ 3.07Å; N360-K364 VanDerWaalsContact OD1-NZ 3.17Å; K361-K364 PolarHBondContact O-N 2.7Å; L362-K364 VanDerWaalsContact C-N 3.29Å; L362-K364 PolarHBondContact O-N 3.44Å; K364-A366 VanDerWaalsContact C-N 3.35Å
365	S	66.3	Low	62.9	Low	84 Å²	84	82.6 Å²	82.6	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-79.1	-14.3	179.8	74.4	0	0	0	0	114.2	K361 L362 K367	K361-S365 PolarHBondContact O-N 2.98Å; K361-S365 VanDerWaalsContact O-N 3.09Å; L362-S365 PolarHBondContact O-N 3.19Å; L362-S365 PolarHBondContact O-OG 3.1Å; L362-S365 VanDerWaalsContact O-OG 3.06Å; S365-K367 PolarHBondContact O-N 3.23Å; S365-K367 VanDerWaalsContact O-N 3.08Å
366	A	66.8	Low	60.9	Low	15 Å²	15	84.2 Å²	84.2	12%	0.124	45%	0.45	C	S	.	.			trans	-59.3	109.2	-178	0	0	0	0	0	113.6	L273 L362 K364 T368	L273-A366 HydrophobicContact CD1-CB 4.27Å; L273-A366 HydrophobicContact CD2-CB 3.77Å; L273-A366 HydrophobicContact CG-CB 3.96Å; L362-A366 PolarHBondContact O-N 3.17Å; L362-A366 VanDerWaalsContact O-N 3.1Å; K364-A366 VanDerWaalsContact C-N 3.35Å; A366-T368 PolarHBondContact O-N 3.13Å
367	K	60.5	Low	59.3	Low	206 Å²	206	90.1 Å²	90.1	90%	0.896	49%	0.491	S	S	*	.			trans	-61.1	10.7	-177.8	-61.5	-179.4	180	177.4	0	116.5	S365 V369	S365-K367 PolarHBondContact O-N 3.23Å; S365-K367 VanDerWaalsContact O-N 3.08Å; K367-V369 PolarHBondContact O-N 3.04Å
368	T	60.8	Low	57.8	Low	20 Å²	20	90 Å²	90	12%	0.123	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-75.5	116.9	175.2	-59.6	0	0	0	0	109.5	K225 K336 I337 A366	K225-T368 HydrophobicContact CD-CG2 4.32Å; K336-T368 WeakPolarHBondContact CE-O 3.5Å; K336-T368 PolarHBondContact NZ-O 3Å; I337-T368 HydrophobicContact CD1-CG2 4.39Å; A366-T368 PolarHBondContact O-N 3.13Å
369	V	52.1	Low	56.6	Low	91 Å²	91	91.5 Å²	91.5	55%	0.552	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-88.9	148.2	177.8	-176.5	0	0	0	0	110.1	K367 E374	K367-V369 PolarHBondContact O-N 3.04Å; V369-E374 HydrophobicContact CG1-CG 4.4Å
370	L	51.8	Low	55.2	Low	47 Å²	47	96 Å²	96	25%	0.246	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-76.2	125.4	171.8	-65.2	177.2	0	0	0	109.3	P224 K336 G372 C373	P224-L370 HydrophobicContact CB-CD2 4.25Å; P224-L370 HydrophobicContact CG-CD2 3.46Å; P224-L370 VanDerWaalsContact CG-CD2 3.46Å; K336-L370 HydrophobicContact CG-CD2 4.26Å; L370-G372 PolarHBondContact O-N 3.12Å; L370-C373 HydrophobicContact CB-CB 4.11Å; L370-C373 WeakPolarHBondContact O-CB 3.49Å; L370-C373 PolarHBondContact O-N 3.08Å
371	R	45.6	Very low	53.8	Low	168 Å²	168	105 Å²	105	63%	0.634	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	125.7	179.3	-179.2	-177.9	-74.1	-176.6	-3.5	109.9	E374	R371-E374 WeakPolarHBondContact CA-OE1 3.11Å
372	G	50.6	Low	52	Low	67 Å²	67	104.8 Å²	104.8	69%	0.691	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.3	-3.9	-174.6	0	0	0	0	0	115.4	L370 E374	L370-G372 PolarHBondContact O-N 3.12Å; G372-E374 VanDerWaalsContact C-N 3.3Å; G372-E374 PolarHBondContact N-OE1 2.8Å
373	C	48.2	Very low	50.6	Low	91 Å²	91	112.4 Å²	112.4	62%	0.615	61%	0.607	S	S	*	*			trans	-94.3	10.3	160.9	-57.6	0	0	0	0	112	L370	L370-C373 HydrophobicContact CB-CB 4.11Å; L370-C373 WeakPolarHBondContact O-CB 3.49Å; L370-C373 PolarHBondContact O-N 3.08Å
374	E	55	Low	48.8	Very low	117 Å²	117	116.8 Å²	116.8	55%	0.547	64%	0.635	S	S	.	*	S	Bend	trans	-69.7	131.5	171.1	-66.3	149.7	-117.6	0	0	109.2	V369 R371 G372 V376	V369-E374 HydrophobicContact CG1-CG 4.4Å; R371-E374 WeakPolarHBondContact CA-OE1 3.11Å; G372-E374 VanDerWaalsContact C-N 3.3Å; G372-E374 PolarHBondContact N-OE1 2.8Å; E374-V376 PolarHBondContact O-N 2.88Å; E374-V376 VanDerWaalsContact O-N 3.17Å
375	E	44.5	Very low	47.1	Very low	189 Å²	189	119.4 Å²	119.4	88%	0.883	65%	0.647	S	S	*	*			trans	-59	122.4	164.4	-80.5	-165.8	129.7	0	0	108.5	C377	E375-C377 PolarHBondContact O-N 2.86Å
376	V	40.5	Very low	45.4	Very low	137 Å²	137	120.8 Å²	120.8	83%	0.83	66%	0.656	S	S	*	*			trans	-70.6	88.6	175.8	179.7	0	0	0	0	107.7	E374 G378	E374-V376 PolarHBondContact O-N 2.88Å; E374-V376 VanDerWaalsContact O-N 3.17Å; V376-G378 PolarHBondContact O-N 2.74Å
377	C	48.1	Very low	43.8	Very low	139 Å²	139	124.6 Å²	124.6	94%	0.939	69%	0.688	S	S	*	*			trans	-74.5	72.1	-175.7	-159.7	0	0	0	0	110.8	E375	E375-C377 PolarHBondContact O-N 2.86Å
378	G	41.8	Very low	42.5	Very low	49 Å²	49	120 Å²	120	51%	0.505	68%	0.682	S	S	.	*	S	Bend	trans	-165	99.1	179.4	0	0	0	0	0	108.1	V376 P380	V376-G378 PolarHBondContact O-N 2.74Å; G378-P380 WeakPolarHBondContact O-CD 3.09Å
379	S	39.7	Very low	41.1	Very low	108 Å²	108	131 Å²	131	76%	0.755	72%	0.721	S	S	*	*			trans	-60.9	123.9	-176.7	52.7	0	0	0	0	110.6	R381	S379-R381 PolarHBondContact O-N 3.36Å
380	P	40.8	Very low	40.3	Very low	117 Å²	117	133.2 Å²	133.2	76%	0.76	73%	0.734	S	S	*	*			trans	-60.9	116.4	166	-17	30.4	0	0	0	106.6	G378 V382	G378-P380 WeakPolarHBondContact O-CD 3.09Å; P380-V382 PolarHBondContact O-N 2.96Å
381	R	41.4	Very low	39.8	Very low	232 Å²	232	136 Å²	136	88%	0.875	76%	0.756	S	S	*	*			trans	-38.4	102.5	-176.6	-85.8	172.2	150.4	162.6	-7.8	111.3	S379 R383	S379-R381 PolarHBondContact O-N 3.36Å; R381-R383 VanDerWaalsContact C-N 3.32Å; R381-R383 PolarHBondContact O-N 3.37Å
382	V	33.2	Very low	39.3	Very low	118 Å²	118	133.7 Å²	133.7	72%	0.715	76%	0.762	S	S	*	*			trans	-67.9	96.9	173	-174.6	0	0	0	0	106.8	P380 T384	P380-V382 PolarHBondContact O-N 2.96Å; V382-T384 HydrophobicContact CG1-CG2 4.01Å; V382-T384 PolarHBondContact O-N 3.14Å
383	R	37.2	Very low	38.3	Very low	212 Å²	212	137.7 Å²	137.7	80%	0.8	77%	0.767	S	S	*	*			trans	-71.8	78.2	168.8	-78.5	-176.6	168.5	174.8	-3.1	108.1	R381 F385	R381-R383 VanDerWaalsContact C-N 3.32Å; R381-R383 PolarHBondContact O-N 3.37Å; R383-F385 PolarHBondContact O-N 3.18Å
384	T	32.3	Very low	37.4	Very low	109 Å²	109	141.2 Å²	141.2	67%	0.669	78%	0.779	S	S	*	*			trans	-60.5	107	162.4	38.3	0	0	0	0	108.1	V382 S386	V382-T384 HydrophobicContact CG1-CG2 4.01Å; V382-T384 PolarHBondContact O-N 3.14Å; T384-S386 VanDerWaalsContact C-N 3.29Å; T384-S386 PolarHBondContact O-N 3.49Å
385	F	31.4	Very low	36.1	Very low	192 Å²	192	141.1 Å²	141.1	84%	0.842	79%	0.791	S	S	*	*			trans	-70.8	89.6	168.7	-76.8	-88	0	0	0	108.4	R383 A387	R383-F385 PolarHBondContact O-N 3.18Å; F385-A387 PolarHBondContact O-N 3.22Å; F385-A387 VanDerWaalsContact O-N 3.07Å
386	S	30.7	Very low	35.5	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	79%	0.791	S	S	*	*			trans	-73.5	95.3	179.6	42	0	0	0	0	111.2	T384 S388	T384-S386 VanDerWaalsContact C-N 3.29Å; T384-S386 PolarHBondContact O-N 3.49Å; S386-S388 PolarHBondContact O-N 2.95Å; S386-S388 VanDerWaalsContact O-N 3.14Å
387	A	32.7	Very low	34.9	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	79%	0.79	S	S	*	*			trans	-71.5	103.7	173.2	0	0	0	0	0	111.6	F385	F385-A387 PolarHBondContact O-N 3.22Å; F385-A387 VanDerWaalsContact O-N 3.07Å
388	S	33.3	Very low	34	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	78%	0.779	S	S	*	*			trans	41.6	97.4	149.9	-57	0	0	0	0	119.4	S386	S386-S388 PolarHBondContact O-N 2.95Å; S386-S388 VanDerWaalsContact O-N 3.14Å
389	R	32.8	Very low	33.5	Very low	251 Å²	251	148.8 Å²	148.8	95%	0.947	80%	0.797	S	S	*	*			trans	-152.3	156.3	134.5	-129.3	166.2	-83.1	-151.7	-1.2	112.4
390	V	34.4	Very low	33.6	Very low	136 Å²	136	149.1 Å²	149.1	82%	0.824	80%	0.796	S	S	*	*			trans	-102.1	147.2	-163.9	175.6	0	0	0	0	111.1
391	P	41.9	Very low	33	Very low	107 Å²	107	148.6 Å²	148.6	70%	0.695	80%	0.795	S	S	*	*			trans	-102	161.2	-170.8	39.1	-36.2	0	0	0	115.5
392	P	34.3	Very low	32.4	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	79%	0.786	S	S	*	*			trans	-105.2	137.2	140.1	34.6	-25.8	0	0	0	109.8
393	L	29.6	Very low	32.3	Very low	152 Å²	152	141 Å²	141	80%	0.796	79%	0.789	S	S	*	*			cis	101.3	120.8	39.2	-84.7	176.6	0	0	0	113.1
394	L	30.3	Very low	32	Very low	164 Å²	164	137.2 Å²	137.2	86%	0.859	78%	0.784	S	S	*	*			trans	70.8	152.8	167.1	-52.6	176.4	0	0	0	116.3
395	S	27.6	Very low	32	Very low	115 Å²	115	140.6 Å²	140.6	80%	0.804	79%	0.792	S	S	*	*			cis	-145	173.8	3.8	3.7	0	0	0	0	113.1
396	R	31.6	Very low	32	Very low	233 Å²	233	136.4 Å²	136.4	88%	0.879	79%	0.787	S	S	*	*			trans	-83.9	-176.6	178	-68.1	176.8	166.9	-179.2	-4.7	113.5
397	L	28	Very low	32	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	79%	0.787	S	S	*	*			trans	92.5	118.4	163.1	-50.2	179.9	0	0	0	112.6
398	S	28.8	Very low	32	Very low	102 Å²	102	135.8 Å²	135.8	71%	0.713	78%	0.782	S	S	*	*			cis	93.4	138.5	39.5	77.1	0	0	0	0	114.1
399	E	31.5	Very low	31.9	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	78%	0.782	S	S	*	*			trans	-56.5	176.8	-175.6	-49.3	166.1	117.8	0	0	114.5
400	P	42.8	Very low	31.9	Very low	114 Å²	114	131.1 Å²	131.1	74%	0.74	77%	0.772	S	S	*	*			cis	-140.7	-165.7	7.5	40.2	-19	0	0	0	116.3
401	S	28.1	Very low	31.7	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	77%	0.769	S	S	*	*			trans	75.3	158	153.3	125.7	0	0	0	0	118.3
402	S	29	Very low	31.1	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	77%	0.768	S	S	*	*			cis	-175.2	149.5	-18.2	46.8	0	0	0	0	112.1
403	A	30.6	Very low	30.7	Very low	94 Å²	94	132.7 Å²	132.7	78%	0.777	77%	0.769	S	S	*	*			trans	65.6	158.6	160.4	0	0	0	0	0	117
404	D	30.3	Very low	31.2	Very low	132 Å²	132	130.3 Å²	130.3	71%	0.706	76%	0.763	S	S	*	*			cis	-147.8	172.9	-6.6	-145	-33.9	0	0	0	110.4
405	E	33	Very low	30.9	Very low	179 Å²	179	128.4 Å²	128.4	84%	0.836	76%	0.762	S	S	*	*			trans	157.8	98	141.8	-85.8	-64.1	106.9	0	0	109.3
406	S	30.7	Very low	31	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	76%	0.76	S	S	*	*			trans	-80.5	164.1	165.7	-58.6	0	0	0	0	109.8
407	A	31	Very low	31.2	Very low	94 Å²	94	122.4 Å²	122.4	78%	0.777	75%	0.753	S	S	*	*			cis	-152.6	-178.3	24.4	0	0	0	0	0	109.5
408	S	33.4	Very low	31	Very low	100 Å²	100	122.2 Å²	122.2	70%	0.699	75%	0.752	S	S	*	*			cis	-154.3	138.3	16.7	57.5	0	0	0	0	113.6
409	D	30.4	Very low	30.9	Very low	142 Å²	142	122.5 Å²	122.5	76%	0.759	75%	0.75	S	S	*	*				23.9	135.1	122.4	-63.2	8.9	0	0	0	118.8
410	V	32.3	Very low	30.8	Very low	121 Å²	121	121.5 Å²	121.5	73%	0.733	75%	0.75	S	S	*	*			cis	-156.8	153.8	6.3	-109.6	0	0	0	0	112.6
411	D	30	Very low	30.3	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	75%	0.747	S	S	*	*			trans	13.5	149	136.3	-79.7	-61.9	0	0	0	122.4
412	S	29.3	Very low	30	Very low	96 Å²	96	125.6 Å²	125.6	67%	0.671	75%	0.753	S	S	*	*			cis	-163.9	-178	-4.1	-132.8	0	0	0	0	112.9
413	I	27.3	Very low	29.9	Very low	156 Å²	156	126.2 Å²	126.2	80%	0.8	76%	0.757	S	S	*	*			trans	-71.7	175.6	168.9	11.6	173.4	0	0	0	112.2
414	P	40.1	Very low	30.2	Very low	103 Å²	103	127 Å²	127	67%	0.669	76%	0.755	S	S	*	*			cis	-141.5	-165.1	-0.8	35	-10.8	0	0	0	116.6
415	C	23.1	Very low	30	Very low	124 Å²	124	127.8 Å²	127.8	84%	0.838	76%	0.758	S	S	*	*			trans	84.4	141.1	148.7	-70.7	0	0	0	0	122.6
416	S	30.7	Very low	29.7	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	76%	0.758	S	S	*	*			trans	-75.8	163.3	158.5	-35.5	0	0	0	0	110.8
417	P	34.8	Very low	29.4	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	76%	0.756	S	S	*	*				-159	173.5	84.1	42.2	-22	0	0	0	118.6
418	L	25.1	Very low	29.7	Very low	152 Å²	152	126.6 Å²	126.6	80%	0.796	76%	0.759	S	S	*	*			trans	52.4	115.6	142.9	-70.1	166	0	0	0	123.9
419	T	24.7	Very low	29.3	Very low	109 Å²	109	125.6 Å²	125.6	67%	0.669	77%	0.765	S	S	*	*			trans	26.2	123.9	131.6	56.9	0	0	0	0	122.9
420	L	29.8	Very low	29.1	Very low	164 Å²	164	123.7 Å²	123.7	86%	0.859	76%	0.762	S	S	*	*				53.3	147.2	126.3	-64.7	-178.9	0	0	0	120.1
421	P	32.3	Very low	29	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	77%	0.767	S	S	*	*				-155.9	-173	53.7	35.2	-8.8	0	0	0	119.5
422	F	22.7	Very low	28.7	Very low	201 Å²	201	122.6 Å²	122.6	88%	0.882	77%	0.766	S	S	*	*			trans	80.4	129.6	162.8	-74.5	-71	0	0	0	122.4
423	S	27.4	Very low	28.7	Very low	110 Å²	110	127.8 Å²	127.8	77%	0.769	78%	0.777	S	S	*	*			trans	-96.9	-167.4	165.6	-33.9	0	0	0	0	109.2
424	P	36.2	Very low	28.6	Very low	112 Å²	112	125.8 Å²	125.8	73%	0.727	78%	0.776	S	S	*	*			cis	-152.9	-159.5	45	38.4	-12.1	0	0	0	116.6
425	I	25.3	Very low	27.8	Very low	148 Å²	148	125.9 Å²	125.9	76%	0.759	78%	0.78	S	S	*	*			trans	99.5	108.4	150.5	-78.4	166.1	0	0	0	120.2
426	V	26.3	Very low	27.9	Very low	138 Å²	138	126.1 Å²	126.1	84%	0.836	78%	0.782	S	S	*	*			trans	85.2	130.1	142.6	167.6	0	0	0	0	121.4
427	A	26.2	Very low	27.6	Very low	85 Å²	85	124.2 Å²	124.2	70%	0.702	78%	0.78	S	S	*	*			trans	-116.1	177.3	167.1	0	0	0	0	0	109.9
428	P	35.6	Very low	27.2	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	79%	0.785	S	S	*	*				-157.5	145.6	101	37.2	-17.8	0	0	0	118.7
429	G	25.8	Very low	27.2	Very low	79 Å²	79	124 Å²	124	81%	0.814	78%	0.78	S	S	*	*			trans	78.5	166.7	146.7	0	0	0	0	0	119.1
430	S	26.7	Very low	27.3	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	79%	0.788	S	S	*	*			cis	-167.9	164.5	-11.5	-163	0	0	0	0	111.8
431	M	28.6	Very low	27.2	Very low	168 Å²	168	123.4 Å²	123.4	83%	0.828	78%	0.782	S	S	*	*			trans	67.4	150.2	179.9	-51.6	-70	106.5	0	0	114.6
432	G	25.2	Very low	26.8	Very low	72 Å²	72	121.6 Å²	121.6	74%	0.742	78%	0.782	S	S	*	*			cis	137.6	142.9	5.7	0	0	0	0	0	108.8
433	K	29.4	Very low	27	Very low	206 Å²	206	118.6 Å²	118.6	90%	0.896	77%	0.772	S	S	*	*			cis	-152.3	174.8	14.6	-61.8	169.6	179.6	171.4	0	110.5
434	S	23.8	Very low	27	Very low	113 Å²	113	124 Å²	124	79%	0.79	78%	0.777	S	S	*	*			trans	-105	161.1	168.8	54.6	0	0	0	0	113
435	S	23.6	Very low	26.5	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	78%	0.778	S	S	*	*			trans	176.8	133.3	140.9	56.3	0	0	0	0	115.2
436	S	25.7	Very low	26.6	Very low	128 Å²	128	128.6 Å²	128.6	90%	0.895	79%	0.786	S	S	*	*			trans	64.2	155	154.2	-51	0	0	0	0	118.4
437	G	23.7	Very low	26.5	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	77%	0.774	S	S	*	*			cis	141.3	153.6	7.3	0	0	0	0	0	109.1
438	L	27.4	Very low	26.5	Very low	158 Å²	158	134.7 Å²	134.7	83%	0.827	78%	0.784	S	S	*	*			cis	-169.9	141.2	10	-118.4	170.9	0	0	0	111.7
439	S	25.4	Very low	26	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	78%	0.775	S	S	*	*			trans	62.2	178.5	148.9	70.3	0	0	0	0	118.9
440	L	26.3	Very low	26	Very low	157 Å²	157	138.2 Å²	138.2	82%	0.822	78%	0.776	S	S	*	*			cis	-159.8	146.2	8	-168.2	63.2	0	0	0	107.3
441	S	27.3	Very low	26	Very low	104 Å²	104	139 Å²	139	73%	0.727	77%	0.772	S	S	*	*			cis	-143.2	-159.6	-3.2	-134.9	0	0	0	0	107.1
442	G	23.6	Very low	25.9	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	77%	0.769	S	S	*	*			cis	159.4	172.7	-1	0	0	0	0	0	108.3
443	M	27.2	Very low	26	Very low	138 Å²	138	140 Å²	140	68%	0.68	77%	0.768	S	S	*	*			cis	-166.4	141.3	-10.8	-122.2	-164.8	82.8	0	0	108.3
444	Y	28	Very low	25.9	Very low	223 Å²	223	134.1 Å²	134.1	88%	0.875	76%	0.758	S	S	*	*				178.8	132.8	128.8	-105.2	-69.7	0	0	0	110.1
445	E	24.9	Very low	26.2	Very low	160 Å²	160	134.7 Å²	134.7	75%	0.748	75%	0.753	S	S	*	*			trans	-106.8	162.9	179.1	-63.3	176.5	114.6	0	0	111.2
446	H	27.3	Very low	26.5	Very low	198 Å²	198	136.5 Å²	136.5	92%	0.917	75%	0.749	S	S	*	*			trans	-142	113.9	140.2	-137.7	-57.7	0	0	0	111.1
447	D	25	Very low	26.7	Very low	108 Å²	108	137.4 Å²	137.4	58%	0.578	74%	0.737	S	S	*	*			trans	-91	154.2	-173.5	177.8	34.2	0	0	0	112.9	L449	D447-L449 WeakPolarHBondContact OD2-CD1 3.43Å
448	R	26.5	Very low	26.9	Very low	242 Å²	242	139.7 Å²	139.7	91%	0.913	73%	0.732	S	S	*	*			trans	-165.9	106.7	157.4	-114.5	174.4	-168.6	-165.8	3.4	113.3
449	L	24.7	Very low	26.9	Very low	128 Å²	128	137.3 Å²	137.3	67%	0.67	73%	0.729	S	S	*	*			trans	-62.1	152.9	166	-66.3	71.6	0	0	0	112.4	D447	D447-L449 WeakPolarHBondContact OD2-CD1 3.43Å
450	N	25.5	Very low	27	Very low	155 Å²	155	141 Å²	141	83%	0.829	74%	0.735	S	S	*	*				-152.7	163.6	115.7	-144.1	-13.6	0	0	0	112.9
451	N	26.6	Very low	26.9	Very low	117 Å²	117	139.5 Å²	139.5	63%	0.626	74%	0.738	S	S	*	*			trans	-99.8	-179.1	-167.9	-66	-56.8	0	0	0	114.6
452	N	27.2	Very low	26.9	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	74%	0.744	S	S	*	*			trans	82.5	141.9	149.8	-66.3	-11.3	0	0	0	118.6
453	T	27.5	Very low	26.9	Very low	120 Å²	120	138.9 Å²	138.9	74%	0.736	75%	0.748	S	S	*	*			cis	-170.9	159.7	-20.5	18.2	0	0	0	0	108.2
454	A	27.7	Very low	26.8	Very low	83 Å²	83	140 Å²	140	69%	0.686	76%	0.757	S	S	*	*			trans	68.4	151.5	150	0	0	0	0	0	117.9
455	D	28.7	Very low	26.9	Very low	125 Å²	125	134.6 Å²	134.6	67%	0.668	75%	0.752	S	S	*	*			cis	-162.4	153.8	-19.7	-117.5	-42.7	0	0	0	110.3
456	H	31	Very low	27	Very low	144 Å²	144	130.6 Å²	130.6	67%	0.667	75%	0.753	S	S	*	*			trans	63.9	151.5	146.1	-71.6	18.1	0	0	0	118.7
457	K	30	Very low	26.9	Very low	148 Å²	148	132 Å²	132	64%	0.643	75%	0.752	S	S	*	*			cis	-162.2	150.1	-9.3	-116.5	-175	170	-145.3	0	114.1
458	D	26.9	Very low	27.2	Very low	117 Å²	117	132.3 Å²	132.3	63%	0.626	76%	0.76	S	S	*	*			trans	51.7	144.7	136.2	-55.5	-12.6	0	0	0	124.2
459	S	28.7	Very low	27.2	Very low	108 Å²	108	125.5 Å²	125.5	76%	0.755	75%	0.749	S	S	*	*			trans	68.4	118	157.6	-59.3	0	0	0	0	118.7
460	E	25.6	Very low	27.3	Very low	178 Å²	178	128.3 Å²	128.3	83%	0.832	76%	0.759	S	S	*	*			cis	84.7	134	38.1	-68.2	-160.6	108.3	0	0	116.9
461	S	25.4	Very low	27.3	Very low	125 Å²	125	133.1 Å²	133.1	87%	0.874	77%	0.765	S	S	*	*			trans	73.4	156.6	154.9	79.8	0	0	0	0	119
462	G	26.5	Very low	27.3	Very low	83 Å²	83	139.4 Å²	139.4	86%	0.856	78%	0.78	S	S	*	*			trans	118	85	179.3	0	0	0	0	0	112.8
463	G	24.8	Very low	27.3	Very low	76 Å²	76	137.7 Å²	137.7	78%	0.784	78%	0.779	S	S	*	*			trans	-116.9	-152.5	174.5	0	0	0	0	0	112.8
464	D	24.9	Very low	27.3	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	79%	0.788	S	S	*	*			trans	85.4	174	175.6	-149	3.2	0	0	0	116.8
465	S	28.5	Very low	27.1	Very low	109 Å²	109	141 Å²	141	76%	0.762	79%	0.792	S	S	*	*			trans	-121.6	165.5	-134.1	56.6	0	0	0	0	114.6
466	G	27.1	Very low	27.2	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	80%	0.801	S	S	*	*			trans	179.7	77.9	179	0	0	0	0	0	115.5
467	Y	26	Very low	27.7	Very low	228 Å²	228	140.5 Å²	140.5	89%	0.894	80%	0.8	S	S	*	*			trans	-86.9	144.3	155.5	-118.8	-81.2	0	0	0	108.6
468	P	32.1	Very low	27.5	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	80%	0.803	S	S	*	*				-148	142.7	110.6	35.5	-19.2	0	0	0	116.7
469	S	26.8	Very low	27.6	Very low	98 Å²	98	141.2 Å²	141.2	69%	0.685	81%	0.811	S	S	*	*			trans	51.9	115.2	136.2	-50.3	0	0	0	0	122.9
470	E	25.6	Very low	27.6	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	81%	0.814	S	S	*	*			trans	29.6	129.5	130.9	-57.5	-169.2	121.5	0	0	121.5
471	R	26.4	Very low	27.9	Very low	256 Å²	256	142.3 Å²	142.3	97%	0.966	81%	0.813	S	S	*	*			trans	-150	154	137.8	-108.8	175.4	-162.6	-134.1	0.7	112.1
472	R	27	Very low	28	Very low	249 Å²	249	144.4 Å²	144.4	94%	0.94	81%	0.814	S	S	*	*			trans	-110	142.3	174.3	-62.1	177.5	179.6	177.8	-1.2	111.3
473	S	27.1	Very low	27.9	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	81%	0.809	S	S	*	*			trans	-170.7	133.5	151.7	50	0	0	0	0	106.3
474	E	26.8	Very low	27.9	Very low	197 Å²	197	147.2 Å²	147.2	92%	0.921	81%	0.814	S	S	*	*				50.9	136.9	85.4	-58	-177.8	-158.9	0	0	113.3
475	G	24.3	Very low	27.9	Very low	75 Å²	75	145.3 Å²	145.3	77%	0.773	80%	0.799	S	S	*	*			cis	176	168.4	2.3	0	0	0	0	0	110.5
476	D	29.1	Very low	27.7	Very low	160 Å²	160	149.1 Å²	149.1	86%	0.856	81%	0.805	S	S	*	*			trans	-63.5	165.1	178.3	-130.9	9	0	0	0	112.1
477	P	41.8	Very low	27.5	Very low	100 Å²	100	154.9 Å²	154.9	65%	0.649	80%	0.803	S	S	*	*			cis	-153.9	178	48.7	43.9	-22.9	0	0	0	119.9
478	N	26.9	Very low	27.4	Very low	129 Å²	129	154.9 Å²	154.9	69%	0.69	80%	0.803	S	S	*	*			trans	71.6	134.8	151.4	-74.7	-2.2	0	0	0	118.2
479	D	29.3	Very low	27	Very low	150 Å²	150	160.6 Å²	160.6	80%	0.802	81%	0.81	S	S	*	*				-144	152.7	68.6	-127.2	-12.2	0	0	0	116.7
480	H	28	Very low	26.9	Very low	176 Å²	176	161 Å²	161	82%	0.815	81%	0.811	S	S	*	*			trans	-124.4	122.3	176.9	-102.5	-72.8	0	0	0	110
481	V	30.6	Very low	26.9	Very low	134 Å²	134	159.1 Å²	159.1	81%	0.812	81%	0.811	S	S	*	*			trans	-137.5	127.5	167.8	-175.2	0	0	0	0	110
482	D	27.7	Very low	27.1	Very low	168 Å²	168	151.4 Å²	151.4	90%	0.898	80%	0.796	S	S	*	*			trans	-73.5	142.6	177	-85.6	-57	0	0	0	112.9
483	G	25.7	Very low	27.4	Very low	72 Å²	72	147.4 Å²	147.4	74%	0.742	79%	0.788	S	S	*	*			trans	-147.8	115.5	175.1	0	0	0	0	0	111.8
484	V	25.3	Very low	27.9	Very low	147 Å²	147	144.9 Å²	144.9	89%	0.891	77%	0.771	S	S	*	*			trans	-82.1	146.2	-169.4	177.5	0	0	0	0	113
485	H	24.1	Very low	28.5	Very low	122 Å²	122	137 Å²	137	57%	0.565	74%	0.735	S	S	*	*			trans	-48.1	134.3	-171	-60.8	-27.4	0	0	0	118.4	R487	H485-R487 HydrophobicContact CB-CG 4.39Å; H485-R487 PolarHBondContact NE2-NH2 3Å
486	H	23.9	Very low	29.4	Very low	189 Å²	189	138.2 Å²	138.2	88%	0.875	72%	0.724	S	S	*	*				-122.8	129.1	125.6	-94.8	6.2	0	0	0	109.6
487	R	24.1	Very low	29.7	Very low	196 Å²	196	134.8 Å²	134.8	74%	0.74	71%	0.705	S	S	*	*			trans	-108.2	91.9	-175.8	-65.1	-174.5	-170.9	-178.8	3.2	110.9	H485	H485-R487 HydrophobicContact CB-CG 4.39Å; H485-R487 PolarHBondContact NE2-NH2 3Å
488	Y	22.7	Very low	29.3	Very low	228 Å²	228	134.2 Å²	134.2	89%	0.894	70%	0.704	S	S	*	*			trans	-83.3	135.2	146.7	-82	-87.8	0	0	0	108.1
489	R	22.8	Very low	29.7	Very low	234 Å²	234	133.1 Å²	133.1	88%	0.883	70%	0.697	S	S	*	*			trans	-129.1	94.3	-176.7	-172.3	-172.8	-166.5	-172.9	5.4	108.8
490	P	25.6	Very low	29.6	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	70%	0.701	S	S	*	*			trans	-55.1	139.8	169.6	-23	34.3	0	0	0	110.2
491	V	26.2	Very low	29.8	Very low	147 Å²	147	139.8 Å²	139.8	89%	0.891	70%	0.704	S	S	*	*			trans	-71.8	142.7	169.6	177.5	0	0	0	0	107.8
492	S	30	Very low	29.7	Very low	93 Å²	93	144.9 Å²	144.9	65%	0.65	71%	0.708	S	S	*	*			trans	-123.9	118.2	-171.4	-43.4	0	0	0	0	110.6
493	E	33.3	Very low	29.7	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	70%	0.704	S	S	*	*			trans	-81.8	175.8	163.6	-62.6	-174.5	139.2	0	0	110	F175	F175-E493 WeakPolarHBondContact CE1-O 3.48Å; F175-E493 WeakPolarHBondContact CZ-O 3.46Å
494	S	36.9	Very low	29.7	Very low	52 Å²	52	150.4 Å²	150.4	36%	0.364	71%	0.708	S	S	.	*			trans	-100.7	154.8	-163.7	-164	0	0	0	0	113.4	D496 D497	S494-D496 WeakPolarHBondContact CB-O 3.45Å; S494-D496 VanDerWaalsContact OG-C 3.25Å; S494-D496 PolarHBondContact OG-N 3.36Å; S494-D496 PolarHBondContact OG-O 2.94Å; S494-D497 WeakPolarHBondContact CB-OD1 3.44Å
495	D	40.7	Very low	29.8	Very low	33 Å²	33	149.9 Å²	149.9	18%	0.176	71%	0.705	C	S	.	*	S	Bend	trans	-75.2	-10.2	160.1	-112.6	-16.2	0	0	0	110.8	R134 K171 N174 F175	R134-D495 IonicContact CZ-OD1 3.72Å; R134-D495 VanDerWaalsContact CZ-OD1 3.26Å; R134-D495 IonicContact NH1-OD1 2.65Å; R134-D495 PolarHBondContact NH1-OD1 2.81Å; R134-D495 IonicContact NH2-OD1 2.63Å; R134-D495 PolarHBondContact NH2-OD1 3.28Å; K171-D495 IonicContact NZ-OD1 2.69Å; K171-D495 IonicContact NZ-OD2 3.58Å; K171-D495 PolarHBondContact NZ-OD2 2.87Å; N174-D495 PolarHBondContact N-OD2 3.23Å; N174-D495 VanDerWaalsContact N-OD2 3.07Å; F175-D495 HydrophobicContact CD2-CB 3.8Å; F175-D495 HydrophobicContact CE2-CB 3.54Å
496	D	43.4	Very low	29.9	Very low	100 Å²	100	148.5 Å²	148.5	54%	0.535	72%	0.715	S	S	.	*	S	Bend	trans	-133.9	92.2	179.6	172.8	2.7	0	0	0	108.7	S494 S498	S494-D496 WeakPolarHBondContact CB-O 3.45Å; S494-D496 VanDerWaalsContact OG-C 3.25Å; S494-D496 PolarHBondContact OG-N 3.36Å; S494-D496 PolarHBondContact OG-O 2.94Å; D496-S498 PolarHBondContact O-N 2.85Å; D496-S498 VanDerWaalsContact O-N 3.16Å; D496-S498 WeakPolarHBondContact OD1-CB 3.42Å; D496-S498 PolarHBondContact OD1-N 2.84Å; D496-S498 VanDerWaalsContact OD1-N 3.13Å; D496-S498 PolarHBondContact OD1-OG 3.43Å
497	D	35.2	Very low	30.2	Very low	87 Å²	87	145 Å²	145	47%	0.465	71%	0.709	S	S	.	*			trans	-85.7	44.6	177.1	-80.3	-33	0	0	0	112.5	S494 I499	S494-D497 WeakPolarHBondContact CB-OD1 3.44Å; D497-I499 VanDerWaalsContact C-N 3.25Å; D497-I499 PolarHBondContact O-N 3.08Å
498	S	32.8	Very low	30.4	Very low	89 Å²	89	141.4 Å²	141.4	62%	0.622	71%	0.711	S	S	*	*			trans	-60.8	86.1	160.1	-69.3	0	0	0	0	110.4	D496 R500	D496-S498 PolarHBondContact O-N 2.85Å; D496-S498 VanDerWaalsContact O-N 3.16Å; D496-S498 WeakPolarHBondContact OD1-CB 3.42Å; D496-S498 PolarHBondContact OD1-N 2.84Å; D496-S498 VanDerWaalsContact OD1-N 3.13Å; D496-S498 PolarHBondContact OD1-OG 3.43Å; S498-R500 PolarHBondContact O-N 3.05Å
499	I	35.8	Very low	30.7	Very low	105 Å²	105	142.2 Å²	142.2	54%	0.538	71%	0.713	S	S	.	*			trans	-46.5	111.3	-169.5	-57.3	178	0	0	0	111.8	D497 R501 W537	D497-I499 VanDerWaalsContact C-N 3.25Å; D497-I499 PolarHBondContact O-N 3.08Å; I499-R501 PolarHBondContact O-N 3.32Å; I499-W537 HydrophobicContact CD1-CH2 3.65Å; I499-W537 HydrophobicContact CD1-CZ2 3.5Å; I499-W537 VanDerWaalsContact CD1-CZ2 3.5Å
500	R	26	Very low	30.9	Very low	234 Å²	234	137.8 Å²	137.8	88%	0.883	71%	0.711	S	S	*	*			trans	-65	98.1	174.4	-76.9	-174.4	172.8	-169.7	-0	110	S498 R502	S498-R500 PolarHBondContact O-N 3.05Å; R500-R502 PolarHBondContact O-N 3.36Å
501	R	32.5	Very low	30.8	Very low	233 Å²	233	138.2 Å²	138.2	88%	0.879	72%	0.717	S	S	*	*			trans	-48.9	96	171.4	-68.6	-175.6	-179.8	-177.8	-0.2	111.6	I499	I499-R501 PolarHBondContact O-N 3.32Å
502	R	27.9	Very low	30.8	Very low	241 Å²	241	135.6 Å²	135.6	91%	0.909	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-77.2	144.8	163	-81.2	-175.6	169	171.5	-1.3	109	R500	R500-R502 PolarHBondContact O-N 3.36Å
503	K	28.3	Very low	30.5	Very low	184 Å²	184	138.3 Å²	138.3	80%	0.8	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-89.5	124.8	-179.6	-146.2	175.9	-174.1	-179.2	0	107.8
504	M	26.6	Very low	30.2	Very low	171 Å²	171	137.8 Å²	137.8	84%	0.842	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.1	-174.8	-68.5	165.5	167.3	0	0	112.7
505	V	27	Very low	29.6	Very low	136 Å²	136	146.1 Å²	146.1	82%	0.824	74%	0.744	S	S	*	*			trans	-138.6	122.2	162.9	-179.9	0	0	0	0	106.5
506	A	26.2	Very low	28.7	Very low	93 Å²	93	150.5 Å²	150.5	77%	0.769	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-81.5	140.1	-177	0	0	0	0	0	111.9
507	P	30.8	Very low	27.7	Very low	117 Å²	117	154.2 Å²	154.2	76%	0.76	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-78.9	159.2	172	33.3	-34.7	0	0	0	112.1
508	P	27.3	Very low	27.2	Very low	119 Å²	119	155.5 Å²	155.5	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.1	153	176.7	31.8	-35.3	0	0	0	112.6
509	R	28.7	Very low	27.4	Very low	246 Å²	246	156.2 Å²	156.2	93%	0.928	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-71.9	141.9	173.7	-66.6	177.2	173	177.3	-4.2	111.5
510	V	28.1	Very low	26.9	Very low	140 Å²	140	156.6 Å²	156.6	85%	0.848	82%	0.822	S	S	*	*			trans	-132.1	152	165.5	-177.5	0	0	0	0	109.3
511	S	23.8	Very low	26.9	Very low	118 Å²	118	153.3 Å²	153.3	83%	0.825	82%	0.822	S	S	*	*			trans	-74.7	158.3	-166	-46.2	0	0	0	0	115.3
512	A	26	Very low	26.6	Very low	91 Å²	91	150.8 Å²	150.8	75%	0.752	82%	0.82	S	S	*	*			trans	-79.2	153.3	170.5	0	0	0	0	0	112.9
513	N	24.3	Very low	26.4	Very low	151 Å²	151	143.2 Å²	143.2	81%	0.807	82%	0.817	S	S	*	*			trans	-176.6	149	132.7	-104.7	-17.9	0	0	0	116.1
514	L	26.2	Very low	26.2	Very low	154 Å²	154	139.4 Å²	139.4	81%	0.806	81%	0.814	S	S	*	*			trans	79.8	156.8	149.5	-70.2	164.2	0	0	0	122.1
515	Y	24.4	Very low	26.4	Very low	226 Å²	226	143.9 Å²	143.9	89%	0.886	82%	0.821	S	S	*	*			trans	-106.6	158.3	-165.2	-65.9	-111.1	0	0	0	113.2
516	S	22.3	Very low	26.3	Very low	125 Å²	125	144.5 Å²	144.5	87%	0.874	82%	0.819	S	S	*	*			trans	-168.9	159.2	135.6	-161.8	0	0	0	0	111.4
517	E	22.5	Very low	26.7	Very low	179 Å²	179	146.2 Å²	146.2	84%	0.836	82%	0.816	S	S	*	*			trans	-111.7	130.9	-174.7	-60.9	173.3	110.3	0	0	114.1
518	S	24.9	Very low	26.4	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	82%	0.816	S	S	*	*			trans	55.5	174.1	143.4	84.1	0	0	0	0	120.9
519	P	36.1	Very low	26.6	Very low	105 Å²	105	145.1 Å²	145.1	68%	0.682	81%	0.808	S	S	*	*			cis	-127.5	174.2	-13.7	39.9	-24.9	0	0	0	115.2
520	S	25.7	Very low	26.9	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	79%	0.791	S	S	*	*			trans	51.1	119.2	150.3	63.4	0	0	0	0	122.2
521	N	24.6	Very low	27.2	Very low	165 Å²	165	139.7 Å²	139.7	88%	0.882	79%	0.792	S	S	*	*				-154.7	158.6	125.8	-158.4	12.8	0	0	0	111
522	E	26.4	Very low	28	Very low	181 Å²	181	138.8 Å²	138.8	85%	0.846	78%	0.777	S	S	*	*			trans	-89.2	155.8	179.7	-65.3	-173.5	124.1	0	0	113.8
523	G	24.8	Very low	28.9	Very low	82 Å²	82	137.4 Å²	137.4	85%	0.845	76%	0.759	S	S	*	*			trans	83.4	81.4	143.8	0	0	0	0	0	119.1
524	S	23.6	Very low	29.8	Very low	104 Å²	104	135.9 Å²	135.9	73%	0.727	75%	0.751	S	S	*	*			trans	-154.6	132.6	145.2	-159.6	0	0	0	0	112.1	L526	S524-L526 PolarHBondContact O-N 2.97Å
525	W	30.7	Very low	30.6	Very low	264 Å²	264	135.6 Å²	135.6	100%	1	75%	0.745	S	S	*	*			trans	-80.7	108.1	168.5	-86.2	77	0	0	0	109.2
526	L	24.8	Very low	31.5	Very low	149 Å²	149	130 Å²	130	78%	0.78	73%	0.726	S	S	*	*			trans	-137.8	129	170.8	-93.2	170.3	0	0	0	112.3	S524 V528	S524-L526 PolarHBondContact O-N 2.97Å; L526-V528 PolarHBondContact O-N 3Å
527	D	34.2	Very low	32.5	Very low	130 Å²	130	126 Å²	126	70%	0.695	69%	0.692	S	S	*	*			trans	-47	122.6	174.1	169.2	17.7	0	0	0	113.2	S529	D527-S529 PolarHBondContact OD1-N 3.04Å; D527-S529 PolarHBondContact OD1-OG 3.05Å
528	V	24.7	Very low	33.6	Very low	128 Å²	128	121 Å²	121	78%	0.776	68%	0.676	S	S	*	*			trans	-131.8	74.7	161.4	-172.7	0	0	0	0	108.5	L526 P530	L526-V528 PolarHBondContact O-N 3Å; V528-P530 WeakPolarHBondContact O-CD 3.46Å
529	S	31.6	Very low	34.5	Very low	84 Å²	84	122.8 Å²	122.8	59%	0.587	67%	0.67	S	S	*	*			trans	-52.7	114.2	164.9	-61.8	0	0	0	0	110	D527 Q531	D527-S529 PolarHBondContact OD1-N 3.04Å; D527-S529 PolarHBondContact OD1-OG 3.05Å; S529-Q531 PolarHBondContact O-N 2.97Å
530	P	35.1	Very low	35.2	Very low	90 Å²	90	119.4 Å²	119.4	58%	0.584	65%	0.645	S	S	*	*			trans	-76.2	99.9	-169.9	29.2	-33.9	0	0	0	111	V528 L532	V528-P530 WeakPolarHBondContact O-CD 3.46Å; P530-L532 PolarHBondContact O-N 3.27Å
531	Q	33.7	Very low	36.4	Very low	183 Å²	183	115.7 Å²	115.7	86%	0.855	62%	0.615	S	S	*	*			trans	-58.7	123.9	177.9	-68.9	-175	7.6	0	0	111.1	S529 T533	S529-Q531 PolarHBondContact O-N 2.97Å; Q531-T533 PolarHBondContact O-N 3.28Å; Q531-T533 VanDerWaalsContact O-N 3.09Å
532	L	40.8	Very low	37.2	Very low	98 Å²	98	109.7 Å²	109.7	51%	0.513	59%	0.586	S	S	.	*			trans	-64.1	104.7	-169.5	-157.4	65.8	0	0	0	111.2	T141 P530	T141-L532 HydrophobicContact CG2-CD1 3.48Å; T141-L532 VanDerWaalsContact CG2-CD1 3.48Å; P530-L532 PolarHBondContact O-N 3.27Å
533	T	44.7	Very low	38.1	Very low	63 Å²	63	104 Å²	104	39%	0.387	57%	0.566	S	S	.	*			trans	-77.6	142.1	179.4	64.1	0	0	0	0	111.5	Q531 E535 K536 W537	Q531-T533 PolarHBondContact O-N 3.28Å; Q531-T533 VanDerWaalsContact O-N 3.09Å; T533-E535 PolarHBondContact O-N 2.75Å; T533-K536 PolarHBondContact O-N 3.26Å; T533-K536 PolarHBondContact OG1-N 3.2Å; T533-W537 PolarHBondContact O-N 3.23Å
534	D	44.2	Very low	39.4	Very low	118 Å²	118	102.8 Å²	102.8	63%	0.631	54%	0.536	S	S	*	.	H	α-helix	trans	-54.9	-24	171.2	-87.8	-37.2	0	0	0	111.6	S538	D534-S538 WeakPolarHBondContact O-CB 3.34Å; D534-S538 PolarHBondContact O-N 2.91Å; D534-S538 PolarHBondContact O-OG 3.22Å
535	E	42.3	Very low	40.3	Very low	148 Å²	148	99.8 Å²	99.8	69%	0.692	52%	0.518	S	S	*	.	H	α-helix	trans	-69.3	-44.3	179	-62.2	164.9	157.5	0	0	112.5	T533 S538 F539	T533-E535 PolarHBondContact O-N 2.75Å; E535-S538 PolarHBondContact O-N 3.21Å; E535-F539 WeakPolarHBondContact O-CB 3.44Å; E535-F539 PolarHBondContact O-N 3.27Å
536	K	43.6	Very low	41.2	Very low	109 Å²	109	94.9 Å²	94.9	47%	0.474	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-43.3	173.4	-90.4	-167.5	173.9	-172	0	111.1	T533 F539 F540	T533-K536 PolarHBondContact O-N 3.26Å; T533-K536 PolarHBondContact OG1-N 3.2Å; K536-F539 PolarHBondContact O-N 3.03Å; K536-F540 PolarHBondContact O-N 3.33Å
537	W	43.4	Very low	43.1	Very low	42 Å²	42	89.7 Å²	89.7	16%	0.159	48%	0.48	C	S	.	.	H	α-helix	trans	-59.4	-46.3	173.8	-95.8	94.5	0	0	0	112	I140 I499 T533 F539 H541	I140-W537 HydrophobicContact CB-CZ2 4.37Å; I140-W537 HydrophobicContact CD1-CH2 3.66Å; I140-W537 HydrophobicContact CD1-CZ2 3.45Å; I140-W537 VanDerWaalsContact CD1-CZ2 3.45Å; I140-W537 HydrophobicContact CG1-CH2 3.68Å; I140-W537 HydrophobicContact CG1-CZ2 3.6Å; I140-W537 HydrophobicContact CG1-CZ3 4.26Å; I140-W537 HydrophobicContact CG2-CD2 3.97Å; I140-W537 HydrophobicContact CG2-CG 4.23Å; I140-W537 HydrophobicContact CG2-CZ2 3.97Å; I499-W537 HydrophobicContact CD1-CH2 3.65Å; I499-W537 HydrophobicContact CD1-CZ2 3.5Å; I499-W537 VanDerWaalsContact CD1-CZ2 3.5Å; T533-W537 PolarHBondContact O-N 3.23Å; W537-F539 VanDerWaalsContact C-N 3.34Å; W537-H541 AromaticContact CE3-CE1 3.39Å; W537-H541 AromaticContact CE3-ND1 3.67Å; W537-H541 AromaticContact CZ3-CE1 3.48Å; W537-H541 VanDerWaalsContact CZ3-CE1 3.48Å; W537-H541 WeakPolarHBondContact CZ3-CE1 3.35Å; W537-H541 WeakPolarHBondContact O-CB 3.48Å; W537-H541 PolarHBondContact O-N 3.33Å; W537-H541 PolarHBondContact O-ND1 3.27Å
538	S	45.4	Very low	45.4	Very low	73 Å²	73	87.6 Å²	87.6	51%	0.51	47%	0.466	S	S	.	.	H	α-helix	trans	-67.3	-34.7	179.5	-61.3	0	0	0	0	111.8	D534 E535 H541 S542	D534-S538 WeakPolarHBondContact O-CB 3.34Å; D534-S538 PolarHBondContact O-N 2.91Å; D534-S538 PolarHBondContact O-OG 3.22Å; E535-S538 PolarHBondContact O-N 3.21Å; S538-H541 PolarHBondContact O-N 3.19Å; S538-S542 VanDerWaalsContact O-CB 3.22Å; S538-S542 WeakPolarHBondContact O-CB 3.43Å; S538-S542 PolarHBondContact O-N 2.79Å; S538-S542 PolarHBondContact O-OG 3.07Å
539	F	44.5	Very low	48.4	Very low	151 Å²	151	83.9 Å²	83.9	66%	0.662	44%	0.438	S	S	*	.	H	α-helix	trans	-64.5	-52.9	174.5	-178.5	-101.8	0	0	0	111.5	E535 K536 W537 H541 S542 S543	E535-F539 WeakPolarHBondContact O-CB 3.44Å; E535-F539 PolarHBondContact O-N 3.27Å; K536-F539 PolarHBondContact O-N 3.03Å; W537-F539 VanDerWaalsContact C-N 3.34Å; F539-H541 PolarHBondContact O-N 2.6Å; F539-S542 WeakPolarHBondContact CA-OG 3.23Å; F539-S542 PolarHBondContact O-N 3.14Å; F539-S542 PolarHBondContact O-OG 2.92Å; F539-S543 PolarHBondContact O-N 3Å; F539-S543 VanDerWaalsContact O-N 3.11Å; F539-S543 PolarHBondContact O-OG 3.42Å
540	F	50	Low	51.3	Low	33 Å²	33	81 Å²	81	15%	0.145	42%	0.417	C	S	.	.	H	α-helix	trans	-56.6	-36.2	177	-172.7	-80	0	0	0	112.2	A139 L213 K536 S543 R544	A139-F540 WeakPolarHBondContact O-CE2 3.42Å; L213-F540 HydrophobicContact CD1-CE1 3.55Å; L213-F540 HydrophobicContact CD1-CE2 4.44Å; L213-F540 HydrophobicContact CD1-CZ 3.48Å; L213-F540 VanDerWaalsContact CD1-CZ 3.48Å; K536-F540 PolarHBondContact O-N 3.33Å; F540-S543 PolarHBondContact O-OG 3.47Å; F540-S543 VanDerWaalsContact O-OG 3.07Å; F540-R544 VanDerWaalsContact CZ-CZ 3.44Å
541	H	51	Low	54.1	Low	34 Å²	34	76.7 Å²	76.7	16%	0.157	39%	0.389	C	S	.	.	H	α-helix	trans	-80.3	-32.6	175.9	-72.9	81.1	0	0	0	113.1	R220 W537 S538 F539 S543 R544 A545	R220-H541 PolarHBondContact NH1-CD2 3.37Å; R220-H541 PolarHBondContact NH1-NE2 3.04Å; R220-H541 PolarHBondContact NH2-NE2 3.4Å; R220-H541 VanDerWaalsContact NH2-NE2 3.12Å; W537-H541 AromaticContact CE3-CE1 3.39Å; W537-H541 AromaticContact CE3-ND1 3.67Å; W537-H541 AromaticContact CZ3-CE1 3.48Å; W537-H541 VanDerWaalsContact CZ3-CE1 3.48Å; W537-H541 WeakPolarHBondContact CZ3-CE1 3.35Å; W537-H541 WeakPolarHBondContact O-CB 3.48Å; W537-H541 PolarHBondContact O-N 3.33Å; W537-H541 PolarHBondContact O-ND1 3.27Å; S538-H541 PolarHBondContact O-N 3.19Å; F539-H541 PolarHBondContact O-N 2.6Å; H541-S543 PolarHBondContact O-N 2.96Å; H541-R544 CarbonylContact O-C 3.6Å; H541-R544 PolarHBondContact O-N 3.14Å; H541-A545 WeakPolarHBondContact O-CA 3.36Å; H541-A545 WeakPolarHBondContact O-CB 3.34Å; H541-A545 PolarHBondContact O-N 2.75Å
542	S	41.7	Very low	57	Low	39 Å²	39	69 Å²	69	27%	0.273	36%	0.355	S	S	.	.	H	α-helix	trans	-65.2	-39.6	177.8	70.4	0	0	0	0	112.3	S538 F539 R544 A545 H546	S538-S542 VanDerWaalsContact O-CB 3.22Å; S538-S542 WeakPolarHBondContact O-CB 3.43Å; S538-S542 PolarHBondContact O-N 2.79Å; S538-S542 PolarHBondContact O-OG 3.07Å; F539-S542 WeakPolarHBondContact CA-OG 3.23Å; F539-S542 PolarHBondContact O-N 3.14Å; F539-S542 PolarHBondContact O-OG 2.92Å; S542-R544 PolarHBondContact O-N 3.07Å; S542-A545 PolarHBondContact O-N 2.84Å; S542-H546 PolarHBondContact O-CD2 3.08Å; S542-H546 PolarHBondContact O-N 2.95Å; S542-H546 VanDerWaalsContact O-N 3.16Å
543	S	44.8	Very low	59.6	Low	63 Å²	63	64.4 Å²	64.4	44%	0.441	33%	0.331	S	S	.	.	H	α-helix	trans	-66.6	-25.9	177.3	59.1	0	0	0	0	112.9	F539 F540 H541 V547	F539-S543 PolarHBondContact O-N 3Å; F539-S543 VanDerWaalsContact O-N 3.11Å; F539-S543 PolarHBondContact O-OG 3.42Å; F540-S543 PolarHBondContact O-OG 3.47Å; F540-S543 VanDerWaalsContact O-OG 3.07Å; H541-S543 PolarHBondContact O-N 2.96Å; S543-V547 WeakPolarHBondContact O-CG2 3.49Å
544	R	51.8	Low	62	Low	56 Å²	56	64 Å²	64	21%	0.211	34%	0.335	C	S	.	.	H	α-helix	trans	-93.8	-27.6	173	-65	-175.3	179.2	179.8	8.3	113.5	E210 W214 R285 F540 H541 S542	E210-R544 IonicContact OE1-NH2 2.77Å; E210-R544 IonicContact OE2-CZ 2.69Å; E210-R544 VanDerWaalsContact OE2-CZ 3.22Å; E210-R544 IonicContact OE2-NH1 3.84Å; E210-R544 PolarHBondContact OE2-NH1 2.73Å; E210-R544 IonicContact OE2-NH2 2.8Å; E210-R544 PolarHBondContact OE2-NH2 3.35Å; W214-R544 HydrophobicContact CH2-CB 4.25Å; W214-R544 HydrophobicContact CH2-CG 4.29Å; W214-R544 HydrophobicContact CZ2-CG 4.28Å; R285-R544 VanDerWaalsContact O-O 3.08Å; F540-R544 VanDerWaalsContact CZ-CZ 3.44Å; H541-R544 CarbonylContact O-C 3.6Å; H541-R544 PolarHBondContact O-N 3.14Å; S542-R544 PolarHBondContact O-N 3.07Å
545	A	43.4	Very low	64.3	Low	41 Å²	41	61 Å²	61	34%	0.339	32%	0.32	S	S	.	.	H	α-helix	trans	-85.6	-21.3	-174.2	0	0	0	0	0	114.4	H541 S542	H541-A545 WeakPolarHBondContact O-CA 3.36Å; H541-A545 WeakPolarHBondContact O-CB 3.34Å; H541-A545 PolarHBondContact O-N 2.75Å; S542-A545 PolarHBondContact O-N 2.84Å
546	H	50.2	Low	66.6	Low	161 Å²	161	54 Å²	54	75%	0.745	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-1	179	-68.5	-52.7	0	0	0	114.4	S542	S542-H546 PolarHBondContact O-CD2 3.08Å; S542-H546 PolarHBondContact O-N 2.95Å; S542-H546 VanDerWaalsContact O-N 3.16Å
547	V	64.1	Low	68.9	Low	40 Å²	40	50.4 Å²	50.4	24%	0.242	28%	0.275	C	S	.	.			trans	-116.8	45.3	-176.7	-152.2	0	0	0	0	112	S286 G287 S543 R549	S286-V547 CarbonylContact C-O 3.54Å; G287-V547 WeakPolarHBondContact CA-O 3.46Å; G287-V547 PolarHBondContact N-O 2.84Å; S543-V547 WeakPolarHBondContact O-CG2 3.49Å; V547-R549 PolarHBondContact O-N 3.22Å
548	H	81.5	Confident	71.2	Confident	86 Å²	86	53.9 Å²	53.9	40%	0.398	29%	0.293	S	S	.	.			trans	-71.5	120.8	166.4	171.3	-94.8	0	0	0	110.2	E284	E284-H548 CarbonylContact O-C 3.56Å; E284-H548 WeakPolarHBondContact O-CA 3.24Å; E284-H548 IonicContact OE2-NE2 3.66Å
549	R	89.5	Confident	73.3	Confident	50 Å²	50	53.8 Å²	53.8	19%	0.189	28%	0.281	C	S	.	.			trans	-122.8	133.9	171.6	-61.7	-171.6	-163.7	-167.1	10	110.3	E284 G287 H288 V547 E556	E284-R549 WeakPolarHBondContact CA-O 3.21Å; E284-R549 WeakPolarHBondContact CB-O 3.27Å; E284-R549 WeakPolarHBondContact CG-O 3.49Å; E284-R549 PolarHBondContact O-N 3.36Å; G287-R549 WeakPolarHBondContact O-CD 3.29Å; G287-R549 PolarHBondContact O-NE 3.31Å; H288-R549 PolarHBondContact NE2-O 3.42Å; V547-R549 PolarHBondContact O-N 3.22Å; R549-E556 IonicContact NH1-OE1 2.7Å; R549-E556 PolarHBondContact NH1-OE1 3.36Å
550	P	92.2	Very high	75.3	Confident	23 Å²	23	46.8 Å²	46.8	15%	0.149	25%	0.251	C	S	.	.			trans	-64.9	139.2	170	-25.9	38.3	0	0	0	112.7	H288 T344 C552 T555	H288-P550 PolarHBondContact CE1-O 3.48Å; H288-P550 PolarHBondContact NE2-O 3.26Å; T344-P550 HydrophobicContact CG2-CB 3.84Å; T344-P550 WeakPolarHBondContact OG1-CA 3.5Å; T344-P550 VanDerWaalsContact OG1-CB 3.32Å; T344-P550 WeakPolarHBondContact OG1-CB 3.19Å; P550-C552 PolarHBondContact O-N 3.06Å; P550-C552 VanDerWaalsContact O-N 3.17Å; P550-T555 HydrophobicContact CG-CG2 3.86Å
551	S	93.8	Very high	77	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-69.7	3	171.5	-58.3	0	0	0	0	115	H280 F283 E284 T344 L573	H280-S551 PolarHBondContact NE2-OG 3.21Å; F283-S551 WeakPolarHBondContact CD1-OG 3.43Å; E284-S551 WeakPolarHBondContact CG-OG 3.49Å; E284-S551 PolarHBondContact OE1-N 3.39Å; E284-S551 PolarHBondContact OE1-OG 2.97Å; T344-S551 PolarHBondContact OG1-N 3.42Å; S551-L573 WeakPolarHBondContact O-CD1 3.15Å
552	C	94.9	Very high	78.7	Confident	20 Å²	20	51.9 Å²	51.9	14%	0.135	29%	0.292	C	S	.	.	S	Bend	trans	-100.7	138.7	179.6	65.5	0	0	0	0	113.5	T344 P345 D347 P550 A554 T555 E556	T344-C552 PolarHBondContact OG1-N 3.47Å; P345-C552 WeakPolarHBondContact O-CB 3.4Å; D347-C552 VanDerWaalsContact OD2-CA 3.27Å; D347-C552 WeakPolarHBondContact OD2-CA 3.4Å; P550-C552 PolarHBondContact O-N 3.06Å; P550-C552 VanDerWaalsContact O-N 3.17Å; C552-A554 VanDerWaalsContact C-N 3.33Å; C552-A554 PolarHBondContact O-N 2.82Å; C552-T555 PolarHBondContact O-N 3.29Å; C552-E556 PolarHBondContact O-N 3.09Å
553	V	95.4	Very high	80.6	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-38.4	-174.2	174.2	0	0	0	0	111.5	D347 T555 E556 V557 L573 H577 R607 L610	D347-V553 HydrophobicContact CB-CG2 4.04Å; D347-V553 PolarHBondContact OD2-N 3.36Å; V553-T555 VanDerWaalsContact C-N 3.34Å; V553-T555 PolarHBondContact O-N 3.01Å; V553-E556 PolarHBondContact O-N 3.23Å; V553-V557 HydrophobicContact CG1-CG2 3.91Å; V553-V557 WeakPolarHBondContact O-CB 3.25Å; V553-V557 VanDerWaalsContact O-CG2 3.24Å; V553-V557 WeakPolarHBondContact O-CG2 3.46Å; V553-V557 PolarHBondContact O-N 3.39Å; V553-L573 HydrophobicContact CG2-CD2 4.25Å; V553-H577 WeakPolarHBondContact CG2-NE2 3.46Å; V553-R607 HydrophobicContact CG2-CB 3.9Å; V553-R607 HydrophobicContact CG2-CG 4.06Å; V553-L610 HydrophobicContact CG1-CB 4.08Å
554	A	94.1	Very high	81.3	Confident	55 Å²	55	58.5 Å²	58.5	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-55.4	-44.9	-178.7	0	0	0	0	0	112.9	C552 E558	C552-A554 VanDerWaalsContact C-N 3.33Å; C552-A554 PolarHBondContact O-N 2.82Å; A554-E558 WeakPolarHBondContact O-CG 2.89Å; A554-E558 PolarHBondContact O-N 3.4Å; A554-E558 VanDerWaalsContact O-N 3.08Å
555	T	91.9	Very high	81.9	Confident	53 Å²	53	63.4 Å²	63.4	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-80.5	-27.7	-179.4	-53	0	0	0	0	112.7	P550 C552 V553 E558 R559	P550-T555 HydrophobicContact CG-CG2 3.86Å; C552-T555 PolarHBondContact O-N 3.29Å; V553-T555 VanDerWaalsContact C-N 3.34Å; V553-T555 PolarHBondContact O-N 3.01Å; T555-E558 PolarHBondContact O-N 3.1Å; T555-R559 WeakPolarHBondContact O-CB 3.18Å; T555-R559 PolarHBondContact O-N 3.1Å
556	E	92.3	Very high	82.6	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.009	35%	0.354	C	S	.	.	H	α-helix	trans	-68.2	-37.2	170.5	-172.8	68	170.6	0	0	111.2	R549 C552 V553 R559 L560 S571 L573	R549-E556 IonicContact NH1-OE1 2.7Å; R549-E556 PolarHBondContact NH1-OE1 3.36Å; C552-E556 PolarHBondContact O-N 3.09Å; V553-E556 PolarHBondContact O-N 3.23Å; E556-R559 VanDerWaalsContact CD-NE 3.32Å; E556-R559 WeakPolarHBondContact O-CB 3.38Å; E556-R559 PolarHBondContact O-N 2.7Å; E556-R559 IonicContact OE1-CZ 2.69Å; E556-R559 IonicContact OE1-NE 2.94Å; E556-R559 PolarHBondContact OE1-NE 3.09Å; E556-R559 IonicContact OE1-NH2 3.42Å; E556-R559 PolarHBondContact OE1-NH2 2.91Å; E556-R559 WeakPolarHBondContact OE2-CD 3.23Å; E556-R559 IonicContact OE2-CZ 3.02Å; E556-R559 IonicContact OE2-NE 3.8Å; E556-R559 PolarHBondContact OE2-NE 3.11Å; E556-R559 IonicContact OE2-NH2 3.82Å; E556-L560 HydrophobicContact CG-CD1 4.19Å; E556-L560 WeakPolarHBondContact O-CB 3.35Å; E556-L560 VanDerWaalsContact O-CG 3.24Å; E556-L560 WeakPolarHBondContact O-CG 3.43Å; E556-L560 PolarHBondContact O-N 3.25Å; E556-S571 WeakPolarHBondContact CG-OG 3.49Å; E556-S571 PolarHBondContact OE1-OG 3.14Å; E556-L573 HydrophobicContact CB-CD2 4Å; E556-L573 HydrophobicContact CG-CB 4.47Å; E556-L573 HydrophobicContact CG-CD2 4.42Å
557	V	91.8	Very high	83.5	Confident	34 Å²	34	64.2 Å²	64.2	21%	0.206	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-43.5	171.2	169.7	0	0	0	0	111.4	V553 L560 N561 L610	V553-V557 HydrophobicContact CG1-CG2 3.91Å; V553-V557 WeakPolarHBondContact O-CB 3.25Å; V553-V557 VanDerWaalsContact O-CG2 3.24Å; V553-V557 WeakPolarHBondContact O-CG2 3.46Å; V553-V557 PolarHBondContact O-N 3.39Å; V557-L560 PolarHBondContact O-N 3.13Å; V557-N561 WeakPolarHBondContact CG1-ND2 3.49Å; V557-N561 WeakPolarHBondContact O-CB 3.5Å; V557-N561 PolarHBondContact O-N 3.06Å; V557-N561 PolarHBondContact O-ND2 3.43Å; V557-L610 HydrophobicContact CG2-CB 3.99Å; V557-L610 WeakPolarHBondContact CG2-O 3.44Å
558	E	90.8	Very high	84.3	Confident	115 Å²	115	64.1 Å²	64.1	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-59.8	-44.7	172.2	-73.5	177.5	165.6	0	0	111.6	A554 T555 N561 A562	A554-E558 WeakPolarHBondContact O-CG 2.89Å; A554-E558 PolarHBondContact O-N 3.4Å; A554-E558 VanDerWaalsContact O-N 3.08Å; T555-E558 PolarHBondContact O-N 3.1Å; E558-N561 PolarHBondContact O-N 2.96Å; E558-A562 PolarHBondContact O-N 3.04Å; E558-A562 VanDerWaalsContact O-N 3.13Å
559	R	88.6	Confident	84.1	Confident	70 Å²	70	61.9 Å²	61.9	26%	0.264	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-46.5	177.2	-170.7	-165.4	67	72.9	-3.2	112.1	T555 E556 A562	T555-R559 WeakPolarHBondContact O-CB 3.18Å; T555-R559 PolarHBondContact O-N 3.1Å; E556-R559 VanDerWaalsContact CD-NE 3.32Å; E556-R559 WeakPolarHBondContact O-CB 3.38Å; E556-R559 PolarHBondContact O-N 2.7Å; E556-R559 IonicContact OE1-CZ 2.69Å; E556-R559 IonicContact OE1-NE 2.94Å; E556-R559 PolarHBondContact OE1-NE 3.09Å; E556-R559 IonicContact OE1-NH2 3.42Å; E556-R559 PolarHBondContact OE1-NH2 2.91Å; E556-R559 WeakPolarHBondContact OE2-CD 3.23Å; E556-R559 IonicContact OE2-CZ 3.02Å; E556-R559 IonicContact OE2-NE 3.8Å; E556-R559 PolarHBondContact OE2-NE 3.11Å; E556-R559 IonicContact OE2-NH2 3.82Å; R559-A562 PolarHBondContact O-N 2.97Å
560	L	87.4	Confident	83.8	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-36.9	179.1	-70.7	166.2	0	0	0	111.8	E556 V557 A562 L563 Q570 C611	E556-L560 HydrophobicContact CG-CD1 4.19Å; E556-L560 WeakPolarHBondContact O-CB 3.35Å; E556-L560 VanDerWaalsContact O-CG 3.24Å; E556-L560 WeakPolarHBondContact O-CG 3.43Å; E556-L560 PolarHBondContact O-N 3.25Å; V557-L560 PolarHBondContact O-N 3.13Å; L560-A562 VanDerWaalsContact C-N 3.26Å; L560-A562 PolarHBondContact O-N 3.22Å; L560-L563 HydrophobicContact CD2-CD1 4.07Å; L560-L563 WeakPolarHBondContact O-CB 3.45Å; L560-L563 PolarHBondContact O-N 3.43Å; L560-Q570 HydrophobicContact CD2-CB 4.21Å; L560-C611 WeakPolarHBondContact CD1-O 3.4Å
561	N	85.9	Confident	83.8	Confident	93 Å²	93	62.6 Å²	62.6	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-68.9	-21.7	175.1	-78.7	-53.8	0	0	0	113.8	V557 E558 L563 K567	V557-N561 WeakPolarHBondContact CG1-ND2 3.49Å; V557-N561 WeakPolarHBondContact O-CB 3.5Å; V557-N561 PolarHBondContact O-N 3.06Å; V557-N561 PolarHBondContact O-ND2 3.43Å; E558-N561 PolarHBondContact O-N 2.96Å; N561-L563 VanDerWaalsContact C-N 3.33Å; N561-K567 PolarHBondContact OD1-NZ 3.5Å
562	A	85.8	Confident	83.8	Confident	80 Å²	80	63.4 Å²	63.4	66%	0.661	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.7	173.8	0	0	0	0	0	114.1	E558 R559 L560	E558-A562 PolarHBondContact O-N 3.04Å; E558-A562 VanDerWaalsContact O-N 3.13Å; R559-A562 PolarHBondContact O-N 2.97Å; L560-A562 VanDerWaalsContact C-N 3.26Å; L560-A562 PolarHBondContact O-N 3.22Å
563	L	81.9	Confident	83.9	Confident	59 Å²	59	62.5 Å²	62.5	31%	0.309	34%	0.336	S	S	.	.			trans	-82.6	140.6	177.1	-59	179.2	0	0	0	111.9	L560 N561 Q565	L560-L563 HydrophobicContact CD2-CD1 4.07Å; L560-L563 WeakPolarHBondContact O-CB 3.45Å; L560-L563 PolarHBondContact O-N 3.43Å; N561-L563 VanDerWaalsContact C-N 3.33Å; L563-Q565 VanDerWaalsContact C-N 3.29Å; L563-Q565 PolarHBondContact O-N 2.89Å
564	L	60.3	Low	83.9	Confident	183 Å²	183	62.3 Å²	62.3	96%	0.958	34%	0.335	S	S	*	.	S	Bend	trans	-83	3	177.8	-65.4	172.2	0	0	0	114.1
565	Q	64	Low	84.1	Confident	159 Å²	159	62.7 Å²	62.7	74%	0.743	33%	0.327	S	S	*	.	S	Bend	trans	-133.9	173.2	-173.5	-70.4	-175.4	-22	0	0	111.2	L563 K567	L563-Q565 VanDerWaalsContact C-N 3.29Å; L563-Q565 PolarHBondContact O-N 2.89Å; Q565-K567 PolarHBondContact O-N 3.42Å
566	K	58.9	Low	84.3	Confident	128 Å²	128	60.2 Å²	60.2	56%	0.557	31%	0.311	S	S	*	.			trans	-47.1	124.7	-176.6	-79.8	-169.9	165.9	-172.8	0	111.6	I568 Q570 E656 A657	K566-I568 VanDerWaalsContact C-N 3.29Å; K566-I568 PolarHBondContact O-N 3.25Å; K566-Q570 PolarHBondContact O-NE2 3.41Å; K566-E656 WeakPolarHBondContact CE-O 3.36Å; K566-E656 PolarHBondContact NZ-O 2.81Å; K566-A657 VanDerWaalsContact NZ-C 3.32Å; K566-A657 PolarHBondContact NZ-O 3.44Å
567	K	67.5	Low	84.6	Confident	90 Å²	90	60.1 Å²	60.1	39%	0.391	31%	0.311	S	S	.	.			trans	-80	-7	-172	-57.7	178.5	-176	172.3	0	114.3	N561 Q565	N561-K567 PolarHBondContact OD1-NZ 3.5Å; Q565-K567 PolarHBondContact O-N 3.42Å
568	I	81.4	Confident	84.9	Confident	39 Å²	39	58.9 Å²	58.9	20%	0.2	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	141.4	-160.5	-71.8	170.8	0	0	0	111.2	K566 Q570 G612 L614 I617 Q653 A657	K566-I568 VanDerWaalsContact C-N 3.29Å; K566-I568 PolarHBondContact O-N 3.25Å; I568-Q570 VanDerWaalsContact C-N 3.28Å; I568-Q570 PolarHBondContact O-N 3.06Å; I568-G612 CarbonylContact C-O 3.59Å; I568-G612 WeakPolarHBondContact CA-O 3.42Å; I568-G612 VanDerWaalsContact CG2-O 3.31Å; I568-G612 WeakPolarHBondContact CG2-O 3.46Å; I568-L614 HydrophobicContact CG2-CB 3.8Å; I568-L614 HydrophobicContact CG2-CD1 4.24Å; I568-L614 HydrophobicContact CG2-CG 4.45Å; I568-I617 HydrophobicContact CD1-CD1 3.97Å; I568-I617 HydrophobicContact CG1-CD1 4.03Å; I568-Q653 HydrophobicContact CD1-CG 4.02Å; I568-A657 HydrophobicContact CD1-CB 3.48Å; I568-A657 VanDerWaalsContact CD1-CB 3.48Å; I568-A657 HydrophobicContact CG2-CB 4.14Å
569	G	78.1	Confident	85.2	Confident	39 Å²	39	53.8 Å²	53.8	40%	0.402	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	9.7	-179.3	0	0	0	0	0	115.8	G612	G569-G612 PolarHBondContact N-O 2.84Å
570	Q	81.9	Confident	85.7	Confident	88 Å²	88	50.5 Å²	50.5	41%	0.411	27%	0.268	S	S	.	.			trans	-100.1	3.3	-175.2	-61.2	-166.1	11.7	0	0	114.5	L560 K566 I568	L560-Q570 HydrophobicContact CD2-CB 4.21Å; K566-Q570 PolarHBondContact O-NE2 3.41Å; I568-Q570 VanDerWaalsContact C-N 3.28Å; I568-Q570 PolarHBondContact O-N 3.06Å
571	S	92.3	Very high	86.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.267	C	S	.	.			trans	-112.3	101.9	-172.7	-173.9	0	0	0	0	112	E556 L573 G574 K575 C611 E613	E556-S571 WeakPolarHBondContact CG-OG 3.49Å; E556-S571 PolarHBondContact OE1-OG 3.14Å; S571-L573 PolarHBondContact O-N 2.84Å; S571-G574 WeakPolarHBondContact O-CA 3.47Å; S571-G574 PolarHBondContact O-N 3.17Å; S571-G574 PolarHBondContact OG-N 3.43Å; S571-K575 PolarHBondContact O-N 3.37Å; S571-C611 WeakPolarHBondContact CB-O 3.29Å; S571-C611 WeakPolarHBondContact OG-CB 3.39Å; S571-E613 PolarHBondContact N-OE1 3.17Å; S571-E613 VanDerWaalsContact O-OE1 3.13Å
572	I	94.1	Very high	86.6	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.087	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-29.9	171.3	-39.2	175.6	0	0	0	110.5	H288 Q289 E310 V322 K575 V576	H288-I572 HydrophobicContact CB-CB 3.82Å; H288-I572 HydrophobicContact CB-CD1 4.26Å; H288-I572 HydrophobicContact CB-CG2 4.2Å; H288-I572 WeakPolarHBondContact O-CG2 3.11Å; Q289-I572 HydrophobicContact CG-CD1 4.04Å; E310-I572 HydrophobicContact CB-CD1 4.17Å; E310-I572 HydrophobicContact CB-CG2 4.02Å; E310-I572 HydrophobicContact CG-CB 4.36Å; E310-I572 HydrophobicContact CG-CD1 3.94Å; E310-I572 HydrophobicContact CG-CG1 3.93Å; E310-I572 HydrophobicContact CG-CG2 3.6Å; V322-I572 HydrophobicContact CG1-CG2 4.01Å; I572-K575 PolarHBondContact O-N 3.1Å; I572-V576 WeakPolarHBondContact O-CG2 2.97Å; I572-V576 PolarHBondContact O-N 2.83Å
573	L	96.5	Very high	87.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-43	172.1	-174.4	62.7	0	0	0	111.1	F283 F346 S551 V553 E556 S571 K575 V576 H577	F283-L573 HydrophobicContact CE1-CD1 4.29Å; F283-L573 HydrophobicContact CZ-CD1 4.35Å; F346-L573 HydrophobicContact CD2-CD1 3.93Å; F346-L573 HydrophobicContact CE2-CD1 3.76Å; S551-L573 WeakPolarHBondContact O-CD1 3.15Å; V553-L573 HydrophobicContact CG2-CD2 4.25Å; E556-L573 HydrophobicContact CB-CD2 4Å; E556-L573 HydrophobicContact CG-CB 4.47Å; E556-L573 HydrophobicContact CG-CD2 4.42Å; S571-L573 PolarHBondContact O-N 2.84Å; L573-K575 PolarHBondContact O-N 3.05Å; L573-V576 WeakPolarHBondContact O-CB 3.34Å; L573-V576 PolarHBondContact O-N 3.06Å; L573-V576 VanDerWaalsContact O-N 3.14Å; L573-H577 PolarHBondContact O-CD2 2.98Å; L573-H577 PolarHBondContact O-N 3.41Å
574	G	96.8	Very high	87.7	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-45.3	172.6	0	0	0	0	0	112.6	S571 V576 H577 L578	S571-G574 WeakPolarHBondContact O-CA 3.47Å; S571-G574 PolarHBondContact O-N 3.17Å; S571-G574 PolarHBondContact OG-N 3.43Å; G574-V576 VanDerWaalsContact C-N 3.27Å; G574-V576 PolarHBondContact O-N 2.92Å; G574-H577 PolarHBondContact O-N 3.36Å; G574-H577 VanDerWaalsContact O-N 3.17Å; G574-L578 PolarHBondContact O-N 2.84Å
575	K	97.1	Very high	89.3	Confident	63 Å²	63	40.9 Å²	40.9	27%	0.274	19%	0.193	S	C	.	.	H	α-helix	trans	-59.9	-35.4	174	-64	-175.8	-175.6	-172.8	0	112.7	E310 V322 S571 I572 L573 A579 E613	E310-K575 IonicContact OE1-NZ 3.71Å; E310-K575 PolarHBondContact OE1-NZ 3.42Å; V322-K575 HydrophobicContact CB-CB 4.37Å; V322-K575 HydrophobicContact CG1-CB 4.05Å; V322-K575 HydrophobicContact CG2-CB 4.38Å; S571-K575 PolarHBondContact O-N 3.37Å; I572-K575 PolarHBondContact O-N 3.1Å; L573-K575 PolarHBondContact O-N 3.05Å; K575-A579 WeakPolarHBondContact O-CB 3.36Å; K575-A579 PolarHBondContact O-N 2.91Å; K575-E613 HydrophobicContact CG-CG 4.41Å; K575-E613 VanDerWaalsContact CG-OE2 3.3Å; K575-E613 WeakPolarHBondContact CG-OE2 3.48Å
576	V	98	Very high	90.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-42.5	174.3	170.7	0	0	0	0	111.4	F283 V322 M325 A326 F329 F346 I572 L573 G574 A579 M580	F283-V576 HydrophobicContact CE2-CG2 4.41Å; F283-V576 HydrophobicContact CZ-CG2 4.41Å; V322-V576 HydrophobicContact CB-CG2 4.14Å; V322-V576 HydrophobicContact CG1-CG2 4.45Å; M325-V576 HydrophobicContact CB-CG1 4.43Å; M325-V576 HydrophobicContact CB-CG2 3.68Å; M325-V576 HydrophobicContact CG-CG2 4.47Å; M325-V576 HydrophobicContact SD-CG2 4Å; A326-V576 HydrophobicContact CB-CG1 4.17Å; F329-V576 HydrophobicContact CD2-CG1 4.29Å; F346-V576 HydrophobicContact CE2-CG1 3.9Å; F346-V576 HydrophobicContact CZ-CG1 3.99Å; I572-V576 WeakPolarHBondContact O-CG2 2.97Å; I572-V576 PolarHBondContact O-N 2.83Å; L573-V576 WeakPolarHBondContact O-CB 3.34Å; L573-V576 PolarHBondContact O-N 3.06Å; L573-V576 VanDerWaalsContact O-N 3.14Å; G574-V576 VanDerWaalsContact C-N 3.27Å; G574-V576 PolarHBondContact O-N 2.92Å; V576-A579 PolarHBondContact O-N 3.01Å; V576-M580 WeakPolarHBondContact O-CG 3.4Å; V576-M580 PolarHBondContact O-N 3.21Å
577	H	98.3	Very high	92.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-42.5	172.1	-74.4	-70.8	0	0	0	112.1	F346 D347 V553 L573 G574 A579 M580 V581 H604 R607 A608	F346-H577 AromaticContact CE1-CE1 3.82Å; F346-H577 AromaticContact CE2-CE1 3.43Å; F346-H577 VanDerWaalsContact CE2-CE1 3.43Å; F346-H577 WeakPolarHBondContact CE2-CE1 3.4Å; F346-H577 AromaticContact CE2-NE2 3.46Å; F346-H577 WeakPolarHBondContact CE2-NE2 3.16Å; F346-H577 AromaticContact CZ-CE1 3.25Å; F346-H577 WeakPolarHBondContact CZ-CE1 3.47Å; F346-H577 AromaticContact CZ-ND1 3.62Å; F346-H577 AromaticContact CZ-NE2 3.76Å; D347-H577 PolarHBondContact O-CE1 3.28Å; V553-H577 WeakPolarHBondContact CG2-NE2 3.46Å; L573-H577 PolarHBondContact O-CD2 2.98Å; L573-H577 PolarHBondContact O-N 3.41Å; G574-H577 PolarHBondContact O-N 3.36Å; G574-H577 VanDerWaalsContact O-N 3.17Å; H577-A579 VanDerWaalsContact C-N 3.27Å; H577-A579 PolarHBondContact O-N 3.04Å; H577-M580 WeakPolarHBondContact O-CA 3.46Å; H577-M580 VanDerWaalsContact O-CB 3.29Å; H577-M580 WeakPolarHBondContact O-CB 3.33Å; H577-M580 PolarHBondContact O-N 3.31Å; H577-V581 WeakPolarHBondContact O-CG2 3.16Å; H577-V581 PolarHBondContact O-N 3.16Å; H577-V581 VanDerWaalsContact O-N 3.09Å; H577-H604 AromaticContact CE1-CE1 3.59Å; H577-H604 AromaticContact CE1-ND1 3.8Å; H577-H604 AromaticContact CG-ND1 3.89Å; H577-H604 AromaticContact ND1-CE1 3.42Å; H577-H604 PolarHBondContact ND1-CE1 3.33Å; H577-H604 AromaticContact ND1-ND1 2.89Å; H577-H604 PolarHBondContact ND1-ND1 3.07Å; H577-R607 HydrophobicContact CB-CB 4Å; H577-A608 HydrophobicContact CB-CB 3.96Å
578	L	97.8	Very high	93.3	Very high	9 Å²	9	35.2 Å²	35.2	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-34.6	175.1	-177.6	59.3	0	0	0	112.2	G574 V581 R582 L605 A608 E615 A616 I631	G574-L578 PolarHBondContact O-N 2.84Å; L578-V581 WeakPolarHBondContact O-CB 3.44Å; L578-V581 PolarHBondContact O-N 3.17Å; L578-R582 PolarHBondContact O-N 3.09Å; L578-L605 HydrophobicContact CD1-CD1 4.43Å; L578-A608 HydrophobicContact CB-CB 4.05Å; L578-E615 HydrophobicContact CD2-CB 3.96Å; L578-E615 HydrophobicContact CD2-CG 4.36Å; L578-A616 HydrophobicContact CD1-CB 4.48Å; L578-I631 HydrophobicContact CD1-CD1 4.21Å
579	A	97.4	Very high	93.7	Very high	8 Å²	8	35.2 Å²	35.2	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-68.7	-31.3	172.2	0	0	0	0	0	113	R323 A326 K575 V576 H577 Y583	R323-A579 HydrophobicContact CG-CB 4.4Å; A326-A579 HydrophobicContact CB-CB 3.85Å; K575-A579 WeakPolarHBondContact O-CB 3.36Å; K575-A579 PolarHBondContact O-N 2.91Å; V576-A579 PolarHBondContact O-N 3.01Å; H577-A579 VanDerWaalsContact C-N 3.27Å; H577-A579 PolarHBondContact O-N 3.04Å; A579-Y583 WeakPolarHBondContact O-CD2 3.36Å; A579-Y583 PolarHBondContact O-N 2.97Å
580	M	97.3	Very high	94.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-43.2	170.4	-67	-74	-70.8	0	0	111.4	A326 H330 F346 E352 V576 H577 R582 Y583 H584 F589 H604	A326-M580 HydrophobicContact CB-CG 3.9Å; A326-M580 HydrophobicContact CB-SD 3.8Å; A326-M580 VanDerWaalsContact O-SD 3.37Å; H330-M580 HydrophobicContact CB-CE 3.8Å; H330-M580 HydrophobicContact CB-SD 4.01Å; F346-M580 HydrophobicContact CZ-CG 4.42Å; E352-M580 WeakPolarHBondContact OE1-CE 3.13Å; V576-M580 WeakPolarHBondContact O-CG 3.4Å; V576-M580 PolarHBondContact O-N 3.21Å; H577-M580 WeakPolarHBondContact O-CA 3.46Å; H577-M580 VanDerWaalsContact O-CB 3.29Å; H577-M580 WeakPolarHBondContact O-CB 3.33Å; H577-M580 PolarHBondContact O-N 3.31Å; M580-R582 PolarHBondContact O-N 3.49Å; M580-Y583 PolarHBondContact O-N 3.04Å; M580-Y583 VanDerWaalsContact O-N 3.11Å; M580-H584 PolarHBondContact O-CD2 3.21Å; M580-H584 PolarHBondContact O-N 3.17Å; M580-F589 HydrophobicContact CE-CE2 4.37Å; M580-F589 HydrophobicContact SD-CE2 4.39Å; M580-F589 HydrophobicContact SD-CZ 4.35Å; M580-H604 HydrophobicContact CB-CB 3.99Å; M580-H604 WeakPolarHBondContact CE-NE2 3.48Å
581	V	97.5	Very high	94.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-53.8	-54.1	176.2	-176.1	0	0	0	0	110.8	H577 L578 Y583 H584 E585 H604 L605 I631 L632	H577-V581 WeakPolarHBondContact O-CG2 3.16Å; H577-V581 PolarHBondContact O-N 3.16Å; H577-V581 VanDerWaalsContact O-N 3.09Å; L578-V581 WeakPolarHBondContact O-CB 3.44Å; L578-V581 PolarHBondContact O-N 3.17Å; V581-Y583 PolarHBondContact O-N 3.18Å; V581-H584 PolarHBondContact O-N 2.8Å; V581-E585 WeakPolarHBondContact O-CB 3.4Å; V581-E585 PolarHBondContact O-N 2.99Å; V581-H604 HydrophobicContact CG2-CB 3.72Å; V581-L605 HydrophobicContact CG1-CD1 4.36Å; V581-L605 HydrophobicContact CG2-CB 3.88Å; V581-L605 HydrophobicContact CG2-CD1 4.16Å; V581-L605 VanDerWaalsContact CG2-N 3.33Å; V581-I631 HydrophobicContact CG1-CG2 3.96Å; V581-L632 HydrophobicContact CG1-CD1 3.86Å; V581-L632 HydrophobicContact CG1-CD2 3.69Å; V581-L632 HydrophobicContact CG1-CG 3.79Å
582	R	96.2	Very high	93.7	Very high	116 Å²	116	46.3 Å²	46.3	44%	0.438	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-21.4	-179.6	-64.8	-179	-174.8	172.3	2.9	113.5	L578 M580 A586 E615	L578-R582 PolarHBondContact O-N 3.09Å; M580-R582 PolarHBondContact O-N 3.49Å; R582-A586 WeakPolarHBondContact O-CB 3.2Å; R582-A586 PolarHBondContact O-N 3.48Å; R582-E615 IonicContact CZ-OE2 2.73Å; R582-E615 IonicContact NH2-OE1 3.2Å; R582-E615 PolarHBondContact NH2-OE1 3.2Å; R582-E615 IonicContact NH2-OE2 3.16Å; R582-E615 PolarHBondContact NH2-OE2 3.39Å
583	Y	95.7	Very high	93.2	Very high	44 Å²	44	52.1 Å²	52.1	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-84.3	-37.6	173.9	-82.4	-52.2	0	0	0	113.2	R323 A326 L327 A579 M580 V581 R588 F589	R323-Y583 HydrophobicContact CB-CE2 3.89Å; R323-Y583 WeakPolarHBondContact CB-OH 3.31Å; R323-Y583 WeakPolarHBondContact O-CE2 3.31Å; A326-Y583 HydrophobicContact CB-CD2 4.35Å; A326-Y583 HydrophobicContact CB-CE2 4.39Å; L327-Y583 HydrophobicContact CD1-CE2 4.33Å; L327-Y583 WeakPolarHBondContact CD1-OH 3.43Å; L327-Y583 HydrophobicContact CD2-CD1 4.4Å; L327-Y583 HydrophobicContact CD2-CD2 4Å; L327-Y583 HydrophobicContact CD2-CE1 4.11Å; L327-Y583 HydrophobicContact CD2-CE2 3.69Å; L327-Y583 HydrophobicContact CD2-CG 4.35Å; L327-Y583 HydrophobicContact CG-CD2 4.36Å; L327-Y583 HydrophobicContact CG-CE2 3.63Å; A579-Y583 WeakPolarHBondContact O-CD2 3.36Å; A579-Y583 PolarHBondContact O-N 2.97Å; M580-Y583 PolarHBondContact O-N 3.04Å; M580-Y583 VanDerWaalsContact O-N 3.11Å; V581-Y583 PolarHBondContact O-N 3.18Å; Y583-R588 HydrophobicContact CD1-CB 3.81Å; Y583-R588 HydrophobicContact CD1-CG 3.67Å; Y583-R588 HydrophobicContact CE1-CG 4.18Å; Y583-R588 HydrophobicContact CG-CB 4.39Å; Y583-R588 HydrophobicContact CG-CG 4.41Å; Y583-R588 WeakPolarHBondContact O-CB 3.18Å; Y583-R588 PolarHBondContact O-N 3.11Å; Y583-F589 HydrophobicContact CD2-CZ 4.18Å; Y583-F589 HydrophobicContact CG-CE2 4.33Å; Y583-F589 HydrophobicContact CG-CZ 4.02Å
584	H	94.9	Very high	92.7	Very high	3 Å²	3	57.4 Å²	57.4	1%	0.014	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-51	170.5	-79.4	-70	0	0	0	110.4	E352 M580 V581 A586 G587 F589 W596 S600 A601	E352-H584 IonicContact OE1-CE1 3.49Å; E352-H584 IonicContact OE1-NE2 3.9Å; E352-H584 PolarHBondContact OE1-NE2 2.86Å; M580-H584 PolarHBondContact O-CD2 3.21Å; M580-H584 PolarHBondContact O-N 3.17Å; V581-H584 PolarHBondContact O-N 2.8Å; H584-A586 VanDerWaalsContact C-N 3.3Å; H584-A586 PolarHBondContact O-N 3.27Å; H584-G587 PolarHBondContact O-N 3.23Å; H584-F589 AromaticContact CD2-CD2 3.93Å; H584-F589 AromaticContact CE1-CD2 3.57Å; H584-F589 AromaticContact CG-CD2 3.87Å; H584-F589 AromaticContact ND1-CD2 3.64Å; H584-F589 AromaticContact NE2-CD2 3.73Å; H584-W596 VanDerWaalsContact O-CB 3.27Å; H584-W596 WeakPolarHBondContact O-CB 3.39Å; H584-S600 VanDerWaalsContact CE1-CB 3.44Å; H584-S600 WeakPolarHBondContact CE1-CB 3.42Å; H584-S600 WeakPolarHBondContact NE2-CB 3.2Å; H584-A601 HydrophobicContact CB-CB 3.86Å
585	E	93.6	Very high	92.3	Very high	55 Å²	55	63 Å²	63	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-52	-42.9	174.7	-179.1	178.3	-124.7	0	0	113.3	V581 G587 L632 P633	V581-E585 WeakPolarHBondContact O-CB 3.4Å; V581-E585 PolarHBondContact O-N 2.99Å; E585-G587 PolarHBondContact O-N 2.8Å; E585-L632 HydrophobicContact CB-CD2 3.87Å; E585-L632 HydrophobicContact CG-CD2 4.19Å; E585-L632 WeakPolarHBondContact OE1-CA 3.47Å; E585-L632 PolarHBondContact OE1-N 3.02Å; E585-P633 WeakPolarHBondContact OE1-CD 3.43Å
586	A	92.9	Very high	92	Very high	74 Å²	74	62.4 Å²	62.4	61%	0.612	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	10.3	177.8	0	0	0	0	0	114.4	R582 H584 R588	R582-A586 WeakPolarHBondContact O-CB 3.2Å; R582-A586 PolarHBondContact O-N 3.48Å; H584-A586 VanDerWaalsContact C-N 3.3Å; H584-A586 PolarHBondContact O-N 3.27Å; A586-R588 PolarHBondContact O-N 3.23Å
587	G	91.4	Very high	91.7	Very high	29 Å²	29	64 Å²	64	30%	0.299	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	29.1	-178.9	0	0	0	0	0	113.6	H584 E585 F589 C590	H584-G587 PolarHBondContact O-N 3.23Å; E585-G587 PolarHBondContact O-N 2.8Å; G587-F589 VanDerWaalsContact C-N 3.32Å; G587-F589 PolarHBondContact O-N 3.18Å; G587-C590 PolarHBondContact O-SG 3.36Å
588	R	91.1	Very high	91.5	Very high	155 Å²	155	67.6 Å²	67.6	59%	0.585	34%	0.339	S	S	*	.			trans	-77	-18.8	-171.3	-174.9	54.2	-173.5	-164.6	4.9	113.9	Y583 A586	Y583-R588 HydrophobicContact CD1-CB 3.81Å; Y583-R588 HydrophobicContact CD1-CG 3.67Å; Y583-R588 HydrophobicContact CE1-CG 4.18Å; Y583-R588 HydrophobicContact CG-CB 4.39Å; Y583-R588 HydrophobicContact CG-CG 4.41Å; Y583-R588 WeakPolarHBondContact O-CB 3.18Å; Y583-R588 PolarHBondContact O-N 3.11Å; A586-R588 PolarHBondContact O-N 3.23Å
589	F	89.6	Confident	91.2	Very high	39 Å²	39	73.1 Å²	73.1	17%	0.171	37%	0.369	C	S	.	.	S	Bend	trans	-115.1	-7.9	-171.2	-57.4	-47.1	0	0	0	114.5	L327 H330 M580 Y583 H584 G587	L327-F589 HydrophobicContact CD2-CE1 3.83Å; L327-F589 HydrophobicContact CD2-CZ 4.13Å; H330-F589 HydrophobicContact CB-CE1 4.03Å; H330-F589 HydrophobicContact CB-CZ 3.88Å; H330-F589 AromaticContact CD2-CD1 3.4Å; H330-F589 WeakPolarHBondContact CD2-CD1 3.27Å; H330-F589 AromaticContact CD2-CE1 3.44Å; H330-F589 VanDerWaalsContact CD2-CE1 3.44Å; H330-F589 WeakPolarHBondContact CD2-CE1 3.17Å; H330-F589 AromaticContact CE1-CD1 3.72Å; H330-F589 AromaticContact CE1-CD2 3.84Å; H330-F589 AromaticContact CE1-CG 3.5Å; H330-F589 VanDerWaalsContact CE1-CG 3.5Å; H330-F589 WeakPolarHBondContact CE1-CG 3.24Å; H330-F589 AromaticContact CG-CD1 3.82Å; H330-F589 AromaticContact CG-CE1 3.56Å; H330-F589 AromaticContact CG-CZ 3.67Å; H330-F589 AromaticContact ND1-CD1 4Å; H330-F589 AromaticContact ND1-CD2 3.84Å; H330-F589 AromaticContact ND1-CE2 3.87Å; H330-F589 AromaticContact ND1-CG 3.89Å; H330-F589 AromaticContact ND1-CZ 3.97Å; H330-F589 AromaticContact NE2-CD1 3.33Å; H330-F589 VanDerWaalsContact NE2-CD1 3.33Å; H330-F589 WeakPolarHBondContact NE2-CD1 3.42Å; H330-F589 AromaticContact NE2-CE1 3.89Å; H330-F589 AromaticContact NE2-CG 3.57Å; M580-F589 HydrophobicContact CE-CE2 4.37Å; M580-F589 HydrophobicContact SD-CE2 4.39Å; M580-F589 HydrophobicContact SD-CZ 4.35Å; Y583-F589 HydrophobicContact CD2-CZ 4.18Å; Y583-F589 HydrophobicContact CG-CE2 4.33Å; Y583-F589 HydrophobicContact CG-CZ 4.02Å; H584-F589 AromaticContact CD2-CD2 3.93Å; H584-F589 AromaticContact CE1-CD2 3.57Å; H584-F589 AromaticContact CG-CD2 3.87Å; H584-F589 AromaticContact ND1-CD2 3.64Å; H584-F589 AromaticContact NE2-CD2 3.73Å; G587-F589 VanDerWaalsContact C-N 3.32Å; G587-F589 PolarHBondContact O-N 3.18Å
590	C	86.3	Confident	91.1	Very high	39 Å²	39	72.8 Å²	72.8	26%	0.264	37%	0.366	S	S	.	.	S	Bend	trans	-91.8	166.2	172.6	59.8	0	0	0	0	111.5	G587 E594	G587-C590 PolarHBondContact O-SG 3.36Å; C590-E594 HydrophobicContact CB-CB 4.2Å
591	E	83	Confident	91.1	Very high	152 Å²	152	72.8 Å²	72.8	71%	0.71	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-72.2	168.3	168.7	-65.6	-158	-179.2	0	0	111.5	D593 E594	E591-D593 PolarHBondContact O-N 3.45Å; E591-E594 HydrophobicContact CB-CG 4.1Å; E591-E594 WeakPolarHBondContact CB-OE2 3.43Å; E591-E594 PolarHBondContact N-OE2 3.38Å; E591-E594 PolarHBondContact O-N 2.99Å
592	K	81.6	Confident	91	Very high	169 Å²	169	74 Å²	74	74%	0.735	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	133.1	179.6	-169.3	-168.1	170.9	-77.2	0	109.5	E594	K592-E594 PolarHBondContact O-N 3.37Å
593	D	83.7	Confident	91	Very high	139 Å²	139	70.6 Å²	70.6	74%	0.743	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	8.9	-179.7	-42.5	-48.3	0	0	0	114.4	E591	E591-D593 PolarHBondContact O-N 3.45Å
594	E	86.8	Confident	91.2	Very high	112 Å²	112	68.5 Å²	68.5	52%	0.523	35%	0.352	S	S	.	.	S	Bend	trans	-84.8	155	164.2	-70.6	-166.3	134.4	0	0	112.2	C590 E591 K592	C590-E594 HydrophobicContact CB-CB 4.2Å; E591-E594 HydrophobicContact CB-CG 4.1Å; E591-E594 WeakPolarHBondContact CB-OE2 3.43Å; E591-E594 PolarHBondContact N-OE2 3.38Å; E591-E594 PolarHBondContact O-N 2.99Å; K592-E594 PolarHBondContact O-N 3.37Å
595	P	87.8	Confident	91.3	Very high	117 Å²	117	68.5 Å²	68.5	76%	0.76	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-68.2	144.9	167.2	30.8	-34.9	0	0	0	111.1
596	W	90.9	Very high	91.4	Very high	51 Å²	51	68.5 Å²	68.5	19%	0.193	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-78.7	156.9	175.9	59.7	-91.4	0	0	0	112.3	H584 Q598 A601 L632 M635	H584-W596 VanDerWaalsContact O-CB 3.27Å; H584-W596 WeakPolarHBondContact O-CB 3.39Å; W596-Q598 HydrophobicContact CD2-CG 4.23Å; W596-Q598 HydrophobicContact CE3-CG 3.9Å; W596-Q598 HydrophobicContact CH2-CG 3.8Å; W596-Q598 HydrophobicContact CZ2-CG 4.13Å; W596-Q598 HydrophobicContact CZ3-CB 4.23Å; W596-Q598 HydrophobicContact CZ3-CG 3.68Å; W596-Q598 PolarHBondContact O-N 3.44Å; W596-Q598 VanDerWaalsContact O-N 3.08Å; W596-A601 HydrophobicContact CE3-CB 4.32Å; W596-A601 HydrophobicContact CZ3-CB 3.66Å; W596-L632 HydrophobicContact CH2-CD2 3.7Å; W596-L632 HydrophobicContact CZ3-CD2 3.82Å; W596-M635 HydrophobicContact CH2-CG 3.77Å; W596-M635 HydrophobicContact CH2-SD 3.86Å; W596-M635 HydrophobicContact CZ2-CG 4.48Å; W596-M635 HydrophobicContact CZ3-SD 4.14Å
597	D	92	Very high	91.6	Very high	33 Å²	33	67.8 Å²	67.8	18%	0.176	33%	0.333	C	S	.	.			trans	-81.5	92.2	-170.7	-174.1	-13	0	0	0	112.1	P351 D599 S600 A601	P351-D597 WeakPolarHBondContact CB-OD2 3.17Å; D597-D599 PolarHBondContact OD1-N 2.88Å; D597-S600 WeakPolarHBondContact OD1-CB 3.39Å; D597-S600 PolarHBondContact OD1-N 3.39Å; D597-S600 PolarHBondContact OD1-OG 3.44Å; D597-S600 VanDerWaalsContact OD2-CB 3.29Å; D597-S600 WeakPolarHBondContact OD2-CB 3.39Å; D597-S600 PolarHBondContact OD2-OG 2.89Å; D597-A601 WeakPolarHBondContact O-CB 3.47Å; D597-A601 PolarHBondContact O-N 3.37Å
598	Q	93	Very high	91.9	Very high	75 Å²	75	66.4 Å²	66.4	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-65.6	-35.9	179.4	-65.4	-156.9	-17.7	0	0	113.5	W596 A601 M602 M635	W596-Q598 HydrophobicContact CD2-CG 4.23Å; W596-Q598 HydrophobicContact CE3-CG 3.9Å; W596-Q598 HydrophobicContact CH2-CG 3.8Å; W596-Q598 HydrophobicContact CZ2-CG 4.13Å; W596-Q598 HydrophobicContact CZ3-CB 4.23Å; W596-Q598 HydrophobicContact CZ3-CG 3.68Å; W596-Q598 PolarHBondContact O-N 3.44Å; W596-Q598 VanDerWaalsContact O-N 3.08Å; Q598-A601 PolarHBondContact O-N 3.45Å; Q598-M602 PolarHBondContact O-N 3.33Å; Q598-M635 HydrophobicContact CB-CE 3.65Å; Q598-M635 HydrophobicContact CB-SD 3.83Å; Q598-M635 HydrophobicContact CG-CE 4.36Å; Q598-M635 HydrophobicContact CG-CG 4.37Å; Q598-M635 HydrophobicContact CG-SD 4.14Å
599	D	93.2	Very high	92.1	Very high	126 Å²	126	59.1 Å²	59.1	67%	0.674	29%	0.292	S	S	*	.	H	α-helix	trans	-67	-44.1	179	-73.8	-30.2	0	0	0	110.6	D597 F603	D597-D599 PolarHBondContact OD1-N 2.88Å; D599-F603 WeakPolarHBondContact O-CB 3.45Å; D599-F603 PolarHBondContact O-N 3.35Å
600	S	95.4	Very high	92.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-41	173.5	-66.8	0	0	0	0	112.2	S349 H584 D597 F603 H604	S349-S600 WeakPolarHBondContact CB-OG 3.47Å; S349-S600 PolarHBondContact OG-OG 3.11Å; H584-S600 VanDerWaalsContact CE1-CB 3.44Å; H584-S600 WeakPolarHBondContact CE1-CB 3.42Å; H584-S600 WeakPolarHBondContact NE2-CB 3.2Å; D597-S600 WeakPolarHBondContact OD1-CB 3.39Å; D597-S600 PolarHBondContact OD1-N 3.39Å; D597-S600 PolarHBondContact OD1-OG 3.44Å; D597-S600 VanDerWaalsContact OD2-CB 3.29Å; D597-S600 WeakPolarHBondContact OD2-CB 3.39Å; D597-S600 PolarHBondContact OD2-OG 2.89Å; S600-F603 PolarHBondContact O-N 2.97Å; S600-H604 PolarHBondContact O-CD2 2.97Å; S600-H604 PolarHBondContact O-N 3.41Å
601	A	96.3	Very high	92.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-47.8	176.9	0	0	0	0	0	112.2	H584 W596 D597 Q598 H604 L605 L632	H584-A601 HydrophobicContact CB-CB 3.86Å; W596-A601 HydrophobicContact CE3-CB 4.32Å; W596-A601 HydrophobicContact CZ3-CB 3.66Å; D597-A601 WeakPolarHBondContact O-CB 3.47Å; D597-A601 PolarHBondContact O-N 3.37Å; Q598-A601 PolarHBondContact O-N 3.45Å; A601-H604 PolarHBondContact O-N 2.88Å; A601-L605 WeakPolarHBondContact O-CB 3.27Å; A601-L605 PolarHBondContact O-N 2.88Å; A601-L632 HydrophobicContact CB-CD1 3.9Å; A601-L632 HydrophobicContact CB-CD2 3.81Å
602	M	95.4	Very high	93.2	Very high	26 Å²	26	52.4 Å²	52.4	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-39.9	176.6	-78.4	-64.3	-71.6	0	0	112.6	Q598 H604 L605 E606 L620 L632 M635 V637	Q598-M602 PolarHBondContact O-N 3.33Å; M602-H604 VanDerWaalsContact C-N 3.34Å; M602-H604 PolarHBondContact O-N 2.85Å; M602-L605 PolarHBondContact O-N 3.46Å; M602-L605 HydrophobicContact SD-CD2 4.09Å; M602-E606 PolarHBondContact O-N 3.02Å; M602-L620 HydrophobicContact CE-CD2 3.79Å; M602-L620 HydrophobicContact SD-CD2 4.42Å; M602-L632 HydrophobicContact CG-CD1 4.27Å; M602-L632 HydrophobicContact SD-CD1 3.83Å; M602-M635 HydrophobicContact CB-CE 4.44Å; M602-M635 HydrophobicContact CG-CE 3.26Å; M602-M635 HydrophobicContact CG-SD 3.65Å; M602-M635 HydrophobicContact SD-CE 4.26Å; M602-M635 HydrophobicContact SD-SD 4.29Å; M602-V637 HydrophobicContact CE-CG2 4.06Å
603	F	97.1	Very high	93.8	Very high	44 Å²	44	45.1 Å²	45.1	19%	0.193	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-49.5	172.8	174.3	-87.4	0	0	0	111.1	D347 L348 D599 S600 L605 E606 R607	D347-F603 HydrophobicContact CB-CE1 4.21Å; D347-F603 HydrophobicContact CB-CZ 4.12Å; L348-F603 VanDerWaalsContact O-CZ 3.23Å; L348-F603 WeakPolarHBondContact O-CZ 3.48Å; D599-F603 WeakPolarHBondContact O-CB 3.45Å; D599-F603 PolarHBondContact O-N 3.35Å; S600-F603 PolarHBondContact O-N 2.97Å; F603-L605 VanDerWaalsContact C-N 3.33Å; F603-L605 PolarHBondContact O-N 2.62Å; F603-E606 PolarHBondContact O-N 3.02Å; F603-R607 HydrophobicContact CD1-CG 4.13Å; F603-R607 HydrophobicContact CE1-CG 3.76Å; F603-R607 VanDerWaalsContact CE2-CZ 3.46Å; F603-R607 VanDerWaalsContact CE2-NH2 3.35Å; F603-R607 HydrophobicContact CZ-CG 4.14Å; F603-R607 WeakPolarHBondContact O-CG 3.44Å; F603-R607 PolarHBondContact O-N 3.16Å
604	H	98.1	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-32.2	178.2	-80.4	-69.6	0	0	0	112.8	F346 D347 E352 H577 M580 V581 S600 A601 M602 R607 A608	F346-H604 AromaticContact CD1-CE1 3.81Å; F346-H604 AromaticContact CE1-CE1 2.89Å; F346-H604 WeakPolarHBondContact CE1-CE1 3.3Å; F346-H604 AromaticContact CZ-CE1 3.46Å; F346-H604 VanDerWaalsContact CZ-CE1 3.46Å; F346-H604 WeakPolarHBondContact CZ-CE1 3.14Å; D347-H604 PolarHBondContact O-CE1 3.27Å; E352-H604 IonicContact OE1-CD2 2.78Å; E352-H604 IonicContact OE1-NE2 2.71Å; E352-H604 PolarHBondContact OE1-NE2 2.9Å; E352-H604 IonicContact OE2-CD2 2.81Å; E352-H604 IonicContact OE2-CE1 3.8Å; E352-H604 CovalentContact OE2-NE2 1.82Å; E352-H604 IonicContact OE2-NE2 2.68Å; E352-H604 PolarHBondContact OE2-NE2 3.37Å; H577-H604 AromaticContact CE1-CE1 3.59Å; H577-H604 AromaticContact CE1-ND1 3.8Å; H577-H604 AromaticContact CG-ND1 3.89Å; H577-H604 AromaticContact ND1-CE1 3.42Å; H577-H604 PolarHBondContact ND1-CE1 3.33Å; H577-H604 AromaticContact ND1-ND1 2.89Å; H577-H604 PolarHBondContact ND1-ND1 3.07Å; M580-H604 HydrophobicContact CB-CB 3.99Å; M580-H604 WeakPolarHBondContact CE-NE2 3.48Å; V581-H604 HydrophobicContact CG2-CB 3.72Å; S600-H604 PolarHBondContact O-CD2 2.97Å; S600-H604 PolarHBondContact O-N 3.41Å; A601-H604 PolarHBondContact O-N 2.88Å; M602-H604 VanDerWaalsContact C-N 3.34Å; M602-H604 PolarHBondContact O-N 2.85Å; H604-R607 PolarHBondContact O-N 2.78Å; H604-A608 WeakPolarHBondContact O-CB 3.39Å; H604-A608 PolarHBondContact O-N 3.37Å
605	L	97.6	Very high	94.6	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-43.2	175.2	-167.8	65.6	0	0	0	111.6	L578 V581 A601 M602 F603 A608 A609 A616 A619 L620 I631 L632	L578-L605 HydrophobicContact CD1-CD1 4.43Å; V581-L605 HydrophobicContact CG1-CD1 4.36Å; V581-L605 HydrophobicContact CG2-CB 3.88Å; V581-L605 HydrophobicContact CG2-CD1 4.16Å; V581-L605 VanDerWaalsContact CG2-N 3.33Å; A601-L605 WeakPolarHBondContact O-CB 3.27Å; A601-L605 PolarHBondContact O-N 2.88Å; M602-L605 PolarHBondContact O-N 3.46Å; M602-L605 HydrophobicContact SD-CD2 4.09Å; F603-L605 VanDerWaalsContact C-N 3.33Å; F603-L605 PolarHBondContact O-N 2.62Å; L605-A608 PolarHBondContact O-N 2.77Å; L605-A609 WeakPolarHBondContact O-CB 3.33Å; L605-A609 PolarHBondContact O-N 3.05Å; L605-A616 HydrophobicContact CD1-CB 3.74Å; L605-A619 HydrophobicContact CD1-CB 4.25Å; L605-A619 HydrophobicContact CD2-CB 4.15Å; L605-L620 HydrophobicContact CB-CD2 4.41Å; L605-L620 HydrophobicContact CD2-CD2 3.61Å; L605-L620 HydrophobicContact CD2-CG 3.92Å; L605-L620 HydrophobicContact CG-CD1 4.48Å; L605-L620 HydrophobicContact CG-CD2 3.88Å; L605-L620 HydrophobicContact CG-CG 3.88Å; L605-I631 HydrophobicContact CD1-CG2 3.91Å; L605-I631 HydrophobicContact CD2-CG2 4.31Å; L605-L632 HydrophobicContact CB-CD1 4.5Å; L605-L632 HydrophobicContact CD2-CD1 3.92Å
606	E	96.3	Very high	95	Very high	56 Å²	56	33.8 Å²	33.8	26%	0.262	16%	0.163	S	C	.	.	H	α-helix	trans	-59.4	-44.4	170.4	-72.2	-168.7	163	0	0	111.8	M602 F603 A608 A609 L610 L620 Y624	M602-E606 PolarHBondContact O-N 3.02Å; F603-E606 PolarHBondContact O-N 3.02Å; E606-A608 PolarHBondContact O-N 3.31Å; E606-A609 PolarHBondContact O-N 3.48Å; E606-L610 WeakPolarHBondContact O-CB 3.18Å; E606-L610 VanDerWaalsContact O-CG 3.27Å; E606-L610 WeakPolarHBondContact O-CG 3.48Å; E606-L610 PolarHBondContact O-N 3.2Å; E606-L620 HydrophobicContact CG-CD1 4.37Å; E606-Y624 PolarHBondContact OE1-OH 3.49Å
607	R	97.4	Very high	95.2	Very high	58 Å²	58	31.4 Å²	31.4	22%	0.219	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-41.6	176.7	-68.2	-49.2	124.9	145.5	-1.8	112.4	D347 V553 H577 F603 H604 C611	D347-R607 HydrophobicContact CB-CG 4.16Å; D347-R607 IonicContact OD1-CZ 2.72Å; D347-R607 IonicContact OD1-NE 3.38Å; D347-R607 IonicContact OD1-NH1 3.9Å; D347-R607 PolarHBondContact OD1-NH1 3.12Å; V553-R607 HydrophobicContact CG2-CB 3.9Å; V553-R607 HydrophobicContact CG2-CG 4.06Å; H577-R607 HydrophobicContact CB-CB 4Å; F603-R607 HydrophobicContact CD1-CG 4.13Å; F603-R607 HydrophobicContact CE1-CG 3.76Å; F603-R607 VanDerWaalsContact CE2-CZ 3.46Å; F603-R607 VanDerWaalsContact CE2-NH2 3.35Å; F603-R607 HydrophobicContact CZ-CG 4.14Å; F603-R607 WeakPolarHBondContact O-CG 3.44Å; F603-R607 PolarHBondContact O-N 3.16Å; H604-R607 PolarHBondContact O-N 2.78Å; R607-C611 WeakPolarHBondContact O-CB 3.5Å; R607-C611 PolarHBondContact O-N 3.47Å; R607-C611 PolarHBondContact O-SG 2.73Å; R607-C611 VanDerWaalsContact O-SG 3.36Å
608	A	97.3	Very high	95.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-43.3	177.8	0	0	0	0	0	112.3	H577 L578 H604 L605 E606 C611 G612 E613 A616	H577-A608 HydrophobicContact CB-CB 3.96Å; L578-A608 HydrophobicContact CB-CB 4.05Å; H604-A608 WeakPolarHBondContact O-CB 3.39Å; H604-A608 PolarHBondContact O-N 3.37Å; L605-A608 PolarHBondContact O-N 2.77Å; E606-A608 PolarHBondContact O-N 3.31Å; A608-C611 CarbonylContact O-C 3.52Å; A608-C611 WeakPolarHBondContact O-CB 3.07Å; A608-C611 PolarHBondContact O-N 3.5Å; A608-G612 PolarHBondContact O-N 2.89Å; A608-E613 PolarHBondContact O-N 3.16Å; A608-A616 HydrophobicContact CB-CB 3.61Å
609	A	95.8	Very high	95.5	Very high	2 Å²	2	27 Å²	27	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-38.7	178.1	0	0	0	0	0	112.7	L605 E606 C611 G612 A616 I617 L620 Y650	L605-A609 WeakPolarHBondContact O-CB 3.33Å; L605-A609 PolarHBondContact O-N 3.05Å; E606-A609 PolarHBondContact O-N 3.48Å; A609-C611 VanDerWaalsContact C-N 3.31Å; A609-C611 PolarHBondContact O-N 3.5Å; A609-G612 WeakPolarHBondContact O-CA 3.38Å; A609-G612 PolarHBondContact O-N 3.47Å; A609-A616 HydrophobicContact CB-CB 3.96Å; A609-I617 HydrophobicContact CB-CG1 3.95Å; A609-L620 HydrophobicContact CB-CD1 3.45Å; A609-L620 VanDerWaalsContact CB-CD1 3.45Å; A609-Y650 HydrophobicContact CB-CE1 4.26Å
610	L	94.4	Very high	95.5	Very high	86 Å²	86	21 Å²	21	45%	0.45	10%	0.102	S	C	.	.	H	α-helix	trans	-61.5	-39.5	171.3	-74.6	171.5	0	0	0	111.8	V553 V557 E606 G612	V553-L610 HydrophobicContact CG1-CB 4.08Å; V557-L610 HydrophobicContact CG2-CB 3.99Å; V557-L610 WeakPolarHBondContact CG2-O 3.44Å; E606-L610 WeakPolarHBondContact O-CB 3.18Å; E606-L610 VanDerWaalsContact O-CG 3.27Å; E606-L610 WeakPolarHBondContact O-CG 3.48Å; E606-L610 PolarHBondContact O-N 3.2Å; L610-G612 PolarHBondContact O-N 3.09Å
611	C	94.1	Very high	95.5	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.2	171.1	-78.3	0	0	0	0	114.4	L560 S571 R607 A608 A609	L560-C611 WeakPolarHBondContact CD1-O 3.4Å; S571-C611 WeakPolarHBondContact CB-O 3.29Å; S571-C611 WeakPolarHBondContact OG-CB 3.39Å; R607-C611 WeakPolarHBondContact O-CB 3.5Å; R607-C611 PolarHBondContact O-N 3.47Å; R607-C611 PolarHBondContact O-SG 2.73Å; R607-C611 VanDerWaalsContact O-SG 3.36Å; A608-C611 CarbonylContact O-C 3.52Å; A608-C611 WeakPolarHBondContact O-CB 3.07Å; A608-C611 PolarHBondContact O-N 3.5Å; A609-C611 VanDerWaalsContact C-N 3.31Å; A609-C611 PolarHBondContact O-N 3.5Å
612	G	93	Very high	95.3	Very high	4 Å²	4	22.6 Å²	22.6	4%	0.041	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	17.8	176.1	0	0	0	0	0	115.3	I568 G569 A608 A609 L610 L614	I568-G612 CarbonylContact C-O 3.59Å; I568-G612 WeakPolarHBondContact CA-O 3.42Å; I568-G612 VanDerWaalsContact CG2-O 3.31Å; I568-G612 WeakPolarHBondContact CG2-O 3.46Å; G569-G612 PolarHBondContact N-O 2.84Å; A608-G612 PolarHBondContact O-N 2.89Å; A609-G612 WeakPolarHBondContact O-CA 3.38Å; A609-G612 PolarHBondContact O-N 3.47Å; L610-G612 PolarHBondContact O-N 3.09Å; G612-L614 PolarHBondContact O-N 2.73Å
613	E	94.9	Very high	95.2	Very high	16 Å²	16	21.5 Å²	21.5	8%	0.075	10%	0.104	C	C	.	.			trans	-76.2	122.3	175.9	-63.8	-52.8	118.6	0	0	111.4	S571 K575 A608 E615 A616 I617	S571-E613 PolarHBondContact N-OE1 3.17Å; S571-E613 VanDerWaalsContact O-OE1 3.13Å; K575-E613 HydrophobicContact CG-CG 4.41Å; K575-E613 VanDerWaalsContact CG-OE2 3.3Å; K575-E613 WeakPolarHBondContact CG-OE2 3.48Å; A608-E613 PolarHBondContact O-N 3.16Å; E613-E615 PolarHBondContact O-N 3.17Å; E613-A616 HydrophobicContact CB-CB 4.36Å; E613-A616 PolarHBondContact O-N 3.28Å; E613-A616 VanDerWaalsContact O-N 3.16Å; E613-I617 WeakPolarHBondContact O-CG1 3.38Å; E613-I617 PolarHBondContact O-N 3.28Å; E613-I617 VanDerWaalsContact O-N 3.07Å
614	L	93.1	Very high	95	Very high	52 Å²	52	19.9 Å²	19.9	27%	0.272	10%	0.096	S	C	.	.	H	α-helix	trans	-62.9	-43.1	-169.5	-174.3	56.1	0	0	0	112.7	I568 G612 A616 I617 V618 A654 A657 D659	I568-L614 HydrophobicContact CG2-CB 3.8Å; I568-L614 HydrophobicContact CG2-CD1 4.24Å; I568-L614 HydrophobicContact CG2-CG 4.45Å; G612-L614 PolarHBondContact O-N 2.73Å; L614-A616 VanDerWaalsContact C-N 3.27Å; L614-A616 PolarHBondContact O-N 3.28Å; L614-I617 PolarHBondContact O-N 3.11Å; L614-V618 HydrophobicContact CD1-CG2 4.13Å; L614-V618 HydrophobicContact CG-CG2 4.38Å; L614-V618 WeakPolarHBondContact O-CG2 3.23Å; L614-V618 PolarHBondContact O-N 3.46Å; L614-A654 HydrophobicContact CD1-CB 3.81Å; L614-A657 HydrophobicContact CD1-CB 3.73Å; L614-A657 HydrophobicContact CD2-CB 4.48Å; L614-D659 HydrophobicContact CD1-CB 4.26Å; L614-D659 HydrophobicContact CD2-CB 4.37Å
615	E	94.2	Very high	94.6	Very high	78 Å²	78	21.3 Å²	21.3	36%	0.364	10%	0.104	S	C	.	.	H	α-helix	trans	-54.9	-43.5	175.6	-64.1	-174.5	-138.4	0	0	112	L578 R582 E613 V618 A619 I631	L578-E615 HydrophobicContact CD2-CB 3.96Å; L578-E615 HydrophobicContact CD2-CG 4.36Å; R582-E615 IonicContact CZ-OE2 2.73Å; R582-E615 IonicContact NH2-OE1 3.2Å; R582-E615 PolarHBondContact NH2-OE1 3.2Å; R582-E615 IonicContact NH2-OE2 3.16Å; R582-E615 PolarHBondContact NH2-OE2 3.39Å; E613-E615 PolarHBondContact O-N 3.17Å; E615-V618 PolarHBondContact O-N 3.39Å; E615-A619 VanDerWaalsContact O-CB 3.26Å; E615-A619 WeakPolarHBondContact O-CB 3.41Å; E615-A619 PolarHBondContact O-N 3.24Å; E615-I631 HydrophobicContact CB-CD1 4.03Å
616	A	96	Very high	94.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-70.1	-38.6	-179.4	0	0	0	0	0	112.3	L578 L605 A608 A609 E613 L614 L620	L578-A616 HydrophobicContact CD1-CB 4.48Å; L605-A616 HydrophobicContact CD1-CB 3.74Å; A608-A616 HydrophobicContact CB-CB 3.61Å; A609-A616 HydrophobicContact CB-CB 3.96Å; E613-A616 HydrophobicContact CB-CB 4.36Å; E613-A616 PolarHBondContact O-N 3.28Å; E613-A616 VanDerWaalsContact O-N 3.16Å; L614-A616 VanDerWaalsContact C-N 3.27Å; L614-A616 PolarHBondContact O-N 3.28Å; A616-L620 WeakPolarHBondContact O-CG 3.12Å; A616-L620 PolarHBondContact O-N 3.19Å
617	I	95.6	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-48.5	173.8	-65.8	161.2	0	0	0	110.2	I568 A609 E613 L614 G621 Y650 Q653 A654	I568-I617 HydrophobicContact CD1-CD1 3.97Å; I568-I617 HydrophobicContact CG1-CD1 4.03Å; A609-I617 HydrophobicContact CB-CG1 3.95Å; E613-I617 WeakPolarHBondContact O-CG1 3.38Å; E613-I617 PolarHBondContact O-N 3.28Å; E613-I617 VanDerWaalsContact O-N 3.07Å; L614-I617 PolarHBondContact O-N 3.11Å; I617-G621 PolarHBondContact O-N 2.8Å; I617-Y650 HydrophobicContact CG2-CD1 4.19Å; I617-Y650 WeakPolarHBondContact CG2-O 3.32Å; I617-Q653 HydrophobicContact CD1-CG 4.44Å; I617-Q653 VanDerWaalsContact CD1-NE2 3.29Å; I617-Q653 HydrophobicContact CG2-CB 4.35Å; I617-Q653 HydrophobicContact CG2-CG 4.34Å; I617-A654 HydrophobicContact CG2-CB 3.96Å
618	V	94.4	Very high	93.5	Very high	13 Å²	13	29.1 Å²	29.1	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-65.3	-42.1	179.4	175.6	0	0	0	0	111.3	L614 E615 G621 K622 A654 D659	L614-V618 HydrophobicContact CD1-CG2 4.13Å; L614-V618 HydrophobicContact CG-CG2 4.38Å; L614-V618 WeakPolarHBondContact O-CG2 3.23Å; L614-V618 PolarHBondContact O-N 3.46Å; E615-V618 PolarHBondContact O-N 3.39Å; V618-G621 PolarHBondContact O-N 2.86Å; V618-K622 HydrophobicContact CG1-CD 4.04Å; V618-K622 HydrophobicContact CG1-CG 4.48Å; V618-K622 WeakPolarHBondContact O-CB 3.48Å; V618-K622 WeakPolarHBondContact O-CG 3.34Å; V618-K622 PolarHBondContact O-N 2.94Å; V618-A654 HydrophobicContact CG2-CB 3.64Å; V618-D659 HydrophobicContact CG2-CB 4.24Å
619	A	95.2	Very high	93.1	Very high	3 Å²	3	31 Å²	31	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-51.3	178	0	0	0	0	0	112.2	L605 E615 G621 K622 C623 I631	L605-A619 HydrophobicContact CD1-CB 4.25Å; L605-A619 HydrophobicContact CD2-CB 4.15Å; E615-A619 VanDerWaalsContact O-CB 3.26Å; E615-A619 WeakPolarHBondContact O-CB 3.41Å; E615-A619 PolarHBondContact O-N 3.24Å; A619-G621 VanDerWaalsContact C-N 3.32Å; A619-G621 PolarHBondContact O-N 2.94Å; A619-K622 PolarHBondContact O-N 3.38Å; A619-C623 VanDerWaalsContact O-CB 3.26Å; A619-C623 WeakPolarHBondContact O-CB 3.41Å; A619-C623 PolarHBondContact O-N 2.92Å; A619-I631 HydrophobicContact CB-CB 3.95Å; A619-I631 HydrophobicContact CB-CD1 4.23Å; A619-I631 HydrophobicContact CB-CG2 4.11Å
620	L	94.9	Very high	92.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-42	174.8	-70.3	174.2	0	0	0	111.7	M602 L605 E606 A609 A616 K622 C623 Y624 Y650	M602-L620 HydrophobicContact CE-CD2 3.79Å; M602-L620 HydrophobicContact SD-CD2 4.42Å; L605-L620 HydrophobicContact CB-CD2 4.41Å; L605-L620 HydrophobicContact CD2-CD2 3.61Å; L605-L620 HydrophobicContact CD2-CG 3.92Å; L605-L620 HydrophobicContact CG-CD1 4.48Å; L605-L620 HydrophobicContact CG-CD2 3.88Å; L605-L620 HydrophobicContact CG-CG 3.88Å; E606-L620 HydrophobicContact CG-CD1 4.37Å; A609-L620 HydrophobicContact CB-CD1 3.45Å; A609-L620 VanDerWaalsContact CB-CD1 3.45Å; A616-L620 WeakPolarHBondContact O-CG 3.12Å; A616-L620 PolarHBondContact O-N 3.19Å; L620-K622 VanDerWaalsContact C-N 3.33Å; L620-K622 PolarHBondContact O-N 3.23Å; L620-C623 PolarHBondContact O-N 3.03Å; L620-Y624 HydrophobicContact CB-CD2 4.19Å; L620-Y624 HydrophobicContact CB-CE2 4.17Å; L620-Y624 HydrophobicContact CD2-CE2 4.16Å; L620-Y624 WeakPolarHBondContact O-CB 3.34Å; L620-Y624 WeakPolarHBondContact O-CD2 3.39Å; L620-Y624 PolarHBondContact O-N 3.49Å; L620-Y650 HydrophobicContact CB-CD2 4Å; L620-Y650 HydrophobicContact CB-CE2 4.17Å; L620-Y650 HydrophobicContact CB-CG 4.37Å; L620-Y650 HydrophobicContact CD1-CE1 4.35Å; L620-Y650 HydrophobicContact CD1-CE2 4.15Å
621	G	94.1	Very high	92.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-44.5	178.6	0	0	0	0	0	112.9	I617 V618 A619 L625 G647	I617-G621 PolarHBondContact O-N 2.8Å; V618-G621 PolarHBondContact O-N 2.86Å; A619-G621 VanDerWaalsContact C-N 3.32Å; A619-G621 PolarHBondContact O-N 2.94Å; G621-L625 WeakPolarHBondContact O-CG 3.44Å; G621-L625 PolarHBondContact O-N 2.97Å; G621-G647 WeakPolarHBondContact CA-O 3.41Å
622	K	92.9	Very high	92.5	Very high	33 Å²	33	33.4 Å²	33.4	14%	0.143	17%	0.172	C	C	.	.	H	α-helix	trans	-73.1	-44.8	177.4	-69.9	-177	-180	-174.8	0	112.1	V618 A619 L620 L625 Q626 L627 P628 H629 L651 S661	V618-K622 HydrophobicContact CG1-CD 4.04Å; V618-K622 HydrophobicContact CG1-CG 4.48Å; V618-K622 WeakPolarHBondContact O-CB 3.48Å; V618-K622 WeakPolarHBondContact O-CG 3.34Å; V618-K622 PolarHBondContact O-N 2.94Å; A619-K622 PolarHBondContact O-N 3.38Å; L620-K622 VanDerWaalsContact C-N 3.33Å; L620-K622 PolarHBondContact O-N 3.23Å; K622-L625 CarbonylContact O-C 3.59Å; K622-L625 PolarHBondContact O-N 2.99Å; K622-L625 VanDerWaalsContact O-N 3.09Å; K622-Q626 PolarHBondContact O-N 3.45Å; K622-L627 HydrophobicContact CB-CB 4.01Å; K622-L627 HydrophobicContact CG-CB 4.23Å; K622-L627 PolarHBondContact O-N 3.33Å; K622-P628 WeakPolarHBondContact CD-O 3.43Å; K622-H629 HydrophobicContact CB-CB 4.1Å; K622-L651 HydrophobicContact CG-CD1 4.45Å; K622-L651 HydrophobicContact CG-CD2 4.13Å; K622-S661 PolarHBondContact NZ-OG 2.87Å
623	C	93	Very high	92.4	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-50.8	178.5	-177.7	0	0	0	0	112.6	A619 L620 L625 Q626 H629 V637	A619-C623 VanDerWaalsContact O-CB 3.26Å; A619-C623 WeakPolarHBondContact O-CB 3.41Å; A619-C623 PolarHBondContact O-N 2.92Å; L620-C623 PolarHBondContact O-N 3.03Å; C623-L625 PolarHBondContact O-N 3.34Å; C623-L625 VanDerWaalsContact O-N 3.13Å; C623-Q626 PolarHBondContact O-N 2.91Å; C623-Q626 PolarHBondContact O-NE2 3.46Å; C623-H629 VanDerWaalsContact CA-CD2 3.47Å; C623-H629 WeakPolarHBondContact CA-CD2 3.27Å; C623-H629 WeakPolarHBondContact CA-NE2 3.35Å; C623-H629 WeakPolarHBondContact CB-NE2 3.32Å; C623-H629 PolarHBondContact N-CD2 3.35Å; C623-V637 VanDerWaalsContact SG-CG2 3.53Å
624	Y	92.3	Very high	92	Very high	9 Å²	9	41.9 Å²	41.9	4%	0.035	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-13.5	176.7	-75.3	-52.1	0	0	0	114.6	E606 L620 V637 N643 R646 Y650	E606-Y624 PolarHBondContact OE1-OH 3.49Å; L620-Y624 HydrophobicContact CB-CD2 4.19Å; L620-Y624 HydrophobicContact CB-CE2 4.17Å; L620-Y624 HydrophobicContact CD2-CE2 4.16Å; L620-Y624 WeakPolarHBondContact O-CB 3.34Å; L620-Y624 WeakPolarHBondContact O-CD2 3.39Å; L620-Y624 PolarHBondContact O-N 3.49Å; Y624-V637 HydrophobicContact CD1-CG1 3.8Å; Y624-V637 HydrophobicContact CE1-CG1 3.91Å; Y624-N643 WeakPolarHBondContact CB-O 3.45Å; Y624-N643 HydrophobicContact CD1-CB 3.82Å; Y624-N643 HydrophobicContact CE1-CB 4.47Å; Y624-R646 HydrophobicContact CD2-CB 4.09Å; Y624-R646 HydrophobicContact CE2-CB 4.26Å; Y624-R646 HydrophobicContact CG-CB 4.41Å; Y624-Y650 HydrophobicContact CD2-CD2 4.02Å; Y624-Y650 HydrophobicContact CD2-CE2 4.1Å; Y624-Y650 HydrophobicContact CE2-CD2 4.13Å; Y624-Y650 AromaticContact CE2-CE2 3.72Å; Y624-Y650 HydrophobicContact CE2-CE2 3.72Å
625	L	90.3	Very high	91.7	Very high	30 Å²	30	40.3 Å²	40.3	16%	0.157	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	5.1	173.2	-72.8	173	0	0	0	113.3	G621 K622 C623 L627 R644 L651	G621-L625 WeakPolarHBondContact O-CG 3.44Å; G621-L625 PolarHBondContact O-N 2.97Å; K622-L625 CarbonylContact O-C 3.59Å; K622-L625 PolarHBondContact O-N 2.99Å; K622-L625 VanDerWaalsContact O-N 3.09Å; C623-L625 PolarHBondContact O-N 3.34Å; C623-L625 VanDerWaalsContact O-N 3.13Å; L625-L627 HydrophobicContact CB-CD1 3.92Å; L625-L627 HydrophobicContact CB-CG 3.85Å; L625-L627 HydrophobicContact CD1-CD1 4.18Å; L625-L627 PolarHBondContact O-N 3.38Å; L625-R644 HydrophobicContact CD2-CB 4.08Å; L625-R644 HydrophobicContact CD2-CG 4.36Å; L625-L651 HydrophobicContact CD1-CD1 3.64Å; L625-L651 HydrophobicContact CD1-CG 4.33Å
626	Q	89.9	Confident	91.1	Very high	99 Å²	99	45.4 Å²	45.4	46%	0.463	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	30.9	-177.5	-44.2	-72.9	-88.6	0	0	113	K622 C623 V637 D639	K622-Q626 PolarHBondContact O-N 3.45Å; C623-Q626 PolarHBondContact O-N 2.91Å; C623-Q626 PolarHBondContact O-NE2 3.46Å; Q626-V637 PolarHBondContact NE2-O 2.58Å; Q626-V637 PolarHBondContact OE1-O 3.11Å; Q626-D639 HydrophobicContact CG-CB 4.11Å
627	L	88.9	Confident	90.7	Very high	59 Å²	59	46.6 Å²	46.6	31%	0.309	24%	0.244	S	C	.	.			trans	-95.7	147.7	177.9	-59.8	176	0	0	0	110.5	K622 L625 H629 L651 I665	K622-L627 HydrophobicContact CB-CB 4.01Å; K622-L627 HydrophobicContact CG-CB 4.23Å; K622-L627 PolarHBondContact O-N 3.33Å; L625-L627 HydrophobicContact CB-CD1 3.92Å; L625-L627 HydrophobicContact CB-CG 3.85Å; L625-L627 HydrophobicContact CD1-CD1 4.18Å; L625-L627 PolarHBondContact O-N 3.38Å; L627-H629 PolarHBondContact O-CD2 2.8Å; L627-H629 PolarHBondContact O-N 3.19Å; L627-L651 HydrophobicContact CD1-CD1 4.23Å; L627-I665 HydrophobicContact CD1-CD1 4.12Å; L627-I665 HydrophobicContact CD1-CG2 3.78Å
628	P	88.6	Confident	90.4	Very high	123 Å²	123	53.4 Å²	53.4	80%	0.799	28%	0.276	S	S	*	.			trans	-55.2	127.4	179.3	-27	35.4	0	0	0	113.9	K622	K622-P628 WeakPolarHBondContact CD-O 3.43Å
629	H	88.9	Confident	90.1	Very high	39 Å²	39	56.7 Å²	56.7	18%	0.181	29%	0.293	C	S	.	.			trans	-129.7	159	175.1	46.4	87	0	0	0	111.7	K622 C623 L627 I631 L632	K622-H629 HydrophobicContact CB-CB 4.1Å; C623-H629 VanDerWaalsContact CA-CD2 3.47Å; C623-H629 WeakPolarHBondContact CA-CD2 3.27Å; C623-H629 WeakPolarHBondContact CA-NE2 3.35Å; C623-H629 WeakPolarHBondContact CB-NE2 3.32Å; C623-H629 PolarHBondContact N-CD2 3.35Å; L627-H629 PolarHBondContact O-CD2 2.8Å; L627-H629 PolarHBondContact O-N 3.19Å; H629-I631 PolarHBondContact ND1-O 3.07Å; H629-L632 PolarHBondContact CE1-O 3.29Å
630	H	89.6	Confident	89.8	Confident	132 Å²	132	59.1 Å²	59.1	61%	0.611	31%	0.305	S	S	*	.	S	Bend	trans	-106.8	-9	-175.7	64.8	-92.6	0	0	0	113.7
631	I	91.8	Very high	89.4	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.026	33%	0.332	C	S	.	.	S	Bend	trans	-104.8	131.6	170.1	-74.7	159.4	0	0	0	106.3	L578 V581 L605 E615 A619 H629	L578-I631 HydrophobicContact CD1-CD1 4.21Å; V581-I631 HydrophobicContact CG1-CG2 3.96Å; L605-I631 HydrophobicContact CD1-CG2 3.91Å; L605-I631 HydrophobicContact CD2-CG2 4.31Å; E615-I631 HydrophobicContact CB-CD1 4.03Å; A619-I631 HydrophobicContact CB-CB 3.95Å; A619-I631 HydrophobicContact CB-CD1 4.23Å; A619-I631 HydrophobicContact CB-CG2 4.11Å; H629-I631 PolarHBondContact ND1-O 3.07Å
632	L	91.9	Very high	89.1	Confident	2 Å²	2	64 Å²	64	1%	0.01	35%	0.35	C	S	.	.	S	Bend	trans	50	49.7	-175.8	-51.4	-179.4	0	0	0	113.4	V581 E585 W596 A601 M602 L605 H629 D634 M635	V581-L632 HydrophobicContact CG1-CD1 3.86Å; V581-L632 HydrophobicContact CG1-CD2 3.69Å; V581-L632 HydrophobicContact CG1-CG 3.79Å; E585-L632 HydrophobicContact CB-CD2 3.87Å; E585-L632 HydrophobicContact CG-CD2 4.19Å; E585-L632 WeakPolarHBondContact OE1-CA 3.47Å; E585-L632 PolarHBondContact OE1-N 3.02Å; W596-L632 HydrophobicContact CH2-CD2 3.7Å; W596-L632 HydrophobicContact CZ3-CD2 3.82Å; A601-L632 HydrophobicContact CB-CD1 3.9Å; A601-L632 HydrophobicContact CB-CD2 3.81Å; M602-L632 HydrophobicContact CG-CD1 4.27Å; M602-L632 HydrophobicContact SD-CD1 3.83Å; L605-L632 HydrophobicContact CB-CD1 4.5Å; L605-L632 HydrophobicContact CD2-CD1 3.92Å; H629-L632 PolarHBondContact CE1-O 3.29Å; L632-D634 PolarHBondContact O-N 3.47Å; L632-M635 HydrophobicContact CB-CB 4.18Å; L632-M635 HydrophobicContact CB-CG 3.96Å; L632-M635 HydrophobicContact CB-SD 4.07Å; L632-M635 HydrophobicContact CD1-SD 3.79Å; L632-M635 HydrophobicContact CG-SD 4.33Å; L632-M635 WeakPolarHBondContact O-CB 3.27Å; L632-M635 PolarHBondContact O-N 3.06Å; L632-M635 VanDerWaalsContact O-N 3.11Å
633	P	90.7	Very high	88.9	Confident	74 Å²	74	63.4 Å²	63.4	48%	0.481	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.2	-172.5	28.1	-36.6	0	0	0	114	E585 M635	E585-P633 WeakPolarHBondContact OE1-CD 3.43Å; P633-M635 VanDerWaalsContact C-N 3.28Å; P633-M635 PolarHBondContact O-N 2.98Å
634	D	86.8	Confident	88.7	Confident	125 Å²	125	67.7 Å²	67.7	67%	0.668	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	7.9	179	-57.1	-42.9	0	0	0	113.5	L632	L632-D634 PolarHBondContact O-N 3.47Å
635	M	85.2	Confident	88.4	Confident	18 Å²	18	71 Å²	71	9%	0.089	38%	0.38	C	S	.	.			trans	-100	113	-176.8	-72.4	-155.7	62.3	0	0	113.7	W596 Q598 M602 L632 P633	W596-M635 HydrophobicContact CH2-CG 3.77Å; W596-M635 HydrophobicContact CH2-SD 3.86Å; W596-M635 HydrophobicContact CZ2-CG 4.48Å; W596-M635 HydrophobicContact CZ3-SD 4.14Å; Q598-M635 HydrophobicContact CB-CE 3.65Å; Q598-M635 HydrophobicContact CB-SD 3.83Å; Q598-M635 HydrophobicContact CG-CE 4.36Å; Q598-M635 HydrophobicContact CG-CG 4.37Å; Q598-M635 HydrophobicContact CG-SD 4.14Å; M602-M635 HydrophobicContact CB-CE 4.44Å; M602-M635 HydrophobicContact CG-CE 3.26Å; M602-M635 HydrophobicContact CG-SD 3.65Å; M602-M635 HydrophobicContact SD-CE 4.26Å; M602-M635 HydrophobicContact SD-SD 4.29Å; L632-M635 HydrophobicContact CB-CB 4.18Å; L632-M635 HydrophobicContact CB-CG 3.96Å; L632-M635 HydrophobicContact CB-SD 4.07Å; L632-M635 HydrophobicContact CD1-SD 3.79Å; L632-M635 HydrophobicContact CG-SD 4.33Å; L632-M635 WeakPolarHBondContact O-CB 3.27Å; L632-M635 PolarHBondContact O-N 3.06Å; L632-M635 VanDerWaalsContact O-N 3.11Å; P633-M635 VanDerWaalsContact C-N 3.28Å; P633-M635 PolarHBondContact O-N 2.98Å
636	E	82.8	Confident	88.5	Confident	185 Å²	185	75.7 Å²	75.7	86%	0.864	40%	0.396	S	S	*	.			trans	-88.4	125.5	171.8	-62.2	-175.8	171.7	0	0	110.8
637	V	87.3	Confident	88.6	Confident	26 Å²	26	71 Å²	71	16%	0.158	37%	0.374	C	S	.	.			trans	-113.4	137	171.7	174	0	0	0	0	108.9	M602 C623 Y624 Q626 D639 N643	M602-V637 HydrophobicContact CE-CG2 4.06Å; C623-V637 VanDerWaalsContact SG-CG2 3.53Å; Y624-V637 HydrophobicContact CD1-CG1 3.8Å; Y624-V637 HydrophobicContact CE1-CG1 3.91Å; Q626-V637 PolarHBondContact NE2-O 2.58Å; Q626-V637 PolarHBondContact OE1-O 3.11Å; V637-D639 PolarHBondContact O-N 3.2Å; V637-N643 WeakPolarHBondContact CG1-ND2 3.29Å
638	E	88.5	Confident	88.7	Confident	142 Å²	142	68.5 Å²	68.5	66%	0.664	36%	0.36	S	S	*	.			trans	-52.8	122.6	-176.7	-173.5	-165.2	-137.2	0	0	112.7	N640 N643	E638-N640 VanDerWaalsContact C-N 3.34Å; E638-N640 PolarHBondContact O-N 3.45Å; E638-N640 PolarHBondContact OE2-ND2 3.18Å; E638-N643 PolarHBondContact O-ND2 3.3Å
639	D	88.6	Confident	88.9	Confident	83 Å²	83	69.5 Å²	69.5	44%	0.444	35%	0.352	S	S	.	.			trans	-72.8	84.2	172.9	-179.4	39.1	0	0	0	111.8	Q626 V637 R644	Q626-D639 HydrophobicContact CG-CB 4.11Å; V637-D639 PolarHBondContact O-N 3.2Å; D639-R644 WeakPolarHBondContact OD1-CD 3.2Å; D639-R644 VanDerWaalsContact OD1-CG 3.28Å; D639-R644 WeakPolarHBondContact OD1-CG 3.37Å; D639-R644 IonicContact OD1-CZ 3.75Å; D639-R644 IonicContact OD1-NE 2.8Å; D639-R644 IonicContact OD1-NH1 3.22Å; D639-R644 PolarHBondContact OD1-NH1 3.39Å; D639-R644 IonicContact OD2-NH1 2.77Å; D639-R644 PolarHBondContact OD2-NH1 2.89Å
640	N	89.3	Confident	89.2	Confident	53 Å²	53	69.6 Å²	69.6	28%	0.283	35%	0.351	S	S	.	.			trans	-118.3	159.2	171.5	75.7	56.8	0	0	0	111.3	E638 G642 N643 R644	E638-N640 VanDerWaalsContact C-N 3.34Å; E638-N640 PolarHBondContact O-N 3.45Å; E638-N640 PolarHBondContact OE2-ND2 3.18Å; N640-G642 PolarHBondContact O-N 3.34Å; N640-G642 WeakPolarHBondContact OD1-CA 3.34Å; N640-G642 PolarHBondContact OD1-N 3.39Å; N640-N643 PolarHBondContact ND2-ND2 3.06Å; N640-N643 VanDerWaalsContact ND2-ND2 3.19Å; N640-N643 PolarHBondContact O-N 3.25Å; N640-N643 VanDerWaalsContact O-N 3.09Å; N640-N643 PolarHBondContact OD1-N 2.92Å; N640-R644 PolarHBondContact O-N 2.91Å
641	A	85.4	Confident	89.3	Confident	67 Å²	67	63.3 Å²	63.3	55%	0.554	32%	0.322	S	S	*	.	H	α-helix	trans	-62.3	-26.1	-175.8	0	0	0	0	0	114	M645	A641-M645 WeakPolarHBondContact O-CB 3.34Å; A641-M645 PolarHBondContact O-N 3.33Å; A641-M645 VanDerWaalsContact O-N 3.15Å
642	G	87.6	Confident	89.4	Confident	37 Å²	37	63.9 Å²	63.9	38%	0.381	33%	0.325	S	S	.	.	H	α-helix	trans	-72.9	-39.9	174.4	0	0	0	0	0	112.4	N640 R646	N640-G642 PolarHBondContact O-N 3.34Å; N640-G642 WeakPolarHBondContact OD1-CA 3.34Å; N640-G642 PolarHBondContact OD1-N 3.39Å; G642-R646 WeakPolarHBondContact O-CG 3.16Å; G642-R646 PolarHBondContact O-N 2.56Å; G642-R646 VanDerWaalsContact O-N 3.07Å
643	N	89.6	Confident	89.4	Confident	19 Å²	19	66.7 Å²	66.7	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-49.5	173.8	-77	-11.9	0	0	0	110.8	Y624 V637 E638 N640 M645 R646 G647	Y624-N643 WeakPolarHBondContact CB-O 3.45Å; Y624-N643 HydrophobicContact CD1-CB 3.82Å; Y624-N643 HydrophobicContact CE1-CB 4.47Å; V637-N643 WeakPolarHBondContact CG1-ND2 3.29Å; E638-N643 PolarHBondContact O-ND2 3.3Å; N640-N643 PolarHBondContact ND2-ND2 3.06Å; N640-N643 VanDerWaalsContact ND2-ND2 3.19Å; N640-N643 PolarHBondContact O-N 3.25Å; N640-N643 VanDerWaalsContact O-N 3.09Å; N640-N643 PolarHBondContact OD1-N 2.92Å; N643-M645 VanDerWaalsContact C-N 3.27Å; N643-M645 PolarHBondContact O-N 3.44Å; N643-R646 CarbonylContact O-C 3.51Å; N643-R646 WeakPolarHBondContact O-CA 3.36Å; N643-R646 WeakPolarHBondContact O-CB 3.39Å; N643-R646 PolarHBondContact O-N 3.45Å; N643-G647 PolarHBondContact O-N 2.93Å
644	R	88	Confident	89.5	Confident	94 Å²	94	63.2 Å²	63.2	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-55.2	-41.6	175.3	-65.9	-166.4	-65.9	-104.1	6.9	112.9	L625 D639 N640 R646 G647 F648	L625-R644 HydrophobicContact CD2-CB 4.08Å; L625-R644 HydrophobicContact CD2-CG 4.36Å; D639-R644 WeakPolarHBondContact OD1-CD 3.2Å; D639-R644 VanDerWaalsContact OD1-CG 3.28Å; D639-R644 WeakPolarHBondContact OD1-CG 3.37Å; D639-R644 IonicContact OD1-CZ 3.75Å; D639-R644 IonicContact OD1-NE 2.8Å; D639-R644 IonicContact OD1-NH1 3.22Å; D639-R644 PolarHBondContact OD1-NH1 3.39Å; D639-R644 IonicContact OD2-NH1 2.77Å; D639-R644 PolarHBondContact OD2-NH1 2.89Å; N640-R644 PolarHBondContact O-N 2.91Å; R644-R646 PolarHBondContact O-N 2.84Å; R644-G647 PolarHBondContact O-N 3.31Å; R644-F648 PolarHBondContact O-N 3.02Å
645	M	87.8	Confident	89.7	Confident	78 Å²	78	57.3 Å²	57.3	38%	0.384	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-39.7	173.3	176.1	-176.7	-73.5	0	0	113.1	A641 N643 K649 A678	A641-M645 WeakPolarHBondContact O-CB 3.34Å; A641-M645 PolarHBondContact O-N 3.33Å; A641-M645 VanDerWaalsContact O-N 3.15Å; N643-M645 VanDerWaalsContact C-N 3.27Å; N643-M645 PolarHBondContact O-N 3.44Å; M645-K649 WeakPolarHBondContact O-CB 3.26Å; M645-K649 PolarHBondContact O-N 2.88Å; M645-A678 HydrophobicContact CE-CB 3.96Å
646	R	90.4	Very high	90	Very high	130 Å²	130	61.9 Å²	61.9	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-45.5	173.3	-69.2	170	-178	-157.2	4.2	111.4	Y624 G642 N643 R644 K649 Y650	Y624-R646 HydrophobicContact CD2-CB 4.09Å; Y624-R646 HydrophobicContact CE2-CB 4.26Å; Y624-R646 HydrophobicContact CG-CB 4.41Å; G642-R646 WeakPolarHBondContact O-CG 3.16Å; G642-R646 PolarHBondContact O-N 2.56Å; G642-R646 VanDerWaalsContact O-N 3.07Å; N643-R646 CarbonylContact O-C 3.51Å; N643-R646 WeakPolarHBondContact O-CA 3.36Å; N643-R646 WeakPolarHBondContact O-CB 3.39Å; N643-R646 PolarHBondContact O-N 3.45Å; R644-R646 PolarHBondContact O-N 2.84Å; R646-K649 WeakPolarHBondContact O-CB 3.45Å; R646-K649 PolarHBondContact O-N 2.92Å; R646-Y650 HydrophobicContact CB-CE2 4.48Å; R646-Y650 WeakPolarHBondContact O-CD2 3.39Å; R646-Y650 PolarHBondContact O-N 3.33Å
647	G	92.2	Very high	90.2	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-49.9	-178.8	0	0	0	0	0	112.3	G621 N643 R644 K649 Y650 L651	G621-G647 WeakPolarHBondContact CA-O 3.41Å; N643-G647 PolarHBondContact O-N 2.93Å; R644-G647 PolarHBondContact O-N 3.31Å; G647-K649 VanDerWaalsContact C-N 3.3Å; G647-K649 PolarHBondContact O-N 3.18Å; G647-Y650 PolarHBondContact O-N 3.19Å; G647-Y650 VanDerWaalsContact O-N 3.17Å; G647-L651 PolarHBondContact O-N 3.43Å
648	F	92.6	Very high	90.3	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-42.3	173.3	178.6	-101.2	0	0	0	112.2	R644 Y650 L651 L652 V666 A669 F670 L676	R644-F648 PolarHBondContact O-N 3.02Å; F648-Y650 PolarHBondContact O-N 2.95Å; F648-L651 PolarHBondContact O-N 3.37Å; F648-L652 HydrophobicContact CE1-CD2 4.4Å; F648-L652 WeakPolarHBondContact O-CB 3.43Å; F648-L652 PolarHBondContact O-N 1.82Å; F648-V666 HydrophobicContact CE2-CB 4.45Å; F648-V666 HydrophobicContact CE2-CG1 4.19Å; F648-V666 HydrophobicContact CE2-CG2 4.21Å; F648-V666 HydrophobicContact CZ-CG1 4.32Å; F648-A669 HydrophobicContact CD2-CB 3.98Å; F648-A669 HydrophobicContact CE2-CB 3.68Å; F648-F670 AromaticContact CZ-CE2 3.89Å; F648-F670 HydrophobicContact CZ-CE2 3.89Å; F648-F670 AromaticContact CZ-CZ 3.82Å; F648-F670 HydrophobicContact CZ-CZ 3.82Å; F648-L676 HydrophobicContact CD2-CD2 4.41Å; F648-L676 HydrophobicContact CE1-CD2 4.17Å; F648-L676 HydrophobicContact CE2-CD2 3.77Å; F648-L676 HydrophobicContact CZ-CD2 3.63Å
649	K	92.3	Very high	90.3	Very high	145 Å²	145	49.1 Å²	49.1	63%	0.63	26%	0.256	S	S	*	.	H	α-helix	trans	-62.8	-40.4	176.9	-176.1	-175.6	174.9	-172.1	0	112.7	M645 R646 G647 Q653	M645-K649 WeakPolarHBondContact O-CB 3.26Å; M645-K649 PolarHBondContact O-N 2.88Å; R646-K649 WeakPolarHBondContact O-CB 3.45Å; R646-K649 PolarHBondContact O-N 2.92Å; G647-K649 VanDerWaalsContact C-N 3.3Å; G647-K649 PolarHBondContact O-N 3.18Å; K649-Q653 PolarHBondContact O-N 2.64Å
650	Y	94.1	Very high	90.3	Very high	40 Å²	40	46.7 Å²	46.7	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-41.7	175.8	-77.7	-61.4	0	0	0	111.8	A609 I617 L620 Y624 R646 G647 F648 Q653 A654	A609-Y650 HydrophobicContact CB-CE1 4.26Å; I617-Y650 HydrophobicContact CG2-CD1 4.19Å; I617-Y650 WeakPolarHBondContact CG2-O 3.32Å; L620-Y650 HydrophobicContact CB-CD2 4Å; L620-Y650 HydrophobicContact CB-CE2 4.17Å; L620-Y650 HydrophobicContact CB-CG 4.37Å; L620-Y650 HydrophobicContact CD1-CE1 4.35Å; L620-Y650 HydrophobicContact CD1-CE2 4.15Å; Y624-Y650 HydrophobicContact CD2-CD2 4.02Å; Y624-Y650 HydrophobicContact CD2-CE2 4.1Å; Y624-Y650 HydrophobicContact CE2-CD2 4.13Å; Y624-Y650 AromaticContact CE2-CE2 3.72Å; Y624-Y650 HydrophobicContact CE2-CE2 3.72Å; R646-Y650 HydrophobicContact CB-CE2 4.48Å; R646-Y650 WeakPolarHBondContact O-CD2 3.39Å; R646-Y650 PolarHBondContact O-N 3.33Å; G647-Y650 PolarHBondContact O-N 3.19Å; G647-Y650 VanDerWaalsContact O-N 3.17Å; F648-Y650 PolarHBondContact O-N 2.95Å; Y650-Q653 WeakPolarHBondContact O-CB 3.44Å; Y650-Q653 PolarHBondContact O-N 2.83Å; Y650-A654 PolarHBondContact O-N 3.3Å
651	L	93.6	Very high	90.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-35.5	175.2	-62.5	-169.7	0	0	0	112.7	K622 L625 L627 G647 F648 Q653 A654 A655 S662 I665 V666	K622-L651 HydrophobicContact CG-CD1 4.45Å; K622-L651 HydrophobicContact CG-CD2 4.13Å; L625-L651 HydrophobicContact CD1-CD1 3.64Å; L625-L651 HydrophobicContact CD1-CG 4.33Å; L627-L651 HydrophobicContact CD1-CD1 4.23Å; G647-L651 PolarHBondContact O-N 3.43Å; F648-L651 PolarHBondContact O-N 3.37Å; L651-Q653 VanDerWaalsContact C-N 3.35Å; L651-Q653 PolarHBondContact O-N 3.36Å; L651-A654 PolarHBondContact O-N 3.04Å; L651-A655 WeakPolarHBondContact O-CB 3.4Å; L651-A655 PolarHBondContact O-N 3.2Å; L651-S662 WeakPolarHBondContact O-CB 3.5Å; L651-I665 HydrophobicContact CD1-CB 4.05Å; L651-I665 HydrophobicContact CD1-CD1 4.01Å; L651-I665 HydrophobicContact CD1-CG2 3.48Å; L651-I665 VanDerWaalsContact CD1-CG2 3.48Å; L651-V666 HydrophobicContact CB-CG2 4.09Å
652	L	93.1	Very high	90.6	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-43.9	170.6	-179.2	61.9	0	0	0	111.3	F648 A654 A655 E656 V666 W690	F648-L652 HydrophobicContact CE1-CD2 4.4Å; F648-L652 WeakPolarHBondContact O-CB 3.43Å; F648-L652 PolarHBondContact O-N 1.82Å; L652-A654 VanDerWaalsContact C-N 3.3Å; L652-A654 PolarHBondContact O-N 3.37Å; L652-A655 PolarHBondContact O-N 2.96Å; L652-E656 WeakPolarHBondContact O-CB 3.5Å; L652-E656 WeakPolarHBondContact O-CG 3.48Å; L652-E656 PolarHBondContact O-N 3.01Å; L652-V666 HydrophobicContact CB-CG2 4.38Å; L652-V666 HydrophobicContact CD1-CG1 4Å; L652-W690 HydrophobicContact CD1-CH2 4.34Å; L652-W690 HydrophobicContact CD1-CZ2 3.64Å
653	Q	92.3	Very high	90.8	Very high	62 Å²	62	41.6 Å²	41.6	29%	0.29	20%	0.198	S	C	.	.	H	α-helix	trans	-62.9	-33.8	174.4	177.9	177.5	-29.2	0	0	112.8	I568 I617 K649 Y650 L651 A657	I568-Q653 HydrophobicContact CD1-CG 4.02Å; I617-Q653 HydrophobicContact CD1-CG 4.44Å; I617-Q653 VanDerWaalsContact CD1-NE2 3.29Å; I617-Q653 HydrophobicContact CG2-CB 4.35Å; I617-Q653 HydrophobicContact CG2-CG 4.34Å; K649-Q653 PolarHBondContact O-N 2.64Å; Y650-Q653 WeakPolarHBondContact O-CB 3.44Å; Y650-Q653 PolarHBondContact O-N 2.83Å; L651-Q653 VanDerWaalsContact C-N 3.35Å; L651-Q653 PolarHBondContact O-N 3.36Å; Q653-A657 PolarHBondContact O-N 3.47Å; Q653-A657 VanDerWaalsContact O-N 3.13Å
654	A	92.2	Very high	90.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-74.1	-38.6	174.2	0	0	0	0	0	112.6	L614 I617 V618 Y650 L651 L652 A657 G658 D659 S662	L614-A654 HydrophobicContact CD1-CB 3.81Å; I617-A654 HydrophobicContact CG2-CB 3.96Å; V618-A654 HydrophobicContact CG2-CB 3.64Å; Y650-A654 PolarHBondContact O-N 3.3Å; L651-A654 PolarHBondContact O-N 3.04Å; L652-A654 VanDerWaalsContact C-N 3.3Å; L652-A654 PolarHBondContact O-N 3.37Å; A654-A657 WeakPolarHBondContact O-CA 3.34Å; A654-A657 WeakPolarHBondContact O-CB 3.5Å; A654-A657 PolarHBondContact O-N 3.03Å; A654-G658 PolarHBondContact O-N 2.87Å; A654-G658 VanDerWaalsContact O-N 3.11Å; A654-D659 HydrophobicContact CB-CB 4.02Å; A654-D659 WeakPolarHBondContact O-CB 3.13Å; A654-D659 PolarHBondContact O-N 2.97Å; A654-S662 WeakPolarHBondContact CB-OG 3.46Å
655	A	92	Very high	91.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-47.3	172.8	0	0	0	0	0	111	L651 L652 A657 G658 M663 V666 W690	L651-A655 WeakPolarHBondContact O-CB 3.4Å; L651-A655 PolarHBondContact O-N 3.2Å; L652-A655 PolarHBondContact O-N 2.96Å; A655-A657 PolarHBondContact O-N 2.85Å; A655-G658 PolarHBondContact O-N 2.95Å; A655-G658 VanDerWaalsContact O-N 3.09Å; A655-M663 HydrophobicContact CB-CB 4.36Å; A655-M663 HydrophobicContact CB-CG 3.8Å; A655-M663 WeakPolarHBondContact O-CE 3.13Å; A655-V666 HydrophobicContact CB-CG2 4.21Å; A655-W690 HydrophobicContact CB-CE3 3.92Å; A655-W690 HydrophobicContact CB-CH2 4.02Å; A655-W690 HydrophobicContact CB-CZ3 3.59Å
656	E	90.6	Very high	91.3	Very high	115 Å²	115	34.5 Å²	34.5	54%	0.537	17%	0.168	S	C	.	.	H	α-helix	trans	-58.1	-30.8	170.9	-71.8	174.3	-173.3	0	0	112.8	K566 L652 W690	K566-E656 WeakPolarHBondContact CE-O 3.36Å; K566-E656 PolarHBondContact NZ-O 2.81Å; L652-E656 WeakPolarHBondContact O-CB 3.5Å; L652-E656 WeakPolarHBondContact O-CG 3.48Å; L652-E656 PolarHBondContact O-N 3.01Å; E656-W690 HydrophobicContact CG-CH2 3.97Å
657	A	87.9	Confident	91.5	Very high	20 Å²	20	28.3 Å²	28.3	17%	0.165	15%	0.145	C	C	.	.	H	α-helix	trans	-68.5	-36.3	175.9	0	0	0	0	0	112.7	K566 I568 L614 Q653 A654 A655	K566-A657 VanDerWaalsContact NZ-C 3.32Å; K566-A657 PolarHBondContact NZ-O 3.44Å; I568-A657 HydrophobicContact CD1-CB 3.48Å; I568-A657 VanDerWaalsContact CD1-CB 3.48Å; I568-A657 HydrophobicContact CG2-CB 4.14Å; L614-A657 HydrophobicContact CD1-CB 3.73Å; L614-A657 HydrophobicContact CD2-CB 4.48Å; Q653-A657 PolarHBondContact O-N 3.47Å; Q653-A657 VanDerWaalsContact O-N 3.13Å; A654-A657 WeakPolarHBondContact O-CA 3.34Å; A654-A657 WeakPolarHBondContact O-CB 3.5Å; A654-A657 PolarHBondContact O-N 3.03Å; A655-A657 PolarHBondContact O-N 2.85Å
658	G	88	Confident	91.5	Very high	28 Å²	28	34 Å²	34	29%	0.289	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	118.9	13.3	-169.1	0	0	0	0	0	114.4	A654 A655 R660 M697	A654-G658 PolarHBondContact O-N 2.87Å; A654-G658 VanDerWaalsContact O-N 3.11Å; A655-G658 PolarHBondContact O-N 2.95Å; A655-G658 VanDerWaalsContact O-N 3.09Å; G658-R660 PolarHBondContact O-N 3.45Å; G658-M697 WeakPolarHBondContact O-CE 3.23Å
659	D	88.9	Confident	91.5	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.193	17%	0.169	C	C	.	.			trans	-78.9	108.8	174.8	-179	62.4	0	0	0	111.2	L614 V618 A654 S661 S662 M663	L614-D659 HydrophobicContact CD1-CB 4.26Å; L614-D659 HydrophobicContact CD2-CB 4.37Å; V618-D659 HydrophobicContact CG2-CB 4.24Å; A654-D659 HydrophobicContact CB-CB 4.02Å; A654-D659 WeakPolarHBondContact O-CB 3.13Å; A654-D659 PolarHBondContact O-N 2.97Å; D659-S661 VanDerWaalsContact C-N 3.32Å; D659-S661 PolarHBondContact O-N 3.42Å; D659-S662 PolarHBondContact O-N 3.12Å; D659-S662 VanDerWaalsContact O-N 3.17Å; D659-S662 WeakPolarHBondContact OD2-CB 3.41Å; D659-S662 PolarHBondContact OD2-N 3.33Å; D659-S662 PolarHBondContact OD2-OG 2.93Å; D659-M663 WeakPolarHBondContact O-CG 3.39Å; D659-M663 PolarHBondContact O-N 3.01Å
660	R	87.7	Confident	91.6	Very high	33 Å²	33	27.4 Å²	27.4	13%	0.125	14%	0.139	C	C	.	.	H	α-helix	trans	-60.5	-38.1	-176.1	-162.4	165.8	177.2	-143.3	-2.1	113.2	G658 M663 I664 A694 M697 D699 T709	G658-R660 PolarHBondContact O-N 3.45Å; R660-M663 PolarHBondContact O-N 3.39Å; R660-I664 WeakPolarHBondContact O-CG1 3.32Å; R660-I664 PolarHBondContact O-N 3.16Å; R660-A694 HydrophobicContact CG-CB 4.25Å; R660-A694 PolarHBondContact NE-O 3.47Å; R660-A694 PolarHBondContact NH2-O 3.43Å; R660-M697 HydrophobicContact CB-CE 3.53Å; R660-M697 HydrophobicContact CG-CE 3.85Å; R660-D699 WeakPolarHBondContact CD-OD2 3.34Å; R660-T709 VanDerWaalsContact CZ-CG2 3.48Å
661	S	88.8	Confident	91.6	Very high	37 Å²	37	26 Å²	26	26%	0.259	13%	0.134	S	C	.	.	H	α-helix	trans	-63.1	-43.6	176.8	-174.6	0	0	0	0	111.2	K622 D659 I664 I665	K622-S661 PolarHBondContact NZ-OG 2.87Å; D659-S661 VanDerWaalsContact C-N 3.32Å; D659-S661 PolarHBondContact O-N 3.42Å; S661-I664 PolarHBondContact O-N 2.86Å; S661-I665 WeakPolarHBondContact O-CD1 3.48Å; S661-I665 VanDerWaalsContact O-CG1 3.32Å; S661-I665 WeakPolarHBondContact O-CG1 3.45Å; S661-I665 PolarHBondContact O-N 3.38Å; S661-I665 VanDerWaalsContact O-N 3.16Å
662	S	92	Very high	91.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.6	-36.2	177.5	-59.1	0	0	0	0	112.8	L651 A654 D659 I664 I665 V666	L651-S662 WeakPolarHBondContact O-CB 3.5Å; A654-S662 WeakPolarHBondContact CB-OG 3.46Å; D659-S662 PolarHBondContact O-N 3.12Å; D659-S662 VanDerWaalsContact O-N 3.17Å; D659-S662 WeakPolarHBondContact OD2-CB 3.41Å; D659-S662 PolarHBondContact OD2-N 3.33Å; D659-S662 PolarHBondContact OD2-OG 2.93Å; S662-I664 VanDerWaalsContact C-N 3.33Å; S662-I664 PolarHBondContact O-N 2.95Å; S662-I665 PolarHBondContact O-N 2.83Å; S662-V666 WeakPolarHBondContact O-CB 3.32Å; S662-V666 WeakPolarHBondContact O-CG2 3.5Å; S662-V666 PolarHBondContact O-N 3.18Å
663	M	92.6	Very high	91.2	Very high	13 Å²	13	30.5 Å²	30.5	6%	0.064	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-47.7	172.5	-69.7	-176	176.1	0	0	111.6	A655 D659 R660 V666 A667 W690 A694 M697	A655-M663 HydrophobicContact CB-CB 4.36Å; A655-M663 HydrophobicContact CB-CG 3.8Å; A655-M663 WeakPolarHBondContact O-CE 3.13Å; D659-M663 WeakPolarHBondContact O-CG 3.39Å; D659-M663 PolarHBondContact O-N 3.01Å; R660-M663 PolarHBondContact O-N 3.39Å; M663-V666 PolarHBondContact O-N 3.23Å; M663-A667 WeakPolarHBondContact O-CB 3.48Å; M663-A667 PolarHBondContact O-N 3.5Å; M663-W690 HydrophobicContact CB-CE3 4.35Å; M663-W690 HydrophobicContact CE-CZ3 4.42Å; M663-W690 HydrophobicContact CG-CE3 3.93Å; M663-W690 HydrophobicContact CG-CZ3 4.21Å; M663-A694 HydrophobicContact CB-CB 3.97Å; M663-A694 HydrophobicContact SD-CB 4.34Å; M663-M697 HydrophobicContact CE-CE 3.73Å; M663-M697 HydrophobicContact CE-SD 3.6Å; M663-M697 VanDerWaalsContact CE-SD 3.6Å; M663-M697 HydrophobicContact SD-CE 3.54Å; M663-M697 VanDerWaalsContact SD-CE 3.54Å; M663-M697 HydrophobicContact SD-SD 4.1Å
664	I	91.5	Very high	90.7	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-40.5	-179	-61.7	166.5	0	0	0	111.2	R660 S661 S662 A667 R668 Y691 A694 T709 E712 L717	R660-I664 WeakPolarHBondContact O-CG1 3.32Å; R660-I664 PolarHBondContact O-N 3.16Å; S661-I664 PolarHBondContact O-N 2.86Å; S662-I664 VanDerWaalsContact C-N 3.33Å; S662-I664 PolarHBondContact O-N 2.95Å; I664-A667 PolarHBondContact O-N 3.15Å; I664-R668 WeakPolarHBondContact O-CB 3.36Å; I664-R668 WeakPolarHBondContact O-CG 3.37Å; I664-R668 PolarHBondContact O-N 3.3Å; I664-Y691 HydrophobicContact CG2-CE1 4.49Å; I664-A694 HydrophobicContact CD1-CB 4.28Å; I664-A694 HydrophobicContact CG1-CB 3.64Å; I664-T709 HydrophobicContact CD1-CG2 3.98Å; I664-E712 HydrophobicContact CG2-CB 4.5Å; I664-E712 HydrophobicContact CG2-CG 4.5Å; I664-E712 WeakPolarHBondContact CG2-OE1 3.25Å; I664-L717 HydrophobicContact CD1-CD1 4.06Å; I664-L717 HydrophobicContact CG1-CD1 4.24Å; I664-L717 HydrophobicContact CG2-CD2 4.14Å
665	I	91.9	Very high	89.8	Confident	37 Å²	37	32 Å²	32	19%	0.19	20%	0.195	C	C	.	.	H	α-helix	trans	-65.7	-39.3	176.2	-63	160.8	0	0	0	111.4	L627 L651 S661 S662 R668 A669	L627-I665 HydrophobicContact CD1-CD1 4.12Å; L627-I665 HydrophobicContact CD1-CG2 3.78Å; L651-I665 HydrophobicContact CD1-CB 4.05Å; L651-I665 HydrophobicContact CD1-CD1 4.01Å; L651-I665 HydrophobicContact CD1-CG2 3.48Å; L651-I665 VanDerWaalsContact CD1-CG2 3.48Å; S661-I665 WeakPolarHBondContact O-CD1 3.48Å; S661-I665 VanDerWaalsContact O-CG1 3.32Å; S661-I665 WeakPolarHBondContact O-CG1 3.45Å; S661-I665 PolarHBondContact O-N 3.38Å; S661-I665 VanDerWaalsContact O-N 3.16Å; S662-I665 PolarHBondContact O-N 2.83Å; I665-R668 PolarHBondContact O-N 3.45Å; I665-A669 PolarHBondContact O-N 3.28Å; I665-A669 VanDerWaalsContact O-N 3.1Å
666	V	93.6	Very high	89.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-43.7	176	168.8	0	0	0	0	110.9	F648 L651 L652 A655 S662 M663 R668 A669 F670 W690	F648-V666 HydrophobicContact CE2-CB 4.45Å; F648-V666 HydrophobicContact CE2-CG1 4.19Å; F648-V666 HydrophobicContact CE2-CG2 4.21Å; F648-V666 HydrophobicContact CZ-CG1 4.32Å; L651-V666 HydrophobicContact CB-CG2 4.09Å; L652-V666 HydrophobicContact CB-CG2 4.38Å; L652-V666 HydrophobicContact CD1-CG1 4Å; A655-V666 HydrophobicContact CB-CG2 4.21Å; S662-V666 WeakPolarHBondContact O-CB 3.32Å; S662-V666 WeakPolarHBondContact O-CG2 3.5Å; S662-V666 PolarHBondContact O-N 3.18Å; M663-V666 PolarHBondContact O-N 3.23Å; V666-R668 PolarHBondContact O-N 2.85Å; V666-A669 WeakPolarHBondContact O-CB 3.49Å; V666-A669 PolarHBondContact O-N 3.19Å; V666-F670 HydrophobicContact CG1-CD2 3.86Å; V666-F670 HydrophobicContact CG1-CE2 3.59Å; V666-F670 VanDerWaalsContact O-CD2 3.22Å; V666-F670 WeakPolarHBondContact O-CD2 3.42Å; V666-F670 PolarHBondContact O-N 3.3Å; V666-F670 VanDerWaalsContact O-N 3.15Å; V666-W690 HydrophobicContact CG1-CD2 4.17Å; V666-W690 HydrophobicContact CG1-CG 3.96Å
667	A	94	Very high	88.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.3	-47.6	174.1	0	0	0	0	0	111.6	M663 I664 A669 F670 D671 W690 Y691	M663-A667 WeakPolarHBondContact O-CB 3.48Å; M663-A667 PolarHBondContact O-N 3.5Å; I664-A667 PolarHBondContact O-N 3.15Å; A667-A669 VanDerWaalsContact C-N 3.31Å; A667-A669 PolarHBondContact O-N 2.93Å; A667-F670 PolarHBondContact O-N 3.39Å; A667-F670 VanDerWaalsContact O-N 3.15Å; A667-D671 WeakPolarHBondContact O-CB 3.27Å; A667-D671 PolarHBondContact O-N 2.91Å; A667-W690 HydrophobicContact CB-CB 3.69Å; A667-Y691 HydrophobicContact CB-CD1 3.39Å; A667-Y691 HydrophobicContact CB-CD2 3.96Å; A667-Y691 HydrophobicContact CB-CE1 3.42Å; A667-Y691 VanDerWaalsContact CB-CE1 3.42Å; A667-Y691 HydrophobicContact CB-CE2 4Å; A667-Y691 HydrophobicContact CB-CG 3.67Å
668	R	92.1	Very high	87.5	Confident	120 Å²	120	32 Å²	32	45%	0.453	21%	0.21	S	C	.	.	H	α-helix	trans	-59.3	-36.2	175.5	-79.3	177.7	159.7	-156	-3.3	113.9	I664 I665 V666 T672 Y691 E712	I664-R668 WeakPolarHBondContact O-CB 3.36Å; I664-R668 WeakPolarHBondContact O-CG 3.37Å; I664-R668 PolarHBondContact O-N 3.3Å; I665-R668 PolarHBondContact O-N 3.45Å; V666-R668 PolarHBondContact O-N 2.85Å; R668-T672 WeakPolarHBondContact O-CB 3.36Å; R668-T672 WeakPolarHBondContact O-CG2 3.47Å; R668-T672 PolarHBondContact O-N 3.24Å; R668-T672 PolarHBondContact O-OG1 3.49Å; R668-Y691 HydrophobicContact CG-CE1 4.45Å; R668-Y691 WeakPolarHBondContact CG-OH 3.49Å; R668-E712 IonicContact CZ-OE1 2.79Å; R668-E712 IonicContact CZ-OE2 3.85Å; R668-E712 IonicContact NE-OE1 2.73Å; R668-E712 PolarHBondContact NE-OE1 2.81Å; R668-E712 IonicContact NE-OE2 2.92Å; R668-E712 PolarHBondContact NE-OE2 2.74Å; R668-E712 IonicContact NH1-OE1 3.78Å; R668-E712 PolarHBondContact NH1-OE1 3.19Å; R668-E712 IonicContact NH2-OE1 2.7Å; R668-E712 PolarHBondContact NH2-OE1 3.47Å; R668-E712 IonicContact NH2-OE2 3.61Å; R668-E712 PolarHBondContact NH2-OE2 3.35Å
669	A	92.4	Very high	86.9	Confident	8 Å²	8	36.5 Å²	36.5	7%	0.066	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-39.6	176.4	0	0	0	0	0	111.5	F648 I665 V666 A667 G673 A674 L676	F648-A669 HydrophobicContact CD2-CB 3.98Å; F648-A669 HydrophobicContact CE2-CB 3.68Å; I665-A669 PolarHBondContact O-N 3.28Å; I665-A669 VanDerWaalsContact O-N 3.1Å; V666-A669 WeakPolarHBondContact O-CB 3.49Å; V666-A669 PolarHBondContact O-N 3.19Å; A667-A669 VanDerWaalsContact C-N 3.31Å; A667-A669 PolarHBondContact O-N 2.93Å; A669-G673 CarbonylContact O-C 3.52Å; A669-G673 WeakPolarHBondContact O-CA 3.46Å; A669-G673 PolarHBondContact O-N 3.37Å; A669-A674 VanDerWaalsContact CA-O 3.32Å; A669-A674 WeakPolarHBondContact CA-O 3.37Å; A669-A674 WeakPolarHBondContact CB-O 3.49Å; A669-L676 HydrophobicContact CB-CD2 3.77Å; A669-L676 HydrophobicContact CB-CG 4.27Å; A669-L676 WeakPolarHBondContact O-CD1 3.47Å; A669-L676 WeakPolarHBondContact O-CG 3.3Å
670	F	94.5	Very high	86.6	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-72.5	-36.7	174	-74.3	-62.3	0	0	0	113.5	F648 V666 A667 L676 Q682 D683 E686 A687 W690	F648-F670 AromaticContact CZ-CE2 3.89Å; F648-F670 HydrophobicContact CZ-CE2 3.89Å; F648-F670 AromaticContact CZ-CZ 3.82Å; F648-F670 HydrophobicContact CZ-CZ 3.82Å; V666-F670 HydrophobicContact CG1-CD2 3.86Å; V666-F670 HydrophobicContact CG1-CE2 3.59Å; V666-F670 VanDerWaalsContact O-CD2 3.22Å; V666-F670 WeakPolarHBondContact O-CD2 3.42Å; V666-F670 PolarHBondContact O-N 3.3Å; V666-F670 VanDerWaalsContact O-N 3.15Å; A667-F670 PolarHBondContact O-N 3.39Å; A667-F670 VanDerWaalsContact O-N 3.15Å; F670-L676 HydrophobicContact CD1-CD1 4.32Å; F670-L676 HydrophobicContact CD1-CD2 3.82Å; F670-L676 HydrophobicContact CE1-CD2 3.88Å; F670-L676 HydrophobicContact CG-CD2 4.26Å; F670-L676 HydrophobicContact CZ-CD2 4.39Å; F670-Q682 WeakPolarHBondContact O-CA 3.45Å; F670-Q682 WeakPolarHBondContact O-CG 3.26Å; F670-D683 WeakPolarHBondContact CB-O 3.39Å; F670-D683 HydrophobicContact CD1-CB 4.31Å; F670-D683 PolarHBondContact O-N 3.37Å; F670-E686 HydrophobicContact CB-CB 4.3Å; F670-E686 HydrophobicContact CD1-CB 3.89Å; F670-E686 HydrophobicContact CD1-CG 4.48Å; F670-E686 HydrophobicContact CD2-CB 3.93Å; F670-E686 HydrophobicContact CE1-CB 4.15Å; F670-E686 HydrophobicContact CE1-CG 4.33Å; F670-E686 HydrophobicContact CE2-CB 4.17Å; F670-E686 HydrophobicContact CG-CB 3.8Å; F670-E686 HydrophobicContact CZ-CB 4.28Å; F670-E686 HydrophobicContact CZ-CG 4.47Å; F670-A687 HydrophobicContact CB-CB 3.81Å; F670-W690 AromaticContact CD2-CD1 3.94Å; F670-W690 AromaticContact CE2-CD1 3.95Å; F670-W690 AromaticContact CE2-NE1 3.91Å
671	D	94	Very high	86.7	Confident	11 Å²	11	46 Å²	46	6%	0.059	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-53.3	174.3	-179.3	-10	0	0	0	111.6	A667 Q682 W684 A687 Y691 R720 M724	A667-D671 WeakPolarHBondContact O-CB 3.27Å; A667-D671 PolarHBondContact O-N 2.91Å; D671-Q682 WeakPolarHBondContact O-CG 3.44Å; D671-Q682 PolarHBondContact O-NE2 3.45Å; D671-W684 PolarHBondContact O-NE1 2.8Å; D671-A687 HydrophobicContact CB-CB 4.24Å; D671-Y691 HydrophobicContact CB-CE2 4.36Å; D671-Y691 PolarHBondContact OD2-OH 3.17Å; D671-R720 IonicContact OD1-CZ 3.71Å; D671-R720 IonicContact OD1-NE 3.81Å; D671-R720 PolarHBondContact OD1-NE 2.95Å; D671-R720 IonicContact OD1-NH2 2.68Å; D671-R720 PolarHBondContact OD1-NH2 3.42Å; D671-R720 WeakPolarHBondContact OD2-CG 3.39Å; D671-R720 IonicContact OD2-CZ 2.66Å; D671-R720 IonicContact OD2-NE 3.35Å; D671-R720 PolarHBondContact OD2-NE 2.93Å; D671-R720 IonicContact OD2-NH2 2.74Å; D671-M724 HydrophobicContact CB-CE 3.45Å; D671-M724 VanDerWaalsContact CB-CE 3.45Å; D671-M724 VanDerWaalsContact OD1-CE 3.23Å; D671-M724 WeakPolarHBondContact OD1-CE 3.35Å; D671-M724 WeakPolarHBondContact OD2-CE 3.28Å
672	T	90.9	Very high	86.9	Confident	81 Å²	81	47.2 Å²	47.2	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-94.7	-16.4	-170.8	62.5	0	0	0	0	114.3	R668 A674	R668-T672 WeakPolarHBondContact O-CB 3.36Å; R668-T672 WeakPolarHBondContact O-CG2 3.47Å; R668-T672 PolarHBondContact O-N 3.24Å; R668-T672 PolarHBondContact O-OG1 3.49Å; T672-A674 PolarHBondContact O-N 2.88Å; T672-A674 WeakPolarHBondContact OG1-CB 3.22Å; T672-A674 PolarHBondContact OG1-N 3.2Å
673	G	86.6	Confident	87	Confident	30 Å²	30	48.6 Å²	48.6	31%	0.309	27%	0.274	S	S	.	.			trans	73.1	-3.3	-168.5	0	0	0	0	0	114.7	A669	A669-G673 CarbonylContact O-C 3.52Å; A669-G673 WeakPolarHBondContact O-CA 3.46Å; A669-G673 PolarHBondContact O-N 3.37Å
674	A	82.7	Confident	87.2	Confident	61 Å²	61	48.4 Å²	48.4	50%	0.504	27%	0.273	S	S	.	.			trans	-81.8	145.4	-178.2	0	0	0	0	0	111.9	A669 T672 L676	A669-A674 VanDerWaalsContact CA-O 3.32Å; A669-A674 WeakPolarHBondContact CA-O 3.37Å; A669-A674 WeakPolarHBondContact CB-O 3.49Å; T672-A674 PolarHBondContact O-N 2.88Å; T672-A674 WeakPolarHBondContact OG1-CB 3.22Å; T672-A674 PolarHBondContact OG1-N 3.2Å; A674-L676 PolarHBondContact O-N 3.11Å; A674-L676 VanDerWaalsContact O-N 3.1Å
675	G	72.9	Confident	87.3	Confident	32 Å²	32	50.3 Å²	50.3	33%	0.33	29%	0.289	S	S	.	.	S	Bend	trans	72.8	-7.1	177.8	0	0	0	0	0	115.9
676	L	79.8	Confident	87.4	Confident	29 Å²	29	52 Å²	52	15%	0.152	30%	0.297	C	S	.	.			trans	-61.7	153.2	176.4	-67.1	178.7	0	0	0	112.9	F648 A669 F670 A674 R680 K681	F648-L676 HydrophobicContact CD2-CD2 4.41Å; F648-L676 HydrophobicContact CE1-CD2 4.17Å; F648-L676 HydrophobicContact CE2-CD2 3.77Å; F648-L676 HydrophobicContact CZ-CD2 3.63Å; A669-L676 HydrophobicContact CB-CD2 3.77Å; A669-L676 HydrophobicContact CB-CG 4.27Å; A669-L676 WeakPolarHBondContact O-CD1 3.47Å; A669-L676 WeakPolarHBondContact O-CG 3.3Å; F670-L676 HydrophobicContact CD1-CD1 4.32Å; F670-L676 HydrophobicContact CD1-CD2 3.82Å; F670-L676 HydrophobicContact CE1-CD2 3.88Å; F670-L676 HydrophobicContact CG-CD2 4.26Å; F670-L676 HydrophobicContact CZ-CD2 4.39Å; A674-L676 PolarHBondContact O-N 3.11Å; A674-L676 VanDerWaalsContact O-N 3.1Å; L676-R680 HydrophobicContact CB-CB 4.38Å; L676-K681 VanDerWaalsContact CD1-O 3.25Å; L676-K681 WeakPolarHBondContact CD1-O 3.27Å
677	S	71.2	Confident	87.5	Confident	12 Å²	12	52 Å²	52	8%	0.084	30%	0.297	C	S	.	.			trans	-70	151.3	170.3	61.4	0	0	0	0	111.5	D679 R680	S677-D679 WeakPolarHBondContact CB-OD1 3.42Å; S677-D679 PolarHBondContact O-N 3Å; S677-D679 VanDerWaalsContact O-N 3.07Å; S677-D679 PolarHBondContact OG-OD1 3.27Å; S677-R680 PolarHBondContact O-N 2.98Å
678	A	71.5	Confident	87.6	Confident	97 Å²	97	52.7 Å²	52.7	80%	0.802	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.1	-171.6	0	0	0	0	0	115.6	M645	M645-A678 HydrophobicContact CE-CB 3.96Å
679	D	76.3	Confident	87.7	Confident	122 Å²	122	51.6 Å²	51.6	65%	0.652	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-16.6	170.7	59.8	-56.3	0	0	0	113.5	S677	S677-D679 WeakPolarHBondContact CB-OD1 3.42Å; S677-D679 PolarHBondContact O-N 3Å; S677-D679 VanDerWaalsContact O-N 3.07Å; S677-D679 PolarHBondContact OG-OD1 3.27Å
680	R	82.8	Confident	87.8	Confident	91 Å²	91	52.2 Å²	52.2	34%	0.343	30%	0.3	S	S	.	.			trans	-106.8	165.6	-178.5	-68.1	-177.8	178.5	-104.2	8.3	111.8	L676 S677	L676-R680 HydrophobicContact CB-CB 4.38Å; S677-R680 PolarHBondContact O-N 2.98Å
681	K	88.4	Confident	87.8	Confident	177 Å²	177	52.3 Å²	52.3	77%	0.77	30%	0.301	S	S	*	.			trans	-143.4	164.7	-179.9	-64.9	-178.4	-177.6	175.3	0	109.5	L676 D683	L676-K681 VanDerWaalsContact CD1-O 3.25Å; L676-K681 WeakPolarHBondContact CD1-O 3.27Å; K681-D683 PolarHBondContact O-N 3.32Å
682	Q	93.4	Very high	87.7	Confident	63 Å²	63	55.2 Å²	55.2	29%	0.294	32%	0.316	S	S	.	.			trans	-50.7	125.2	169.6	-167.6	173.9	8	0	0	110.1	F670 D671 F730	F670-Q682 WeakPolarHBondContact O-CA 3.45Å; F670-Q682 WeakPolarHBondContact O-CG 3.26Å; D671-Q682 WeakPolarHBondContact O-CG 3.44Å; D671-Q682 PolarHBondContact O-NE2 3.45Å; Q682-F730 HydrophobicContact CB-CD1 3.78Å; Q682-F730 HydrophobicContact CB-CE1 4.16Å; Q682-F730 HydrophobicContact CB-CG 4.44Å; Q682-F730 HydrophobicContact CG-CB 4.41Å; Q682-F730 HydrophobicContact CG-CD1 3.61Å; Q682-F730 HydrophobicContact CG-CD2 4.45Å; Q682-F730 HydrophobicContact CG-CE1 3.94Å; Q682-F730 HydrophobicContact CG-CG 3.9Å; Q682-F730 HydrophobicContact CG-CZ 4.48Å
683	D	94.9	Very high	87.7	Confident	28 Å²	28	52.8 Å²	52.8	15%	0.15	30%	0.302	C	S	.	.			trans	-151.4	107.7	-172.6	-169.2	-52.9	0	0	0	109.1	F670 K681 A685 E686 A687 F730 N731	F670-D683 WeakPolarHBondContact CB-O 3.39Å; F670-D683 HydrophobicContact CD1-CB 4.31Å; F670-D683 PolarHBondContact O-N 3.37Å; K681-D683 PolarHBondContact O-N 3.32Å; D683-A685 VanDerWaalsContact C-N 3.34Å; D683-A685 WeakPolarHBondContact OD1-CB 3.22Å; D683-A685 PolarHBondContact OD1-N 3.49Å; D683-E686 HydrophobicContact CB-CB 4.21Å; D683-E686 HydrophobicContact CB-CG 4.35Å; D683-E686 PolarHBondContact OD1-N 3.2Å; D683-A687 WeakPolarHBondContact O-CB 3.38Å; D683-A687 PolarHBondContact O-N 3.2Å; D683-F730 CarbonylContact C-O 3.6Å; D683-F730 WeakPolarHBondContact CA-O 3.46Å; D683-N731 PolarHBondContact OD2-ND2 3.07Å
684	W	96.3	Very high	87.9	Confident	10 Å²	10	51.3 Å²	51.3	4%	0.038	29%	0.288	C	S	.	.	H	α-helix	trans	-77	-20.3	-176.2	-72.4	-5.8	0	0	0	113	D671 A687 I688 M724 E727 F730 L732	D671-W684 PolarHBondContact O-NE1 2.8Å; W684-A687 PolarHBondContact O-N 3.49Å; W684-I688 WeakPolarHBondContact O-CB 3.44Å; W684-I688 WeakPolarHBondContact O-CD1 3.44Å; W684-I688 WeakPolarHBondContact O-CG1 3.49Å; W684-I688 PolarHBondContact O-N 2.93Å; W684-M724 HydrophobicContact CB-CG 4.48Å; W684-M724 HydrophobicContact CB-SD 4.01Å; W684-M724 HydrophobicContact CD2-CB 4.26Å; W684-M724 HydrophobicContact CD2-CG 3.88Å; W684-M724 HydrophobicContact CD2-SD 4.39Å; W684-M724 HydrophobicContact CE3-CB 4.03Å; W684-M724 HydrophobicContact CE3-CG 4.12Å; W684-M724 HydrophobicContact CG-CE 4.15Å; W684-M724 HydrophobicContact CG-CG 4.07Å; W684-M724 HydrophobicContact CG-SD 3.94Å; W684-E727 HydrophobicContact CH2-CB 4.25Å; W684-E727 HydrophobicContact CZ3-CB 4.07Å; W684-F730 HydrophobicContact CB-CB 4.31Å; W684-F730 HydrophobicContact CD2-CB 4.19Å; W684-F730 AromaticContact CD2-CD2 3.76Å; W684-F730 HydrophobicContact CD2-CD2 3.76Å; W684-F730 HydrophobicContact CD2-CG 4.42Å; W684-F730 AromaticContact CE2-CD2 3.47Å; W684-F730 VanDerWaalsContact CE2-CD2 3.47Å; W684-F730 HydrophobicContact CE3-CD2 4.15Å; W684-F730 HydrophobicContact CG-CB 3.91Å; W684-F730 HydrophobicContact CG-CD2 4.3Å; W684-F730 HydrophobicContact CH2-CD2 4.08Å; W684-F730 HydrophobicContact CH2-CE2 4.23Å; W684-F730 AromaticContact CZ2-CD2 3.66Å; W684-F730 HydrophobicContact CZ2-CD2 3.66Å; W684-F730 AromaticContact CZ2-CE2 3.83Å; W684-F730 HydrophobicContact CZ2-CE2 3.83Å; W684-F730 HydrophobicContact CZ3-CD2 4.3Å; W684-F730 PolarHBondContact N-O 3.12Å; W684-F730 AromaticContact NE1-CD2 3.83Å; W684-L732 HydrophobicContact CB-CB 3.79Å; W684-L732 HydrophobicContact CB-CD2 4.16Å; W684-L732 HydrophobicContact CE3-CD2 4.44Å
685	A	94.3	Very high	88.1	Confident	45 Å²	45	49 Å²	49	37%	0.372	27%	0.266	S	S	.	.	H	α-helix	trans	-71.8	-42.2	173.7	0	0	0	0	0	111.2	D683 H689	D683-A685 VanDerWaalsContact C-N 3.34Å; D683-A685 WeakPolarHBondContact OD1-CB 3.22Å; D683-A685 PolarHBondContact OD1-N 3.49Å; A685-H689 PolarHBondContact O-N 3.05Å; A685-H689 VanDerWaalsContact O-N 3.11Å
686	E	94	Very high	88.7	Confident	73 Å²	73	52 Å²	52	34%	0.341	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-42.1	169.1	-73.2	-83.8	139.4	0	0	111.3	F670 D683 I688 H689 W690	F670-E686 HydrophobicContact CB-CB 4.3Å; F670-E686 HydrophobicContact CD1-CB 3.89Å; F670-E686 HydrophobicContact CD1-CG 4.48Å; F670-E686 HydrophobicContact CD2-CB 3.93Å; F670-E686 HydrophobicContact CE1-CB 4.15Å; F670-E686 HydrophobicContact CE1-CG 4.33Å; F670-E686 HydrophobicContact CE2-CB 4.17Å; F670-E686 HydrophobicContact CG-CB 3.8Å; F670-E686 HydrophobicContact CZ-CB 4.28Å; F670-E686 HydrophobicContact CZ-CG 4.47Å; D683-E686 HydrophobicContact CB-CB 4.21Å; D683-E686 HydrophobicContact CB-CG 4.35Å; D683-E686 PolarHBondContact OD1-N 3.2Å; E686-I688 PolarHBondContact O-N 2.88Å; E686-H689 WeakPolarHBondContact O-CB 3.4Å; E686-H689 PolarHBondContact O-N 3.36Å; E686-W690 PolarHBondContact O-N 3.37Å; E686-W690 VanDerWaalsContact O-N 3.17Å
687	A	95.3	Very high	88.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-48.7	179	0	0	0	0	0	112.3	F670 D671 D683 W684 W690 Y691 M724	F670-A687 HydrophobicContact CB-CB 3.81Å; D671-A687 HydrophobicContact CB-CB 4.24Å; D683-A687 WeakPolarHBondContact O-CB 3.38Å; D683-A687 PolarHBondContact O-N 3.2Å; W684-A687 PolarHBondContact O-N 3.49Å; A687-W690 PolarHBondContact O-N 3.5Å; A687-Y691 HydrophobicContact CB-CE2 4.38Å; A687-Y691 WeakPolarHBondContact O-CD2 3.36Å; A687-Y691 PolarHBondContact O-N 3.43Å; A687-M724 HydrophobicContact CB-CE 3.88Å; A687-M724 HydrophobicContact CB-SD 4.23Å
688	I	94.8	Very high	87.8	Confident	14 Å²	14	59.3 Å²	59.3	7%	0.072	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-39.4	177.5	-73.5	157.9	0	0	0	111.6	W684 E686 W690 Y691 D692 E721 M724 F725 L732	W684-I688 WeakPolarHBondContact O-CB 3.44Å; W684-I688 WeakPolarHBondContact O-CD1 3.44Å; W684-I688 WeakPolarHBondContact O-CG1 3.49Å; W684-I688 PolarHBondContact O-N 2.93Å; E686-I688 PolarHBondContact O-N 2.88Å; I688-W690 PolarHBondContact O-N 3.01Å; I688-Y691 PolarHBondContact O-N 3.35Å; I688-D692 VanDerWaalsContact O-CB 3.23Å; I688-D692 WeakPolarHBondContact O-CB 2.93Å; I688-D692 PolarHBondContact O-N 2.84Å; I688-E721 HydrophobicContact CG1-CB 4.47Å; I688-E721 HydrophobicContact CG1-CG 4.23Å; I688-M724 HydrophobicContact CD1-CB 3.95Å; I688-M724 HydrophobicContact CD1-SD 3.92Å; I688-M724 HydrophobicContact CG1-SD 3.72Å; I688-F725 HydrophobicContact CD1-CD2 4.07Å; I688-F725 HydrophobicContact CD1-CE1 4.34Å; I688-F725 HydrophobicContact CD1-CE2 3.57Å; I688-F725 HydrophobicContact CD1-CZ 3.71Å; I688-F725 HydrophobicContact CG1-CE2 4.24Å; I688-F725 HydrophobicContact CG2-CE2 4.01Å; I688-F725 HydrophobicContact CG2-CZ 4.1Å; I688-L732 HydrophobicContact CD1-CD1 3.73Å; I688-L732 HydrophobicContact CD1-CD2 3.39Å; I688-L732 HydrophobicContact CD1-CG 4.19Å
689	H	94.9	Very high	86.9	Confident	97 Å²	97	59 Å²	59	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-55.3	-39.9	173.9	164.9	-88.4	0	0	0	112.2	A685 E686 S693	A685-H689 PolarHBondContact O-N 3.05Å; A685-H689 VanDerWaalsContact O-N 3.11Å; E686-H689 WeakPolarHBondContact O-CB 3.4Å; E686-H689 PolarHBondContact O-N 3.36Å; H689-S693 VanDerWaalsContact O-CB 3.29Å; H689-S693 WeakPolarHBondContact O-CB 3.47Å; H689-S693 PolarHBondContact O-N 3.43Å; H689-S693 VanDerWaalsContact O-N 3.1Å; H689-S693 PolarHBondContact O-OG 3.17Å
690	W	94.7	Very high	85.4	Confident	21 Å²	21	62.4 Å²	62.4	8%	0.08	30%	0.299	C	S	.	.	H	α-helix	trans	-81.8	-32	179.6	-68.7	112.7	0	0	0	113.8	L652 A655 E656 M663 V666 A667 F670 E686 A687 I688 A694	L652-W690 HydrophobicContact CD1-CH2 4.34Å; L652-W690 HydrophobicContact CD1-CZ2 3.64Å; A655-W690 HydrophobicContact CB-CE3 3.92Å; A655-W690 HydrophobicContact CB-CH2 4.02Å; A655-W690 HydrophobicContact CB-CZ3 3.59Å; E656-W690 HydrophobicContact CG-CH2 3.97Å; M663-W690 HydrophobicContact CB-CE3 4.35Å; M663-W690 HydrophobicContact CE-CZ3 4.42Å; M663-W690 HydrophobicContact CG-CE3 3.93Å; M663-W690 HydrophobicContact CG-CZ3 4.21Å; V666-W690 HydrophobicContact CG1-CD2 4.17Å; V666-W690 HydrophobicContact CG1-CG 3.96Å; A667-W690 HydrophobicContact CB-CB 3.69Å; F670-W690 AromaticContact CD2-CD1 3.94Å; F670-W690 AromaticContact CE2-CD1 3.95Å; F670-W690 AromaticContact CE2-NE1 3.91Å; E686-W690 PolarHBondContact O-N 3.37Å; E686-W690 VanDerWaalsContact O-N 3.17Å; A687-W690 PolarHBondContact O-N 3.5Å; I688-W690 PolarHBondContact O-N 3.01Å; W690-A694 WeakPolarHBondContact O-CB 3.21Å; W690-A694 PolarHBondContact O-N 2.98Å
691	Y	94.1	Very high	83.7	Confident	5 Å²	5	61 Å²	61	2%	0.02	30%	0.298	C	S	.	.	H	α-helix	trans	-67.6	-49.8	170.7	-72.9	-48.6	0	0	0	111.6	I664 A667 R668 D671 A687 I688 S693 A694 L695 L717 R720 E721 M724	I664-Y691 HydrophobicContact CG2-CE1 4.49Å; A667-Y691 HydrophobicContact CB-CD1 3.39Å; A667-Y691 HydrophobicContact CB-CD2 3.96Å; A667-Y691 HydrophobicContact CB-CE1 3.42Å; A667-Y691 VanDerWaalsContact CB-CE1 3.42Å; A667-Y691 HydrophobicContact CB-CE2 4Å; A667-Y691 HydrophobicContact CB-CG 3.67Å; R668-Y691 HydrophobicContact CG-CE1 4.45Å; R668-Y691 WeakPolarHBondContact CG-OH 3.49Å; D671-Y691 HydrophobicContact CB-CE2 4.36Å; D671-Y691 PolarHBondContact OD2-OH 3.17Å; A687-Y691 HydrophobicContact CB-CE2 4.38Å; A687-Y691 WeakPolarHBondContact O-CD2 3.36Å; A687-Y691 PolarHBondContact O-N 3.43Å; I688-Y691 PolarHBondContact O-N 3.35Å; Y691-S693 VanDerWaalsContact C-N 3.31Å; Y691-S693 PolarHBondContact O-N 2.81Å; Y691-A694 CarbonylContact O-C 3.59Å; Y691-A694 WeakPolarHBondContact O-CA 3.33Å; Y691-A694 PolarHBondContact O-N 2.98Å; Y691-L695 WeakPolarHBondContact O-CB 3.22Å; Y691-L695 WeakPolarHBondContact O-CG 3.31Å; Y691-L695 PolarHBondContact O-N 3Å; Y691-L717 HydrophobicContact CD1-CD2 3.89Å; Y691-L717 HydrophobicContact CE1-CD2 3.89Å; Y691-R720 HydrophobicContact CE2-CG 4.23Å; Y691-E721 VanDerWaalsContact CB-OE1 3.29Å; Y691-E721 WeakPolarHBondContact CB-OE1 3.17Å; Y691-E721 HydrophobicContact CD2-CG 4.14Å; Y691-E721 HydrophobicContact CG-CG 4.33Å; Y691-M724 HydrophobicContact CE2-CE 3.89Å
692	D	92.3	Very high	81.4	Confident	72 Å²	72	63 Å²	63	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-43.1	174	177.8	85.7	0	0	0	111.4	I688 A694 L695 N696 E721	I688-D692 VanDerWaalsContact O-CB 3.23Å; I688-D692 WeakPolarHBondContact O-CB 2.93Å; I688-D692 PolarHBondContact O-N 2.84Å; D692-A694 PolarHBondContact O-N 3.03Å; D692-L695 PolarHBondContact O-N 2.98Å; D692-L695 VanDerWaalsContact O-N 3.14Å; D692-N696 VanDerWaalsContact O-CB 3.28Å; D692-N696 WeakPolarHBondContact O-CB 3.45Å; D692-N696 PolarHBondContact O-N 3.17Å; D692-N696 PolarHBondContact O-ND2 3.35Å; D692-N696 PolarHBondContact OD1-ND2 3.2Å; D692-N696 PolarHBondContact OD2-ND2 2.95Å; D692-E721 PolarHBondContact N-OE1 3.47Å; D692-E721 VanDerWaalsContact N-OE1 3.1Å
693	S	91.5	Very high	79	Confident	29 Å²	29	62.9 Å²	62.9	20%	0.203	33%	0.326	C	S	.	.	H	α-helix	trans	-57.5	-47	172.9	-65.6	0	0	0	0	112.1	H689 Y691 L695 N696 M697	H689-S693 VanDerWaalsContact O-CB 3.29Å; H689-S693 WeakPolarHBondContact O-CB 3.47Å; H689-S693 PolarHBondContact O-N 3.43Å; H689-S693 VanDerWaalsContact O-N 3.1Å; H689-S693 PolarHBondContact O-OG 3.17Å; Y691-S693 VanDerWaalsContact C-N 3.31Å; Y691-S693 PolarHBondContact O-N 2.81Å; S693-L695 VanDerWaalsContact C-N 3.28Å; S693-L695 PolarHBondContact O-N 3.33Å; S693-N696 PolarHBondContact O-N 2.94Å; S693-M697 WeakPolarHBondContact O-CG 3.48Å; S693-M697 PolarHBondContact O-N 3.25Å; S693-M697 VanDerWaalsContact O-N 3.08Å
694	A	89.6	Confident	76.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-71.1	-20.3	177.8	0	0	0	0	0	113.9	R660 M663 I664 W690 Y691 D692	R660-A694 HydrophobicContact CG-CB 4.25Å; R660-A694 PolarHBondContact NE-O 3.47Å; R660-A694 PolarHBondContact NH2-O 3.43Å; M663-A694 HydrophobicContact CB-CB 3.97Å; M663-A694 HydrophobicContact SD-CB 4.34Å; I664-A694 HydrophobicContact CD1-CB 4.28Å; I664-A694 HydrophobicContact CG1-CB 3.64Å; W690-A694 WeakPolarHBondContact O-CB 3.21Å; W690-A694 PolarHBondContact O-N 2.98Å; Y691-A694 CarbonylContact O-C 3.59Å; Y691-A694 WeakPolarHBondContact O-CA 3.33Å; Y691-A694 PolarHBondContact O-N 2.98Å; D692-A694 PolarHBondContact O-N 3.03Å
695	L	87.9	Confident	74	Confident	11 Å²	11	72 Å²	72	6%	0.058	38%	0.383	C	S	.	.	H	α-helix	trans	-85.6	-30.4	175.6	-78.9	166.5	0	0	0	112.9	Y691 D692 S693 R714 L717 L718 E721	Y691-L695 WeakPolarHBondContact O-CB 3.22Å; Y691-L695 WeakPolarHBondContact O-CG 3.31Å; Y691-L695 PolarHBondContact O-N 3Å; D692-L695 PolarHBondContact O-N 2.98Å; D692-L695 VanDerWaalsContact O-N 3.14Å; S693-L695 VanDerWaalsContact C-N 3.28Å; S693-L695 PolarHBondContact O-N 3.33Å; L695-R714 HydrophobicContact CD2-CB 4.19Å; L695-R714 HydrophobicContact CD2-CG 3.66Å; L695-R714 PolarHBondContact O-NH1 3.47Å; L695-L717 HydrophobicContact CD1-CB 4.09Å; L695-L717 HydrophobicContact CD2-CB 4.06Å; L695-L717 HydrophobicContact CD2-CD1 4.25Å; L695-L717 HydrophobicContact CG-CB 4.17Å; L695-L717 HydrophobicContact CG-CD1 4.31Å; L695-L718 HydrophobicContact CD1-CD2 3.84Å; L695-L718 HydrophobicContact CD1-CG 4.11Å; L695-L718 HydrophobicContact CD2-CD2 4.39Å; L695-L718 HydrophobicContact CD2-CG 4.06Å; L695-E721 WeakPolarHBondContact CD1-OE2 3.31Å
696	N	85.3	Confident	71.4	Confident	96 Å²	96	77 Å²	77	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-94.6	-13.6	-177.9	-70.5	-34.6	0	0	0	114	D692 S693 M698	D692-N696 VanDerWaalsContact O-CB 3.28Å; D692-N696 WeakPolarHBondContact O-CB 3.45Å; D692-N696 PolarHBondContact O-N 3.17Å; D692-N696 PolarHBondContact O-ND2 3.35Å; D692-N696 PolarHBondContact OD1-ND2 3.2Å; D692-N696 PolarHBondContact OD2-ND2 2.95Å; S693-N696 PolarHBondContact O-N 2.94Å; N696-M698 PolarHBondContact O-N 3.19Å
697	M	77.1	Confident	69.3	Low	45 Å²	45	77.1 Å²	77.1	22%	0.222	40%	0.4	C	S	.	.			trans	-69.1	102.2	165.2	-71.6	-159.9	-44.8	0	0	110.4	G658 R660 M663 S693 D699	G658-M697 WeakPolarHBondContact O-CE 3.23Å; R660-M697 HydrophobicContact CB-CE 3.53Å; R660-M697 HydrophobicContact CG-CE 3.85Å; M663-M697 HydrophobicContact CE-CE 3.73Å; M663-M697 HydrophobicContact CE-SD 3.6Å; M663-M697 VanDerWaalsContact CE-SD 3.6Å; M663-M697 HydrophobicContact SD-CE 3.54Å; M663-M697 VanDerWaalsContact SD-CE 3.54Å; M663-M697 HydrophobicContact SD-SD 4.1Å; S693-M697 WeakPolarHBondContact O-CG 3.48Å; S693-M697 PolarHBondContact O-N 3.25Å; S693-M697 VanDerWaalsContact O-N 3.08Å; M697-D699 PolarHBondContact O-N 3.04Å
698	M	55.4	Low	67.1	Low	150 Å²	150	78.8 Å²	78.8	74%	0.739	42%	0.417	S	S	*	.			trans	-75.4	66.5	175.2	-64.3	-174.9	69.2	0	0	111.3	N696 Y700	N696-M698 PolarHBondContact O-N 3.19Å; M698-Y700 HydrophobicContact CE-CD2 4.29Å; M698-Y700 HydrophobicContact CE-CE2 3.84Å; M698-Y700 PolarHBondContact O-N 2.99Å
699	D	52.4	Low	65	Low	90 Å²	90	78.5 Å²	78.5	48%	0.481	42%	0.416	S	S	.	.			trans	-72	73.6	172	-67.3	-26.2	0	0	0	110.3	R660 M697	R660-D699 WeakPolarHBondContact CD-OD2 3.34Å; M697-D699 PolarHBondContact O-N 3.04Å
700	Y	44.9	Very low	63.1	Low	193 Å²	193	81.1 Å²	81.1	76%	0.757	43%	0.428	S	S	*	.			trans	-84.5	105.1	151.8	-70.7	-74	0	0	0	107.3	M698	M698-Y700 HydrophobicContact CE-CD2 4.29Å; M698-Y700 HydrophobicContact CE-CE2 3.84Å; M698-Y700 PolarHBondContact O-N 2.99Å
701	D	46.8	Very low	61.6	Low	61 Å²	61	87.4 Å²	87.4	33%	0.326	46%	0.463	S	S	.	.			trans	-61.8	154.1	162.1	61.9	-57.6	0	0	0	110	G703 G704 E705 F706	D701-G703 PolarHBondContact O-N 3.07Å; D701-G704 VanDerWaalsContact CG-N 3.26Å; D701-G704 PolarHBondContact O-N 3.24Å; D701-G704 WeakPolarHBondContact OD1-CA 3.35Å; D701-G704 PolarHBondContact OD1-N 3.47Å; D701-G704 PolarHBondContact OD2-N 3.12Å; D701-E705 PolarHBondContact OD1-N 2.71Å; D701-E705 PolarHBondContact OD2-N 2.62Å; D701-F706 PolarHBondContact OD2-N 3.05Å
702	E	38.9	Very low	60.7	Low	220 Å²	220	88.3 Å²	88.3	100%	1.028	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-7.9	-178.5	-77.9	-172.7	127.1	0	0	113.9
703	G	43.7	Very low	60.4	Low	60 Å²	60	86.4 Å²	86.4	62%	0.619	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-25.8	170.9	0	0	0	0	0	115.5	D701 E705	D701-G703 PolarHBondContact O-N 3.07Å; G703-E705 VanDerWaalsContact C-N 3.33Å
704	G	44.4	Very low	60.3	Low	55 Å²	55	89.4 Å²	89.4	57%	0.567	47%	0.466	S	S	*	.	S	Bend	trans	70.8	22.7	-171.3	0	0	0	0	0	114.4	D701	D701-G704 VanDerWaalsContact CG-N 3.26Å; D701-G704 PolarHBondContact O-N 3.24Å; D701-G704 WeakPolarHBondContact OD1-CA 3.35Å; D701-G704 PolarHBondContact OD1-N 3.47Å; D701-G704 PolarHBondContact OD2-N 3.12Å
705	E	40.9	Very low	60.3	Low	176 Å²	176	90.5 Å²	90.5	82%	0.822	47%	0.47	S	S	*	.			trans	-108.5	-17.3	-172.7	-68.1	-166.9	148.5	0	0	114.1	D701 G703	D701-E705 PolarHBondContact OD1-N 2.71Å; D701-E705 PolarHBondContact OD2-N 2.62Å; G703-E705 VanDerWaalsContact C-N 3.33Å
706	F	41.5	Very low	60.5	Low	150 Å²	150	93.2 Å²	93.2	66%	0.658	49%	0.485	S	S	*	.			trans	-108.5	81.1	-179.3	-166.4	-99.9	0	0	0	113.3	D701 G708	D701-F706 PolarHBondContact OD2-N 3.05Å; F706-G708 PolarHBondContact O-N 2.82Å
707	D	48.4	Very low	60.8	Low	75 Å²	75	88.8 Å²	88.8	40%	0.401	46%	0.461	S	S	.	.			trans	-67.6	102.2	165.1	-177.6	4.3	0	0	0	110.4	T709 Q710	D707-T709 PolarHBondContact O-N 3.49Å; D707-T709 WeakPolarHBondContact OD1-CA 3.48Å; D707-T709 WeakPolarHBondContact OD1-CB 3.45Å; D707-T709 PolarHBondContact OD1-N 2.94Å; D707-T709 PolarHBondContact OD1-OG1 2.9Å; D707-T709 PolarHBondContact OD2-OG1 3.4Å; D707-Q710 WeakPolarHBondContact O-CG 3.37Å; D707-Q710 PolarHBondContact O-N 2.98Å
708	G	48.9	Very low	61.7	Low	34 Å²	34	86.8 Å²	86.8	35%	0.351	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	3.7	173.9	0	0	0	0	0	115.3	F706	F706-G708 PolarHBondContact O-N 2.82Å
709	T	51.8	Low	63.6	Low	8 Å²	8	79.8 Å²	79.8	5%	0.049	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	26.1	-179.4	69.9	0	0	0	0	114.4	R660 I664 D707 D711 E712	R660-T709 VanDerWaalsContact CZ-CG2 3.48Å; I664-T709 HydrophobicContact CD1-CG2 3.98Å; D707-T709 PolarHBondContact O-N 3.49Å; D707-T709 WeakPolarHBondContact OD1-CA 3.48Å; D707-T709 WeakPolarHBondContact OD1-CB 3.45Å; D707-T709 PolarHBondContact OD1-N 2.94Å; D707-T709 PolarHBondContact OD1-OG1 2.9Å; D707-T709 PolarHBondContact OD2-OG1 3.4Å; T709-D711 PolarHBondContact O-N 3.34Å; T709-E712 WeakPolarHBondContact CB-O 3.46Å; T709-E712 CarbonylContact O-C 3.52Å; T709-E712 VanDerWaalsContact O-C 3.22Å; T709-E712 PolarHBondContact O-N 2.91Å
710	Q	55.3	Low	65.6	Low	152 Å²	152	78.5 Å²	78.5	71%	0.71	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-32	-177.1	-58.3	-154.1	-3.4	0	0	115.1	D707	D707-Q710 WeakPolarHBondContact O-CG 3.37Å; D707-Q710 PolarHBondContact O-N 2.98Å
711	D	62.6	Low	68	Low	154 Å²	154	69.6 Å²	69.6	82%	0.824	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-20.2	175.1	-67	-47.7	0	0	0	114	T709	T709-D711 PolarHBondContact O-N 3.34Å
712	E	76.1	Confident	70.3	Confident	24 Å²	24	66.7 Å²	66.7	11%	0.112	36%	0.355	C	S	.	.	S	Bend	trans	-144.3	63.8	-169.9	-64.3	-164.4	-115.6	0	0	114	I664 R668 T709 L717	I664-E712 HydrophobicContact CG2-CB 4.5Å; I664-E712 HydrophobicContact CG2-CG 4.5Å; I664-E712 WeakPolarHBondContact CG2-OE1 3.25Å; R668-E712 IonicContact CZ-OE1 2.79Å; R668-E712 IonicContact CZ-OE2 3.85Å; R668-E712 IonicContact NE-OE1 2.73Å; R668-E712 PolarHBondContact NE-OE1 2.81Å; R668-E712 IonicContact NE-OE2 2.92Å; R668-E712 PolarHBondContact NE-OE2 2.74Å; R668-E712 IonicContact NH1-OE1 3.78Å; R668-E712 PolarHBondContact NH1-OE1 3.19Å; R668-E712 IonicContact NH2-OE1 2.7Å; R668-E712 PolarHBondContact NH2-OE1 3.47Å; R668-E712 IonicContact NH2-OE2 3.61Å; R668-E712 PolarHBondContact NH2-OE2 3.35Å; T709-E712 WeakPolarHBondContact CB-O 3.46Å; T709-E712 CarbonylContact O-C 3.52Å; T709-E712 VanDerWaalsContact O-C 3.22Å; T709-E712 PolarHBondContact O-N 2.91Å; E712-L717 HydrophobicContact CB-CD2 4.27Å
713	P	85.4	Confident	73	Confident	31 Å²	31	58.6 Å²	58.6	20%	0.201	32%	0.317	C	S	.	.			trans	-60.8	150.8	-177.4	24.6	-36.4	0	0	0	113.4	Y715 L716	P713-Y715 HydrophobicContact CB-CD1 4.14Å; P713-Y715 HydrophobicContact CB-CE1 3.76Å; P713-Y715 HydrophobicContact CG-CD1 4.25Å; P713-Y715 HydrophobicContact CG-CE1 3.55Å; P713-Y715 HydrophobicContact CG-CE2 4.17Å; P713-Y715 VanDerWaalsContact CG-CZ 3.48Å; P713-Y715 PolarHBondContact O-N 2.96Å; P713-L716 HydrophobicContact CG-CD1 4.35Å; P713-L716 HydrophobicContact CG-CG 4.42Å; P713-L716 PolarHBondContact O-N 3.49Å
714	R	88.3	Confident	75.5	Confident	93 Å²	93	55.8 Å²	55.8	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-35.8	-43.4	-175.6	171.3	163.5	-175.2	108.1	5.8	115.7	L695 L716 L717 L718 E745 A749	L695-R714 HydrophobicContact CD2-CB 4.19Å; L695-R714 HydrophobicContact CD2-CG 3.66Å; L695-R714 PolarHBondContact O-NH1 3.47Å; R714-L716 VanDerWaalsContact C-N 3.3Å; R714-L716 PolarHBondContact O-N 3.2Å; R714-L717 PolarHBondContact O-N 3.1Å; R714-L718 HydrophobicContact CG-CD1 3.6Å; R714-L718 HydrophobicContact CG-CG 4.22Å; R714-L718 WeakPolarHBondContact O-CG 3.29Å; R714-L718 PolarHBondContact O-N 3.4Å; R714-L718 VanDerWaalsContact O-N 3.12Å; R714-E745 IonicContact CZ-OE2 2.73Å; R714-E745 IonicContact NH2-OE2 2.92Å; R714-E745 PolarHBondContact NH2-OE2 3.33Å; R714-A749 HydrophobicContact CG-CB 4.17Å
715	Y	90.6	Very high	78	Confident	22 Å²	22	53.9 Å²	53.9	9%	0.086	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-25.4	-177.8	63.8	-104.1	0	0	0	114.4	P713 A719 A746 A750 A753 K755 L758 Y762	P713-Y715 HydrophobicContact CB-CD1 4.14Å; P713-Y715 HydrophobicContact CB-CE1 3.76Å; P713-Y715 HydrophobicContact CG-CD1 4.25Å; P713-Y715 HydrophobicContact CG-CE1 3.55Å; P713-Y715 HydrophobicContact CG-CE2 4.17Å; P713-Y715 VanDerWaalsContact CG-CZ 3.48Å; P713-Y715 PolarHBondContact O-N 2.96Å; Y715-A719 VanDerWaalsContact O-CB 3.25Å; Y715-A719 WeakPolarHBondContact O-CB 3.44Å; Y715-A719 PolarHBondContact O-N 3.5Å; Y715-A746 WeakPolarHBondContact CB-O 3.4Å; Y715-A750 HydrophobicContact CD1-CB 4.43Å; Y715-A750 HydrophobicContact CD2-CB 4.39Å; Y715-A750 HydrophobicContact CG-CB 4.03Å; Y715-A753 HydrophobicContact CD1-CB 3.86Å; Y715-A753 HydrophobicContact CE1-CB 3.62Å; Y715-K755 HydrophobicContact CE1-CG 3.92Å; Y715-K755 WeakPolarHBondContact OH-CE 3.15Å; Y715-L758 HydrophobicContact CD2-CD2 3.71Å; Y715-L758 HydrophobicContact CE2-CD2 3.44Å; Y715-L758 VanDerWaalsContact CE2-CD2 3.44Å; Y715-Y762 HydrophobicContact CD2-CE2 4.18Å
716	L	92	Very high	80.5	Confident	69 Å²	69	47.7 Å²	47.7	36%	0.361	24%	0.235	S	C	.	.	H	α-helix	trans	-76	-41.2	174.8	-66.8	-176.6	0	0	0	111.5	P713 R714 A719 R720	P713-L716 HydrophobicContact CG-CD1 4.35Å; P713-L716 HydrophobicContact CG-CG 4.42Å; P713-L716 PolarHBondContact O-N 3.49Å; R714-L716 VanDerWaalsContact C-N 3.3Å; R714-L716 PolarHBondContact O-N 3.2Å; L716-A719 PolarHBondContact O-N 3.43Å; L716-R720 WeakPolarHBondContact O-CB 3.44Å; L716-R720 PolarHBondContact O-N 3.34Å
717	L	92.3	Very high	83	Confident	2 Å²	2	47 Å²	47	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-51.1	-179.9	-56.1	-178.9	0	0	0	110.5	I664 Y691 L695 E712 R714 A719 R720 E721	I664-L717 HydrophobicContact CD1-CD1 4.06Å; I664-L717 HydrophobicContact CG1-CD1 4.24Å; I664-L717 HydrophobicContact CG2-CD2 4.14Å; Y691-L717 HydrophobicContact CD1-CD2 3.89Å; Y691-L717 HydrophobicContact CE1-CD2 3.89Å; L695-L717 HydrophobicContact CD1-CB 4.09Å; L695-L717 HydrophobicContact CD2-CB 4.06Å; L695-L717 HydrophobicContact CD2-CD1 4.25Å; L695-L717 HydrophobicContact CG-CB 4.17Å; L695-L717 HydrophobicContact CG-CD1 4.31Å; E712-L717 HydrophobicContact CB-CD2 4.27Å; R714-L717 PolarHBondContact O-N 3.1Å; L717-A719 VanDerWaalsContact C-N 3.31Å; L717-A719 PolarHBondContact O-N 2.82Å; L717-R720 WeakPolarHBondContact O-CB 3.34Å; L717-R720 PolarHBondContact O-N 3.15Å; L717-E721 PolarHBondContact O-N 2.96Å
718	L	94.4	Very high	85	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-56	-43.3	175.2	-71.6	167.5	0	0	0	112.5	L695 R714 R720 E721 A722 L742 E745 A746 A749	L695-L718 HydrophobicContact CD1-CD2 3.84Å; L695-L718 HydrophobicContact CD1-CG 4.11Å; L695-L718 HydrophobicContact CD2-CD2 4.39Å; L695-L718 HydrophobicContact CD2-CG 4.06Å; R714-L718 HydrophobicContact CG-CD1 3.6Å; R714-L718 HydrophobicContact CG-CG 4.22Å; R714-L718 WeakPolarHBondContact O-CG 3.29Å; R714-L718 PolarHBondContact O-N 3.4Å; R714-L718 VanDerWaalsContact O-N 3.12Å; L718-R720 VanDerWaalsContact C-N 3.29Å; L718-R720 PolarHBondContact O-N 3.15Å; L718-E721 PolarHBondContact O-N 2.99Å; L718-A722 WeakPolarHBondContact O-CB 3.42Å; L718-A722 PolarHBondContact O-N 2.57Å; L718-L742 HydrophobicContact CD2-CD2 3.83Å; L718-E745 HydrophobicContact CD1-CB 3.87Å; L718-E745 HydrophobicContact CD2-CB 4.34Å; L718-A746 HydrophobicContact CB-CB 3.81Å; L718-A749 HydrophobicContact CD1-CB 4.33Å
719	A	94.9	Very high	87.1	Confident	3 Å²	3	44.1 Å²	44.1	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-30.5	177.3	0	0	0	0	0	112.9	Y715 L716 L717 E723 F743 A746 Y762	Y715-A719 VanDerWaalsContact O-CB 3.25Å; Y715-A719 WeakPolarHBondContact O-CB 3.44Å; Y715-A719 PolarHBondContact O-N 3.5Å; L716-A719 PolarHBondContact O-N 3.43Å; L717-A719 VanDerWaalsContact C-N 3.31Å; L717-A719 PolarHBondContact O-N 2.82Å; A719-E723 WeakPolarHBondContact O-CG 3.37Å; A719-E723 PolarHBondContact O-N 3.01Å; A719-F743 HydrophobicContact CB-CE1 4.5Å; A719-F743 WeakPolarHBondContact O-CE1 3.48Å; A719-A746 HydrophobicContact CB-CB 3.99Å; A719-Y762 HydrophobicContact CB-CD1 4.01Å; A719-Y762 HydrophobicContact CB-CE1 3.36Å; A719-Y762 HydrophobicContact CB-CE2 4.07Å
720	R	95.2	Very high	89	Confident	63 Å²	63	48.1 Å²	48.1	24%	0.238	24%	0.239	C	C	.	.	H	α-helix	trans	-75.4	-40.4	176.8	-172.1	67	-164.8	131	10.5	111.9	D671 Y691 L716 L717 L718 A722 E723 M724	D671-R720 IonicContact OD1-CZ 3.71Å; D671-R720 IonicContact OD1-NE 3.81Å; D671-R720 PolarHBondContact OD1-NE 2.95Å; D671-R720 IonicContact OD1-NH2 2.68Å; D671-R720 PolarHBondContact OD1-NH2 3.42Å; D671-R720 WeakPolarHBondContact OD2-CG 3.39Å; D671-R720 IonicContact OD2-CZ 2.66Å; D671-R720 IonicContact OD2-NE 3.35Å; D671-R720 PolarHBondContact OD2-NE 2.93Å; D671-R720 IonicContact OD2-NH2 2.74Å; Y691-R720 HydrophobicContact CE2-CG 4.23Å; L716-R720 WeakPolarHBondContact O-CB 3.44Å; L716-R720 PolarHBondContact O-N 3.34Å; L717-R720 WeakPolarHBondContact O-CB 3.34Å; L717-R720 PolarHBondContact O-N 3.15Å; L718-R720 VanDerWaalsContact C-N 3.29Å; L718-R720 PolarHBondContact O-N 3.15Å; R720-A722 VanDerWaalsContact C-N 3.32Å; R720-E723 IonicContact CZ-OE2 2.94Å; R720-E723 IonicContact NH1-OE2 3.37Å; R720-E723 PolarHBondContact NH1-OE2 3.42Å; R720-E723 PolarHBondContact O-N 2.91Å; R720-M724 HydrophobicContact CG-CE 4.44Å; R720-M724 WeakPolarHBondContact O-CG 3.33Å; R720-M724 PolarHBondContact O-N 3.02Å
721	E	95.4	Very high	90.7	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.028	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-42.5	171.1	-65	-175	128.2	0	0	111.3	I688 Y691 D692 L695 L717 L718 E723 M724 F725 L742	I688-E721 HydrophobicContact CG1-CB 4.47Å; I688-E721 HydrophobicContact CG1-CG 4.23Å; Y691-E721 VanDerWaalsContact CB-OE1 3.29Å; Y691-E721 WeakPolarHBondContact CB-OE1 3.17Å; Y691-E721 HydrophobicContact CD2-CG 4.14Å; Y691-E721 HydrophobicContact CG-CG 4.33Å; D692-E721 PolarHBondContact N-OE1 3.47Å; D692-E721 VanDerWaalsContact N-OE1 3.1Å; L695-E721 WeakPolarHBondContact CD1-OE2 3.31Å; L717-E721 PolarHBondContact O-N 2.96Å; L718-E721 PolarHBondContact O-N 2.99Å; E721-E723 PolarHBondContact O-N 2.89Å; E721-M724 WeakPolarHBondContact O-CB 3.28Å; E721-M724 PolarHBondContact O-N 2.61Å; E721-F725 VanDerWaalsContact O-CD2 3.27Å; E721-F725 WeakPolarHBondContact O-CD2 3.32Å; E721-F725 PolarHBondContact O-N 3.03Å; E721-L742 HydrophobicContact CB-CD1 3.93Å
722	A	96	Very high	92.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-42.3	175	0	0	0	0	0	112.4	L718 R720 M724 F725 Q726 A739 L742 F743	L718-A722 WeakPolarHBondContact O-CB 3.42Å; L718-A722 PolarHBondContact O-N 2.57Å; R720-A722 VanDerWaalsContact C-N 3.32Å; A722-M724 PolarHBondContact O-N 3.25Å; A722-F725 PolarHBondContact O-N 2.94Å; A722-Q726 VanDerWaalsContact O-CB 3.28Å; A722-Q726 WeakPolarHBondContact O-CB 3.48Å; A722-Q726 PolarHBondContact O-N 3.15Å; A722-A739 WeakPolarHBondContact O-CB 3.26Å; A722-L742 HydrophobicContact CB-CB 3.67Å; A722-F743 HydrophobicContact CB-CB 4.4Å; A722-F743 HydrophobicContact CB-CD1 3.47Å; A722-F743 VanDerWaalsContact CB-CD1 3.47Å; A722-F743 HydrophobicContact CB-CD2 3.71Å; A722-F743 HydrophobicContact CB-CE1 3.43Å; A722-F743 VanDerWaalsContact CB-CE1 3.43Å; A722-F743 HydrophobicContact CB-CE2 3.69Å; A722-F743 HydrophobicContact CB-CG 3.58Å; A722-F743 HydrophobicContact CB-CZ 3.53Å
723	E	95.9	Very high	93	Very high	51 Å²	51	45.4 Å²	45.4	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-61	-41	173.3	-75.7	172.5	177	0	0	112.6	A719 R720 E721 Q726 E727 F743 K765	A719-E723 WeakPolarHBondContact O-CG 3.37Å; A719-E723 PolarHBondContact O-N 3.01Å; R720-E723 IonicContact CZ-OE2 2.94Å; R720-E723 IonicContact NH1-OE2 3.37Å; R720-E723 PolarHBondContact NH1-OE2 3.42Å; R720-E723 PolarHBondContact O-N 2.91Å; E721-E723 PolarHBondContact O-N 2.89Å; E723-Q726 PolarHBondContact O-N 3.39Å; E723-E727 PolarHBondContact O-N 3.06Å; E723-F743 HydrophobicContact CG-CE1 4.09Å; E723-F743 HydrophobicContact CG-CZ 3.8Å; E723-K765 IonicContact OE1-NZ 2.73Å; E723-K765 PolarHBondContact OE1-NZ 3.01Å
724	M	95.5	Very high	93.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-45	176.2	-69.2	178.6	175.6	0	0	112.4	D671 W684 A687 I688 Y691 R720 E721 A722 Q726 G728 L732	D671-M724 HydrophobicContact CB-CE 3.45Å; D671-M724 VanDerWaalsContact CB-CE 3.45Å; D671-M724 VanDerWaalsContact OD1-CE 3.23Å; D671-M724 WeakPolarHBondContact OD1-CE 3.35Å; D671-M724 WeakPolarHBondContact OD2-CE 3.28Å; W684-M724 HydrophobicContact CB-CG 4.48Å; W684-M724 HydrophobicContact CB-SD 4.01Å; W684-M724 HydrophobicContact CD2-CB 4.26Å; W684-M724 HydrophobicContact CD2-CG 3.88Å; W684-M724 HydrophobicContact CD2-SD 4.39Å; W684-M724 HydrophobicContact CE3-CB 4.03Å; W684-M724 HydrophobicContact CE3-CG 4.12Å; W684-M724 HydrophobicContact CG-CE 4.15Å; W684-M724 HydrophobicContact CG-CG 4.07Å; W684-M724 HydrophobicContact CG-SD 3.94Å; A687-M724 HydrophobicContact CB-CE 3.88Å; A687-M724 HydrophobicContact CB-SD 4.23Å; I688-M724 HydrophobicContact CD1-CB 3.95Å; I688-M724 HydrophobicContact CD1-SD 3.92Å; I688-M724 HydrophobicContact CG1-SD 3.72Å; Y691-M724 HydrophobicContact CE2-CE 3.89Å; R720-M724 HydrophobicContact CG-CE 4.44Å; R720-M724 WeakPolarHBondContact O-CG 3.33Å; R720-M724 PolarHBondContact O-N 3.02Å; E721-M724 WeakPolarHBondContact O-CB 3.28Å; E721-M724 PolarHBondContact O-N 2.61Å; A722-M724 PolarHBondContact O-N 3.25Å; M724-Q726 VanDerWaalsContact C-N 3.31Å; M724-Q726 PolarHBondContact O-N 3.3Å; M724-G728 PolarHBondContact O-N 3.29Å; M724-L732 HydrophobicContact CB-CD2 3.81Å; M724-L732 WeakPolarHBondContact O-CD2 3.39Å
725	F	96.4	Very high	93.8	Very high	15 Å²	15	45.1 Å²	45.1	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-30.8	176	-78.6	-66.3	0	0	0	112.5	I688 E721 A722 L732 A734 D735 K738 A739 L742	I688-F725 HydrophobicContact CD1-CD2 4.07Å; I688-F725 HydrophobicContact CD1-CE1 4.34Å; I688-F725 HydrophobicContact CD1-CE2 3.57Å; I688-F725 HydrophobicContact CD1-CZ 3.71Å; I688-F725 HydrophobicContact CG1-CE2 4.24Å; I688-F725 HydrophobicContact CG2-CE2 4.01Å; I688-F725 HydrophobicContact CG2-CZ 4.1Å; E721-F725 VanDerWaalsContact O-CD2 3.27Å; E721-F725 WeakPolarHBondContact O-CD2 3.32Å; E721-F725 PolarHBondContact O-N 3.03Å; A722-F725 PolarHBondContact O-N 2.94Å; F725-L732 HydrophobicContact CD1-CD1 4.35Å; F725-L732 HydrophobicContact CD1-CD2 4.06Å; F725-L732 HydrophobicContact CD1-CG 4.41Å; F725-L732 HydrophobicContact CE1-CD1 3.76Å; F725-L732 HydrophobicContact CE1-CD2 4.24Å; F725-L732 HydrophobicContact CE1-CG 4.3Å; F725-L732 HydrophobicContact CG-CD2 4.41Å; F725-L732 HydrophobicContact CZ-CD1 4.19Å; F725-A734 CarbonylContact O-C 3.59Å; F725-A734 VanDerWaalsContact O-CA 3.27Å; F725-A734 WeakPolarHBondContact O-CA 3.47Å; F725-D735 HydrophobicContact CD1-CB 3.86Å; F725-D735 PolarHBondContact O-N 2.77Å; F725-K738 HydrophobicContact CD1-CD 4.25Å; F725-K738 HydrophobicContact CD2-CD 4.04Å; F725-K738 HydrophobicContact CD2-CG 4.22Å; F725-K738 HydrophobicContact CE1-CD 3.93Å; F725-K738 HydrophobicContact CE2-CD 3.73Å; F725-K738 VanDerWaalsContact CE2-CE 3.49Å; F725-K738 HydrophobicContact CE2-CG 4.36Å; F725-K738 HydrophobicContact CG-CD 4.32Å; F725-K738 HydrophobicContact CG-CG 4.41Å; F725-K738 HydrophobicContact CZ-CD 3.68Å; F725-K738 VanDerWaalsContact CZ-NZ 3.26Å; F725-A739 HydrophobicContact CB-CB 3.96Å; F725-L742 HydrophobicContact CD2-CD1 3.6Å; F725-L742 HydrophobicContact CE2-CD1 3.94Å
726	Q	94.4	Very high	93.9	Very high	47 Å²	47	45.5 Å²	45.5	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-70.2	-43.3	176.6	-176.5	69.1	-6.2	0	0	112.4	A722 E723 M724 A739 F743 A769	A722-Q726 VanDerWaalsContact O-CB 3.28Å; A722-Q726 WeakPolarHBondContact O-CB 3.48Å; A722-Q726 PolarHBondContact O-N 3.15Å; E723-Q726 PolarHBondContact O-N 3.39Å; M724-Q726 VanDerWaalsContact C-N 3.31Å; M724-Q726 PolarHBondContact O-N 3.3Å; Q726-A739 HydrophobicContact CB-CB 3.9Å; Q726-F743 HydrophobicContact CB-CE2 4.45Å; Q726-A769 VanDerWaalsContact OE1-CB 3.23Å
727	E	94.1	Very high	94	Very high	135 Å²	135	46.1 Å²	46.1	63%	0.631	25%	0.252	S	S	*	.	H	α-helix	trans	-82.5	-46.8	-177.9	-68.9	-176.5	-177.7	0	0	112.6	W684 E723	W684-E727 HydrophobicContact CH2-CB 4.25Å; W684-E727 HydrophobicContact CZ3-CB 4.07Å; E723-E727 PolarHBondContact O-N 3.06Å
728	G	89.6	Confident	94.2	Very high	22 Å²	22	49.8 Å²	49.8	23%	0.227	27%	0.268	C	S	.	.			trans	67.9	151.6	-168.4	0	0	0	0	0	113.7	M724	M724-G728 PolarHBondContact O-N 3.29Å
729	G	92.3	Very high	94.2	Very high	27 Å²	27	49.7 Å²	49.7	28%	0.278	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	142.4	172.8	-174.1	0	0	0	0	0	112.2	N731 L732	G729-N731 PolarHBondContact O-N 3.49Å; G729-L732 PolarHBondContact N-O 2.91Å; G729-L732 WeakPolarHBondContact O-CA 3.48Å; G729-L732 VanDerWaalsContact O-CB 3.26Å; G729-L732 WeakPolarHBondContact O-CB 3.46Å; G729-L732 PolarHBondContact O-N 3Å
730	F	91.6	Very high	94.3	Very high	91 Å²	91	49.5 Å²	49.5	40%	0.399	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	56.7	173.2	-53.5	-79.9	0	0	0	113.4	Q682 D683 W684 L732	Q682-F730 HydrophobicContact CB-CD1 3.78Å; Q682-F730 HydrophobicContact CB-CE1 4.16Å; Q682-F730 HydrophobicContact CB-CG 4.44Å; Q682-F730 HydrophobicContact CG-CB 4.41Å; Q682-F730 HydrophobicContact CG-CD1 3.61Å; Q682-F730 HydrophobicContact CG-CD2 4.45Å; Q682-F730 HydrophobicContact CG-CE1 3.94Å; Q682-F730 HydrophobicContact CG-CG 3.9Å; Q682-F730 HydrophobicContact CG-CZ 4.48Å; D683-F730 CarbonylContact C-O 3.6Å; D683-F730 WeakPolarHBondContact CA-O 3.46Å; W684-F730 HydrophobicContact CB-CB 4.31Å; W684-F730 HydrophobicContact CD2-CB 4.19Å; W684-F730 AromaticContact CD2-CD2 3.76Å; W684-F730 HydrophobicContact CD2-CD2 3.76Å; W684-F730 HydrophobicContact CD2-CG 4.42Å; W684-F730 AromaticContact CE2-CD2 3.47Å; W684-F730 VanDerWaalsContact CE2-CD2 3.47Å; W684-F730 HydrophobicContact CE3-CD2 4.15Å; W684-F730 HydrophobicContact CG-CB 3.91Å; W684-F730 HydrophobicContact CG-CD2 4.3Å; W684-F730 HydrophobicContact CH2-CD2 4.08Å; W684-F730 HydrophobicContact CH2-CE2 4.23Å; W684-F730 AromaticContact CZ2-CD2 3.66Å; W684-F730 HydrophobicContact CZ2-CD2 3.66Å; W684-F730 AromaticContact CZ2-CE2 3.83Å; W684-F730 HydrophobicContact CZ2-CE2 3.83Å; W684-F730 HydrophobicContact CZ3-CD2 4.3Å; W684-F730 PolarHBondContact N-O 3.12Å; W684-F730 AromaticContact NE1-CD2 3.83Å; F730-L732 PolarHBondContact O-N 2.96Å; F730-L732 VanDerWaalsContact O-N 3.17Å
731	N	91.6	Very high	94.3	Very high	135 Å²	135	49.9 Å²	49.9	72%	0.722	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	-3.3	-174.8	-59.6	-24.9	0	0	0	117	D683 G729	D683-N731 PolarHBondContact OD2-ND2 3.07Å; G729-N731 PolarHBondContact O-N 3.49Å
732	L	94.3	Very high	94.4	Very high	25 Å²	25	50.4 Å²	50.4	13%	0.131	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-91.7	136.4	169.8	-167.1	75.4	0	0	0	111.8	W684 I688 M724 F725 G729 F730	W684-L732 HydrophobicContact CB-CB 3.79Å; W684-L732 HydrophobicContact CB-CD2 4.16Å; W684-L732 HydrophobicContact CE3-CD2 4.44Å; I688-L732 HydrophobicContact CD1-CD1 3.73Å; I688-L732 HydrophobicContact CD1-CD2 3.39Å; I688-L732 HydrophobicContact CD1-CG 4.19Å; M724-L732 HydrophobicContact CB-CD2 3.81Å; M724-L732 WeakPolarHBondContact O-CD2 3.39Å; F725-L732 HydrophobicContact CD1-CD1 4.35Å; F725-L732 HydrophobicContact CD1-CD2 4.06Å; F725-L732 HydrophobicContact CD1-CG 4.41Å; F725-L732 HydrophobicContact CE1-CD1 3.76Å; F725-L732 HydrophobicContact CE1-CD2 4.24Å; F725-L732 HydrophobicContact CE1-CG 4.3Å; F725-L732 HydrophobicContact CG-CD2 4.41Å; F725-L732 HydrophobicContact CZ-CD1 4.19Å; G729-L732 PolarHBondContact N-O 2.91Å; G729-L732 WeakPolarHBondContact O-CA 3.48Å; G729-L732 VanDerWaalsContact O-CB 3.26Å; G729-L732 WeakPolarHBondContact O-CB 3.46Å; G729-L732 PolarHBondContact O-N 3Å; F730-L732 PolarHBondContact O-N 2.96Å; F730-L732 VanDerWaalsContact O-N 3.17Å
733	T	93.7	Very high	94.5	Very high	114 Å²	114	50.6 Å²	50.6	70%	0.699	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-84.3	137.1	166.5	49.3	0	0	0	0	110.5
734	A	93.7	Very high	94.6	Very high	54 Å²	54	49.7 Å²	49.7	45%	0.446	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-59.5	139.6	171.1	0	0	0	0	0	111.1	F725	F725-A734 CarbonylContact O-C 3.59Å; F725-A734 VanDerWaalsContact O-CA 3.27Å; F725-A734 WeakPolarHBondContact O-CA 3.47Å
735	D	95.4	Very high	94.6	Very high	64 Å²	64	53.9 Å²	53.9	34%	0.342	29%	0.294	S	S	.	.			trans	-144.5	83.2	177.8	-174.8	-17.8	0	0	0	108.2	F725 Q737 K738 A739	F725-D735 HydrophobicContact CD1-CB 3.86Å; F725-D735 PolarHBondContact O-N 2.77Å; D735-Q737 PolarHBondContact O-N 3.45Å; D735-Q737 PolarHBondContact OD1-N 3.12Å; D735-K738 HydrophobicContact CB-CB 4.1Å; D735-K738 VanDerWaalsContact CG-CB 3.44Å; D735-K738 PolarHBondContact O-N 3.08Å; D735-K738 PolarHBondContact OD1-N 3.27Å; D735-K738 WeakPolarHBondContact OD2-CB 3.47Å; D735-A739 PolarHBondContact O-N 2.95Å
736	P	93.9	Very high	94.5	Very high	30 Å²	30	53.1 Å²	53.1	20%	0.195	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-21.7	-176.4	-21.5	33.8	0	0	0	113.4	G740 A769 L772 V773	P736-G740 PolarHBondContact O-N 3.47Å; P736-A769 VanDerWaalsContact CB-O 3.31Å; P736-A769 WeakPolarHBondContact CB-O 3.37Å; P736-L772 HydrophobicContact CB-CB 3.94Å; P736-L772 HydrophobicContact CG-CB 4.11Å; P736-V773 HydrophobicContact CB-CG2 3.9Å
737	Q	94.5	Very high	94.6	Very high	82 Å²	82	50.9 Å²	50.9	38%	0.383	28%	0.28	S	S	.	.	H	α-helix	trans	-65	-55.2	171.5	178	62.5	60.2	0	0	109.8	D735 A739 G740 D741 W770 V773	D735-Q737 PolarHBondContact O-N 3.45Å; D735-Q737 PolarHBondContact OD1-N 3.12Å; Q737-A739 VanDerWaalsContact C-N 3.26Å; Q737-A739 PolarHBondContact O-N 2.9Å; Q737-G740 PolarHBondContact O-N 2.91Å; Q737-D741 PolarHBondContact NE2-OD1 3.36Å; Q737-D741 PolarHBondContact NE2-OD2 3.03Å; Q737-D741 PolarHBondContact O-N 3.04Å; Q737-W770 VanDerWaalsContact NE2-NE1 3.13Å; Q737-W770 PolarHBondContact O-NE1 3.35Å; Q737-V773 HydrophobicContact CB-CG2 4.06Å
738	K	94.4	Very high	94.7	Very high	79 Å²	79	50.3 Å²	50.3	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-32.5	178.2	-172.5	174.1	177.3	-170.7	0	112.2	F725 D735 D741 L742	F725-K738 HydrophobicContact CD1-CD 4.25Å; F725-K738 HydrophobicContact CD2-CD 4.04Å; F725-K738 HydrophobicContact CD2-CG 4.22Å; F725-K738 HydrophobicContact CE1-CD 3.93Å; F725-K738 HydrophobicContact CE2-CD 3.73Å; F725-K738 VanDerWaalsContact CE2-CE 3.49Å; F725-K738 HydrophobicContact CE2-CG 4.36Å; F725-K738 HydrophobicContact CG-CD 4.32Å; F725-K738 HydrophobicContact CG-CG 4.41Å; F725-K738 HydrophobicContact CZ-CD 3.68Å; F725-K738 VanDerWaalsContact CZ-NZ 3.26Å; D735-K738 HydrophobicContact CB-CB 4.1Å; D735-K738 VanDerWaalsContact CG-CB 3.44Å; D735-K738 PolarHBondContact O-N 3.08Å; D735-K738 PolarHBondContact OD1-N 3.27Å; D735-K738 WeakPolarHBondContact OD2-CB 3.47Å; K738-D741 PolarHBondContact O-N 3.2Å; K738-L742 HydrophobicContact CG-CD1 4.02Å; K738-L742 HydrophobicContact CG-CG 4.36Å; K738-L742 WeakPolarHBondContact O-CB 3.29Å; K738-L742 WeakPolarHBondContact O-CG 3.05Å; K738-L742 PolarHBondContact O-N 3.11Å
739	A	95.9	Very high	94.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-46.6	172.9	0	0	0	0	0	112.3	A722 F725 Q726 D735 Q737 D741 L742 F743 A769	A722-A739 WeakPolarHBondContact O-CB 3.26Å; F725-A739 HydrophobicContact CB-CB 3.96Å; Q726-A739 HydrophobicContact CB-CB 3.9Å; D735-A739 PolarHBondContact O-N 2.95Å; Q737-A739 VanDerWaalsContact C-N 3.26Å; Q737-A739 PolarHBondContact O-N 2.9Å; A739-D741 VanDerWaalsContact C-N 3.35Å; A739-D741 PolarHBondContact O-N 3.38Å; A739-L742 PolarHBondContact O-N 3.19Å; A739-F743 HydrophobicContact CB-CE2 4.44Å; A739-F743 WeakPolarHBondContact O-CB 3.4Å; A739-F743 WeakPolarHBondContact O-CD2 3.34Å; A739-F743 WeakPolarHBondContact O-CG 3.47Å; A739-F743 PolarHBondContact O-N 3.03Å; A739-A769 HydrophobicContact CB-CB 4.08Å
740	G	96.1	Very high	94.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-38.7	177.1	0	0	0	0	0	113.2	P736 Q737 F743 T744 A766	P736-G740 PolarHBondContact O-N 3.47Å; Q737-G740 PolarHBondContact O-N 2.91Å; G740-F743 PolarHBondContact O-N 2.99Å; G740-T744 PolarHBondContact O-N 2.65Å; G740-T744 PolarHBondContact O-OG1 2.73Å; G740-A766 WeakPolarHBondContact O-CB 3.43Å
741	D	96.6	Very high	94.9	Very high	71 Å²	71	49.3 Å²	49.3	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-47.3	175.9	-58.4	-12.5	0	0	0	110.9	Q737 K738 A739 T744 E745 W770	Q737-D741 PolarHBondContact NE2-OD1 3.36Å; Q737-D741 PolarHBondContact NE2-OD2 3.03Å; Q737-D741 PolarHBondContact O-N 3.04Å; K738-D741 PolarHBondContact O-N 3.2Å; A739-D741 VanDerWaalsContact C-N 3.35Å; A739-D741 PolarHBondContact O-N 3.38Å; D741-T744 WeakPolarHBondContact O-CB 3.4Å; D741-T744 PolarHBondContact O-N 3.3Å; D741-E745 PolarHBondContact O-N 3.45Å; D741-W770 PolarHBondContact OD1-NE1 3.2Å
742	L	96.6	Very high	94.9	Very high	16 Å²	16	46.9 Å²	46.9	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-68.8	-35.9	177.7	-73.6	170.2	0	0	0	113.4	L718 E721 A722 F725 K738 A739 T744 E745 A746	L718-L742 HydrophobicContact CD2-CD2 3.83Å; E721-L742 HydrophobicContact CB-CD1 3.93Å; A722-L742 HydrophobicContact CB-CB 3.67Å; F725-L742 HydrophobicContact CD2-CD1 3.6Å; F725-L742 HydrophobicContact CE2-CD1 3.94Å; K738-L742 HydrophobicContact CG-CD1 4.02Å; K738-L742 HydrophobicContact CG-CG 4.36Å; K738-L742 WeakPolarHBondContact O-CB 3.29Å; K738-L742 WeakPolarHBondContact O-CG 3.05Å; K738-L742 PolarHBondContact O-N 3.11Å; A739-L742 PolarHBondContact O-N 3.19Å; L742-T744 VanDerWaalsContact C-N 3.25Å; L742-T744 PolarHBondContact O-N 3.4Å; L742-E745 PolarHBondContact O-N 3.45Å; L742-A746 WeakPolarHBondContact O-CB 3.47Å; L742-A746 PolarHBondContact O-N 3.2Å
743	F	98	Very high	94.6	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-32.9	171.2	-79	-51.2	0	0	0	111.6	A719 A722 E723 Q726 A739 G740 A746 A747 Y762 K765 A766 A769	A719-F743 HydrophobicContact CB-CE1 4.5Å; A719-F743 WeakPolarHBondContact O-CE1 3.48Å; A722-F743 HydrophobicContact CB-CB 4.4Å; A722-F743 HydrophobicContact CB-CD1 3.47Å; A722-F743 VanDerWaalsContact CB-CD1 3.47Å; A722-F743 HydrophobicContact CB-CD2 3.71Å; A722-F743 HydrophobicContact CB-CE1 3.43Å; A722-F743 VanDerWaalsContact CB-CE1 3.43Å; A722-F743 HydrophobicContact CB-CE2 3.69Å; A722-F743 HydrophobicContact CB-CG 3.58Å; A722-F743 HydrophobicContact CB-CZ 3.53Å; E723-F743 HydrophobicContact CG-CE1 4.09Å; E723-F743 HydrophobicContact CG-CZ 3.8Å; Q726-F743 HydrophobicContact CB-CE2 4.45Å; A739-F743 HydrophobicContact CB-CE2 4.44Å; A739-F743 WeakPolarHBondContact O-CB 3.4Å; A739-F743 WeakPolarHBondContact O-CD2 3.34Å; A739-F743 WeakPolarHBondContact O-CG 3.47Å; A739-F743 PolarHBondContact O-N 3.03Å; G740-F743 PolarHBondContact O-N 2.99Å; F743-A746 PolarHBondContact O-N 3.44Å; F743-A747 WeakPolarHBondContact O-CB 3.4Å; F743-A747 PolarHBondContact O-N 2.99Å; F743-Y762 HydrophobicContact CD1-CD1 4.28Å; F743-K765 HydrophobicContact CB-CB 4.42Å; F743-K765 HydrophobicContact CD1-CB 3.84Å; F743-K765 HydrophobicContact CD1-CD 4Å; F743-K765 HydrophobicContact CD2-CB 3.74Å; F743-K765 HydrophobicContact CE1-CB 4Å; F743-K765 HydrophobicContact CE1-CD 3.4Å; F743-K765 VanDerWaalsContact CE1-CD 3.4Å; F743-K765 HydrophobicContact CE1-CG 4.37Å; F743-K765 HydrophobicContact CE2-CB 3.9Å; F743-K765 HydrophobicContact CE2-CD 4.2Å; F743-K765 HydrophobicContact CG-CB 3.74Å; F743-K765 HydrophobicContact CZ-CB 4.05Å; F743-K765 HydrophobicContact CZ-CD 3.54Å; F743-K765 HydrophobicContact CZ-CG 4.43Å; F743-A766 HydrophobicContact CB-CB 3.81Å; F743-A769 HydrophobicContact CD2-CB 4.28Å
744	T	97.2	Very high	94.5	Very high	32 Å²	32	50.8 Å²	50.8	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-67.9	-47.2	174.6	-58.2	0	0	0	0	111.1	G740 D741 L742 A746 A747 E748 Y763 A766 W770	G740-T744 PolarHBondContact O-N 2.65Å; G740-T744 PolarHBondContact O-OG1 2.73Å; D741-T744 WeakPolarHBondContact O-CB 3.4Å; D741-T744 PolarHBondContact O-N 3.3Å; L742-T744 VanDerWaalsContact C-N 3.25Å; L742-T744 PolarHBondContact O-N 3.4Å; T744-A746 VanDerWaalsContact C-N 3.31Å; T744-A746 PolarHBondContact O-N 3.49Å; T744-A747 WeakPolarHBondContact O-CB 3.35Å; T744-A747 PolarHBondContact O-N 3.32Å; T744-A747 VanDerWaalsContact O-N 3.11Å; T744-E748 PolarHBondContact O-N 3.41Å; T744-Y763 HydrophobicContact CG2-CE1 4.32Å; T744-A766 WeakPolarHBondContact OG1-CB 3.38Å; T744-W770 WeakPolarHBondContact OG1-CH2 3.2Å
745	E	96.1	Very high	94.4	Very high	88 Å²	88	53.1 Å²	53.1	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-40.4	172.2	-77.9	-160.3	-134.5	0	0	112.4	R714 L718 D741 L742 A747 E748 A749	R714-E745 IonicContact CZ-OE2 2.73Å; R714-E745 IonicContact NH2-OE2 2.92Å; R714-E745 PolarHBondContact NH2-OE2 3.33Å; L718-E745 HydrophobicContact CD1-CB 3.87Å; L718-E745 HydrophobicContact CD2-CB 4.34Å; D741-E745 PolarHBondContact O-N 3.45Å; L742-E745 PolarHBondContact O-N 3.45Å; E745-A747 VanDerWaalsContact C-N 3.3Å; E745-A747 PolarHBondContact O-N 2.9Å; E745-E748 PolarHBondContact O-N 3.25Å; E745-A749 VanDerWaalsContact O-CB 3.31Å; E745-A749 WeakPolarHBondContact O-CB 3.34Å; E745-A749 PolarHBondContact O-N 3.32Å
746	A	95.4	Very high	94.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-38.1	175.3	0	0	0	0	0	111.7	Y715 L718 A719 L742 F743 T744 A750 Y762	Y715-A746 WeakPolarHBondContact CB-O 3.4Å; L718-A746 HydrophobicContact CB-CB 3.81Å; A719-A746 HydrophobicContact CB-CB 3.99Å; L742-A746 WeakPolarHBondContact O-CB 3.47Å; L742-A746 PolarHBondContact O-N 3.2Å; F743-A746 PolarHBondContact O-N 3.44Å; T744-A746 VanDerWaalsContact C-N 3.31Å; T744-A746 PolarHBondContact O-N 3.49Å; A746-A750 WeakPolarHBondContact O-CB 3.36Å; A746-A750 PolarHBondContact O-N 2.95Å; A746-Y762 HydrophobicContact CB-CD2 3.82Å; A746-Y762 HydrophobicContact CB-CE2 4.18Å; A746-Y762 HydrophobicContact CB-CG 4.15Å
747	A	96.6	Very high	94.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-43.8	176.2	0	0	0	0	0	112.2	F743 T744 E745 A750 M751 A759 Y763	F743-A747 WeakPolarHBondContact O-CB 3.4Å; F743-A747 PolarHBondContact O-N 2.99Å; T744-A747 WeakPolarHBondContact O-CB 3.35Å; T744-A747 PolarHBondContact O-N 3.32Å; T744-A747 VanDerWaalsContact O-N 3.11Å; E745-A747 VanDerWaalsContact C-N 3.3Å; E745-A747 PolarHBondContact O-N 2.9Å; A747-A750 PolarHBondContact O-N 3.07Å; A747-M751 WeakPolarHBondContact O-CG 3.25Å; A747-M751 PolarHBondContact O-N 3.47Å; A747-A759 VanDerWaalsContact O-CB 3.27Å; A747-A759 WeakPolarHBondContact O-CB 3.48Å; A747-Y763 HydrophobicContact CB-CD1 3.64Å; A747-Y763 HydrophobicContact CB-CD2 3.71Å; A747-Y763 HydrophobicContact CB-CE1 3.57Å; A747-Y763 HydrophobicContact CB-CE2 3.64Å; A747-Y763 HydrophobicContact CB-CG 3.7Å
748	E	95.3	Very high	94.3	Very high	122 Å²	122	58.8 Å²	58.8	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-64.2	-46.1	175.2	-69.4	-166.4	167.6	0	0	111.9	T744 E745 A750 M751 A752	T744-E748 PolarHBondContact O-N 3.41Å; E745-E748 PolarHBondContact O-N 3.25Å; E748-A750 VanDerWaalsContact C-N 3.31Å; E748-A750 PolarHBondContact O-N 2.8Å; E748-M751 WeakPolarHBondContact O-CB 3.38Å; E748-M751 PolarHBondContact O-N 3.27Å; E748-M751 VanDerWaalsContact O-N 3.14Å; E748-A752 PolarHBondContact O-N 2.73Å
749	A	91.6	Very high	94.3	Very high	21 Å²	21	55 Å²	55	17%	0.174	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-37	175.5	0	0	0	0	0	112.2	R714 L718 E745 A752 A753	R714-A749 HydrophobicContact CG-CB 4.17Å; L718-A749 HydrophobicContact CD1-CB 4.33Å; E745-A749 VanDerWaalsContact O-CB 3.31Å; E745-A749 WeakPolarHBondContact O-CB 3.34Å; E745-A749 PolarHBondContact O-N 3.32Å; A749-A752 PolarHBondContact O-N 2.86Å; A749-A753 WeakPolarHBondContact O-CB 3.35Å; A749-A753 PolarHBondContact O-N 2.59Å
750	A	93.1	Very high	94.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.2	-36.4	173.4	0	0	0	0	0	112.3	Y715 A746 A747 E748 A753 M754 K755 A759 Y762	Y715-A750 HydrophobicContact CD1-CB 4.43Å; Y715-A750 HydrophobicContact CD2-CB 4.39Å; Y715-A750 HydrophobicContact CG-CB 4.03Å; A746-A750 WeakPolarHBondContact O-CB 3.36Å; A746-A750 PolarHBondContact O-N 2.95Å; A747-A750 PolarHBondContact O-N 3.07Å; E748-A750 VanDerWaalsContact C-N 3.31Å; E748-A750 PolarHBondContact O-N 2.8Å; A750-A753 CarbonylContact O-C 3.58Å; A750-A753 PolarHBondContact O-N 3.15Å; A750-M754 PolarHBondContact O-N 3.22Å; A750-K755 HydrophobicContact CB-CB 4.28Å; A750-K755 WeakPolarHBondContact O-CA 3.2Å; A750-K755 WeakPolarHBondContact O-CB 3.42Å; A750-K755 PolarHBondContact O-N 3.28Å; A750-A759 HydrophobicContact CB-CB 3.87Å; A750-Y762 HydrophobicContact CB-CD2 4.19Å; A750-Y762 HydrophobicContact CB-CE2 4.29Å
751	M	93.8	Very high	94.3	Very high	98 Å²	98	65.3 Å²	65.3	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-45.2	172	-76.3	-62.9	-75.7	0	0	111.7	A747 E748 A753 M754 A759 Y763	A747-M751 WeakPolarHBondContact O-CG 3.25Å; A747-M751 PolarHBondContact O-N 3.47Å; E748-M751 WeakPolarHBondContact O-CB 3.38Å; E748-M751 PolarHBondContact O-N 3.27Å; E748-M751 VanDerWaalsContact O-N 3.14Å; M751-A753 VanDerWaalsContact C-N 3.31Å; M751-A753 PolarHBondContact O-N 2.98Å; M751-M754 WeakPolarHBondContact O-CA 3.46Å; M751-M754 PolarHBondContact O-N 3.33Å; M751-A759 HydrophobicContact CB-CB 4.5Å; M751-A759 HydrophobicContact CG-CB 3.53Å; M751-A759 HydrophobicContact SD-CB 3.69Å; M751-Y763 HydrophobicContact CG-CE2 4.46Å
752	A	90.3	Very high	94.4	Very high	84 Å²	84	62.9 Å²	62.9	69%	0.694	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-41.1	176.5	0	0	0	0	0	111.8	E748 A749 M754	E748-A752 PolarHBondContact O-N 2.73Å; A749-A752 PolarHBondContact O-N 2.86Å; A752-M754 PolarHBondContact O-N 3.1Å; A752-M754 VanDerWaalsContact O-N 3.14Å
753	A	88.9	Confident	94.4	Very high	43 Å²	43	66.3 Å²	66.3	36%	0.355	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	13.1	172.9	0	0	0	0	0	114.6	Y715 A749 A750 M751 K755	Y715-A753 HydrophobicContact CD1-CB 3.86Å; Y715-A753 HydrophobicContact CE1-CB 3.62Å; A749-A753 WeakPolarHBondContact O-CB 3.35Å; A749-A753 PolarHBondContact O-N 2.59Å; A750-A753 CarbonylContact O-C 3.58Å; A750-A753 PolarHBondContact O-N 3.15Å; M751-A753 VanDerWaalsContact C-N 3.31Å; M751-A753 PolarHBondContact O-N 2.98Å; A753-K755 HydrophobicContact CB-CG 4.05Å; A753-K755 WeakPolarHBondContact O-CG 3.44Å; A753-K755 PolarHBondContact O-N 3.47Å; A753-K755 VanDerWaalsContact O-N 3.12Å
754	M	92.1	Very high	94.3	Very high	179 Å²	179	71.8 Å²	71.8	88%	0.882	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	17.8	-178.1	-54.2	-170.6	-176.2	0	0	115.5	A750 M751 A752 G756	A750-M754 PolarHBondContact O-N 3.22Å; M751-M754 WeakPolarHBondContact O-CA 3.46Å; M751-M754 PolarHBondContact O-N 3.33Å; A752-M754 PolarHBondContact O-N 3.1Å; A752-M754 VanDerWaalsContact O-N 3.14Å; M754-G756 VanDerWaalsContact C-N 3.26Å; M754-G756 PolarHBondContact O-N 2.85Å; M754-G756 VanDerWaalsContact O-N 3.16Å
755	K	91.6	Very high	94.3	Very high	102 Å²	102	73.5 Å²	73.5	44%	0.443	37%	0.369	S	S	.	.			trans	-87.1	42.7	179.5	-49.2	-63.7	178.7	167.5	0	112.2	Y715 A750 A753 R757 L758 A759	Y715-K755 HydrophobicContact CE1-CG 3.92Å; Y715-K755 WeakPolarHBondContact OH-CE 3.15Å; A750-K755 HydrophobicContact CB-CB 4.28Å; A750-K755 WeakPolarHBondContact O-CA 3.2Å; A750-K755 WeakPolarHBondContact O-CB 3.42Å; A750-K755 PolarHBondContact O-N 3.28Å; A753-K755 HydrophobicContact CB-CG 4.05Å; A753-K755 WeakPolarHBondContact O-CG 3.44Å; A753-K755 PolarHBondContact O-N 3.47Å; A753-K755 VanDerWaalsContact O-N 3.12Å; K755-R757 PolarHBondContact O-N 2.92Å; K755-L758 HydrophobicContact CB-CB 4.15Å; K755-L758 WeakPolarHBondContact O-CA 3.32Å; K755-L758 WeakPolarHBondContact O-CB 3.46Å; K755-L758 PolarHBondContact O-N 3.07Å; K755-A759 PolarHBondContact O-N 2.78Å; K755-A759 VanDerWaalsContact O-N 3.12Å
756	G	92	Very high	94.3	Very high	26 Å²	26	69.3 Å²	69.3	27%	0.268	35%	0.349	S	S	.	.	H	α-helix	trans	-55.3	-23.8	-167.9	0	0	0	0	0	117	M754 N760	M754-G756 VanDerWaalsContact C-N 3.26Å; M754-G756 PolarHBondContact O-N 2.85Å; M754-G756 VanDerWaalsContact O-N 3.16Å; G756-N760 VanDerWaalsContact O-CG 3.31Å; G756-N760 PolarHBondContact O-N 2.72Å; G756-N760 PolarHBondContact O-OD1 3.19Å
757	R	94.9	Very high	94.3	Very high	226 Å²	226	75.8 Å²	75.8	85%	0.853	38%	0.38	S	S	*	.	H	α-helix	trans	-68.5	-37.9	170.8	-70.6	-172.8	-176.9	174.3	2	113.2	K755 Q761	K755-R757 PolarHBondContact O-N 2.92Å; R757-Q761 PolarHBondContact O-N 3.04Å
758	L	93.5	Very high	94.2	Very high	44 Å²	44	81.2 Å²	81.2	23%	0.23	41%	0.405	C	S	.	.	H	α-helix	trans	-75.6	-39.5	178.1	-177.3	64.1	0	0	0	110.4	Y715 K755 N760 Q761 Y762	Y715-L758 HydrophobicContact CD2-CD2 3.71Å; Y715-L758 HydrophobicContact CE2-CD2 3.44Å; Y715-L758 VanDerWaalsContact CE2-CD2 3.44Å; K755-L758 HydrophobicContact CB-CB 4.15Å; K755-L758 WeakPolarHBondContact O-CA 3.32Å; K755-L758 WeakPolarHBondContact O-CB 3.46Å; K755-L758 PolarHBondContact O-N 3.07Å; L758-N760 VanDerWaalsContact C-N 3.32Å; L758-N760 PolarHBondContact O-N 3.03Å; L758-Q761 WeakPolarHBondContact O-CA 3.46Å; L758-Q761 WeakPolarHBondContact O-CB 3.34Å; L758-Q761 PolarHBondContact O-N 2.98Å; L758-Y762 HydrophobicContact CD1-CE1 4.13Å; L758-Y762 HydrophobicContact CD1-CE2 4.04Å; L758-Y762 HydrophobicContact CD2-CE2 3.87Å; L758-Y762 HydrophobicContact CG-CD2 4.17Å; L758-Y762 HydrophobicContact CG-CE2 3.54Å; L758-Y762 PolarHBondContact O-N 3.13Å
759	A	95.2	Very high	94.1	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-55.3	-45.7	172	0	0	0	0	0	112.5	A747 A750 M751 K755 Q761 Y762 Y763	A747-A759 VanDerWaalsContact O-CB 3.27Å; A747-A759 WeakPolarHBondContact O-CB 3.48Å; A750-A759 HydrophobicContact CB-CB 3.87Å; M751-A759 HydrophobicContact CB-CB 4.5Å; M751-A759 HydrophobicContact CG-CB 3.53Å; M751-A759 HydrophobicContact SD-CB 3.69Å; K755-A759 PolarHBondContact O-N 2.78Å; K755-A759 VanDerWaalsContact O-N 3.12Å; A759-Q761 PolarHBondContact O-N 2.92Å; A759-Y762 PolarHBondContact O-N 3.09Å; A759-Y762 VanDerWaalsContact O-N 3.11Å; A759-Y763 HydrophobicContact CB-CE2 4.43Å; A759-Y763 VanDerWaalsContact O-CD2 3.24Å; A759-Y763 WeakPolarHBondContact O-CD2 3.45Å; A759-Y763 PolarHBondContact O-N 3.35Å
760	N	95.8	Very high	94.2	Very high	98 Å²	98	78 Å²	78	52%	0.524	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-29.7	175.3	-71	3.6	0	0	0	113.2	G756 L758 M764	G756-N760 VanDerWaalsContact O-CG 3.31Å; G756-N760 PolarHBondContact O-N 2.72Å; G756-N760 PolarHBondContact O-OD1 3.19Å; L758-N760 VanDerWaalsContact C-N 3.32Å; L758-N760 PolarHBondContact O-N 3.03Å; N760-M764 WeakPolarHBondContact O-CG 3.48Å; N760-M764 PolarHBondContact O-N 3.31Å
761	Q	96.6	Very high	94.1	Very high	118 Å²	118	80.8 Å²	80.8	55%	0.551	41%	0.406	S	S	*	.	H	α-helix	trans	-73.4	-38.1	174.3	-67.5	172.6	-39.3	0	0	111.5	R757 L758 A759 M764 K765	R757-Q761 PolarHBondContact O-N 3.04Å; L758-Q761 WeakPolarHBondContact O-CA 3.46Å; L758-Q761 WeakPolarHBondContact O-CB 3.34Å; L758-Q761 PolarHBondContact O-N 2.98Å; A759-Q761 PolarHBondContact O-N 2.92Å; Q761-M764 PolarHBondContact O-N 3.06Å; Q761-K765 PolarHBondContact O-N 2.89Å
762	Y	97.5	Very high	93.7	Very high	19 Å²	19	80.4 Å²	80.4	8%	0.075	41%	0.406	C	S	.	.	H	α-helix	trans	-70.1	-38.8	174.8	-62.6	-35.3	0	0	0	112.6	Y715 A719 F743 A746 A750 L758 A759 M764 K765 A766	Y715-Y762 HydrophobicContact CD2-CE2 4.18Å; A719-Y762 HydrophobicContact CB-CD1 4.01Å; A719-Y762 HydrophobicContact CB-CE1 3.36Å; A719-Y762 HydrophobicContact CB-CE2 4.07Å; F743-Y762 HydrophobicContact CD1-CD1 4.28Å; A746-Y762 HydrophobicContact CB-CD2 3.82Å; A746-Y762 HydrophobicContact CB-CE2 4.18Å; A746-Y762 HydrophobicContact CB-CG 4.15Å; A750-Y762 HydrophobicContact CB-CD2 4.19Å; A750-Y762 HydrophobicContact CB-CE2 4.29Å; L758-Y762 HydrophobicContact CD1-CE1 4.13Å; L758-Y762 HydrophobicContact CD1-CE2 4.04Å; L758-Y762 HydrophobicContact CD2-CE2 3.87Å; L758-Y762 HydrophobicContact CG-CD2 4.17Å; L758-Y762 HydrophobicContact CG-CE2 3.54Å; L758-Y762 PolarHBondContact O-N 3.13Å; A759-Y762 PolarHBondContact O-N 3.09Å; A759-Y762 VanDerWaalsContact O-N 3.11Å; Y762-M764 VanDerWaalsContact C-N 3.3Å; Y762-M764 PolarHBondContact O-N 2.85Å; Y762-K765 CarbonylContact O-C 3.49Å; Y762-K765 PolarHBondContact O-N 2.74Å; Y762-K765 VanDerWaalsContact O-N 3.15Å; Y762-A766 PolarHBondContact O-N 2.66Å
763	Y	97.6	Very high	93.4	Very high	88 Å²	88	79.7 Å²	79.7	35%	0.345	39%	0.392	S	S	.	.	H	α-helix	trans	-59.5	-39.4	169.9	-73.3	-58.3	0	0	0	112.2	T744 A747 M751 A759 A766 E767	T744-Y763 HydrophobicContact CG2-CE1 4.32Å; A747-Y763 HydrophobicContact CB-CD1 3.64Å; A747-Y763 HydrophobicContact CB-CD2 3.71Å; A747-Y763 HydrophobicContact CB-CE1 3.57Å; A747-Y763 HydrophobicContact CB-CE2 3.64Å; A747-Y763 HydrophobicContact CB-CG 3.7Å; M751-Y763 HydrophobicContact CG-CE2 4.46Å; A759-Y763 HydrophobicContact CB-CE2 4.43Å; A759-Y763 VanDerWaalsContact O-CD2 3.24Å; A759-Y763 WeakPolarHBondContact O-CD2 3.45Å; A759-Y763 PolarHBondContact O-N 3.35Å; Y763-A766 PolarHBondContact O-N 3.12Å; Y763-E767 WeakPolarHBondContact O-CG 3.48Å; Y763-E767 PolarHBondContact O-N 3.09Å
764	M	96.4	Very high	92	Very high	120 Å²	120	86.3 Å²	86.3	59%	0.591	42%	0.416	S	S	*	.	H	α-helix	trans	-63.8	-43.5	173	-73.7	178.1	62.1	0	0	112.1	N760 Q761 Y762 A766 E767 E768	N760-M764 WeakPolarHBondContact O-CG 3.48Å; N760-M764 PolarHBondContact O-N 3.31Å; Q761-M764 PolarHBondContact O-N 3.06Å; Y762-M764 VanDerWaalsContact C-N 3.3Å; Y762-M764 PolarHBondContact O-N 2.85Å; M764-A766 VanDerWaalsContact C-N 3.27Å; M764-A766 PolarHBondContact O-N 3.07Å; M764-E767 PolarHBondContact O-N 2.95Å; M764-E768 WeakPolarHBondContact O-CG 3.34Å; M764-E768 PolarHBondContact O-N 3.17Å
765	K	96.3	Very high	90.1	Very high	67 Å²	67	89 Å²	89	29%	0.291	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-31.5	174.3	-74.9	-161.7	173.6	-158.5	0	113.2	E723 F743 Q761 Y762 E768 A769	E723-K765 IonicContact OE1-NZ 2.73Å; E723-K765 PolarHBondContact OE1-NZ 3.01Å; F743-K765 HydrophobicContact CB-CB 4.42Å; F743-K765 HydrophobicContact CD1-CB 3.84Å; F743-K765 HydrophobicContact CD1-CD 4Å; F743-K765 HydrophobicContact CD2-CB 3.74Å; F743-K765 HydrophobicContact CE1-CB 4Å; F743-K765 HydrophobicContact CE1-CD 3.4Å; F743-K765 VanDerWaalsContact CE1-CD 3.4Å; F743-K765 HydrophobicContact CE1-CG 4.37Å; F743-K765 HydrophobicContact CE2-CB 3.9Å; F743-K765 HydrophobicContact CE2-CD 4.2Å; F743-K765 HydrophobicContact CG-CB 3.74Å; F743-K765 HydrophobicContact CZ-CB 4.05Å; F743-K765 HydrophobicContact CZ-CD 3.54Å; F743-K765 HydrophobicContact CZ-CG 4.43Å; Q761-K765 PolarHBondContact O-N 2.89Å; Y762-K765 CarbonylContact O-C 3.49Å; Y762-K765 PolarHBondContact O-N 2.74Å; Y762-K765 VanDerWaalsContact O-N 3.15Å; K765-E768 PolarHBondContact O-N 2.74Å; K765-A769 WeakPolarHBondContact O-CB 3.37Å; K765-A769 PolarHBondContact O-N 3.19Å
766	A	95.8	Very high	90.1	Very high	1 Å²	1	88.3 Å²	88.3	1%	0.008	43%	0.425	C	S	.	.	H	α-helix	trans	-66.4	-47	176.8	0	0	0	0	0	111.9	G740 F743 T744 Y762 Y763 M764 E768 A769 W770	G740-A766 WeakPolarHBondContact O-CB 3.43Å; F743-A766 HydrophobicContact CB-CB 3.81Å; T744-A766 WeakPolarHBondContact OG1-CB 3.38Å; Y762-A766 PolarHBondContact O-N 2.66Å; Y763-A766 PolarHBondContact O-N 3.12Å; M764-A766 VanDerWaalsContact C-N 3.27Å; M764-A766 PolarHBondContact O-N 3.07Å; A766-E768 VanDerWaalsContact C-N 3.35Å; A766-E768 PolarHBondContact O-N 2.85Å; A766-A769 PolarHBondContact O-N 3.28Å; A766-A769 VanDerWaalsContact O-N 3.15Å; A766-W770 HydrophobicContact CB-CE3 4.43Å; A766-W770 HydrophobicContact CB-CH2 4.33Å; A766-W770 HydrophobicContact CB-CZ3 4.14Å; A766-W770 PolarHBondContact O-N 2.7Å
767	E	95.1	Very high	90	Very high	136 Å²	136	91.6 Å²	91.6	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-62.8	-40.4	173.8	-59.8	-78.9	155.1	0	0	111.4	Y763 M764 A769 A771	Y763-E767 WeakPolarHBondContact O-CG 3.48Å; Y763-E767 PolarHBondContact O-N 3.09Å; M764-E767 PolarHBondContact O-N 2.95Å; E767-A769 VanDerWaalsContact C-N 3.27Å; E767-A769 PolarHBondContact O-N 2.79Å; E767-A771 VanDerWaalsContact O-CB 3.28Å; E767-A771 WeakPolarHBondContact O-CB 3.28Å; E767-A771 PolarHBondContact O-N 2.92Å
768	E	94.4	Very high	89.7	Confident	114 Å²	114	84.1 Å²	84.1	53%	0.533	41%	0.41	S	S	.	.	H	α-helix	trans	-64.1	-27.8	173.7	-72.8	171.3	-173.6	0	0	113.2	M764 K765 A766	M764-E768 WeakPolarHBondContact O-CG 3.34Å; M764-E768 PolarHBondContact O-N 3.17Å; K765-E768 PolarHBondContact O-N 2.74Å; A766-E768 VanDerWaalsContact C-N 3.35Å; A766-E768 PolarHBondContact O-N 2.85Å
769	A	93.1	Very high	89.5	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-80.1	-50.7	176.8	0	0	0	0	0	112.3	Q726 P736 A739 F743 K765 A766 E767 A771 L772	Q726-A769 VanDerWaalsContact OE1-CB 3.23Å; P736-A769 VanDerWaalsContact CB-O 3.31Å; P736-A769 WeakPolarHBondContact CB-O 3.37Å; A739-A769 HydrophobicContact CB-CB 4.08Å; F743-A769 HydrophobicContact CD2-CB 4.28Å; K765-A769 WeakPolarHBondContact O-CB 3.37Å; K765-A769 PolarHBondContact O-N 3.19Å; A766-A769 PolarHBondContact O-N 3.28Å; A766-A769 VanDerWaalsContact O-N 3.15Å; E767-A769 VanDerWaalsContact C-N 3.27Å; E767-A769 PolarHBondContact O-N 2.79Å; A769-A771 PolarHBondContact O-N 2.82Å; A769-L772 PolarHBondContact O-N 3.24Å
770	W	93.5	Very high	89.1	Confident	76 Å²	76	91.9 Å²	91.9	29%	0.288	45%	0.447	S	S	.	.	H	α-helix	trans	-63.2	-29.3	177	-65.3	-41.8	0	0	0	112.8	Q737 D741 T744 A766 L772 V773	Q737-W770 VanDerWaalsContact NE2-NE1 3.13Å; Q737-W770 PolarHBondContact O-NE1 3.35Å; D741-W770 PolarHBondContact OD1-NE1 3.2Å; T744-W770 WeakPolarHBondContact OG1-CH2 3.2Å; A766-W770 HydrophobicContact CB-CE3 4.43Å; A766-W770 HydrophobicContact CB-CH2 4.33Å; A766-W770 HydrophobicContact CB-CZ3 4.14Å; A766-W770 PolarHBondContact O-N 2.7Å; W770-L772 PolarHBondContact O-N 2.96Å; W770-V773 WeakPolarHBondContact O-CB 3.39Å; W770-V773 PolarHBondContact O-N 3.49Å
771	A	91.4	Very high	88.7	Confident	58 Å²	58	91.5 Å²	91.5	48%	0.479	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.9	172.8	0	0	0	0	0	113.8	E767 A769 V773	E767-A771 VanDerWaalsContact O-CB 3.28Å; E767-A771 WeakPolarHBondContact O-CB 3.28Å; E767-A771 PolarHBondContact O-N 2.92Å; A769-A771 PolarHBondContact O-N 2.82Å; A771-V773 VanDerWaalsContact C-N 3.3Å
772	L	86.8	Confident	88.1	Confident	90 Å²	90	89.6 Å²	89.6	47%	0.471	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	1.3	173.7	-57.4	-175.5	0	0	0	113.6	P736 A769 W770	P736-L772 HydrophobicContact CB-CB 3.94Å; P736-L772 HydrophobicContact CG-CB 4.11Å; A769-L772 PolarHBondContact O-N 3.24Å; W770-L772 PolarHBondContact O-N 2.96Å
773	V	82.7	Confident	87.4	Confident	68 Å²	68	95 Å²	95	41%	0.412	46%	0.462	S	S	.	.	S	Bend	trans	-94.1	-15	173.5	-170.6	0	0	0	0	111.3	P736 Q737 W770 A771	P736-V773 HydrophobicContact CB-CG2 3.9Å; Q737-V773 HydrophobicContact CB-CG2 4.06Å; W770-V773 WeakPolarHBondContact O-CB 3.39Å; W770-V773 PolarHBondContact O-N 3.49Å; A771-V773 VanDerWaalsContact C-N 3.3Å
774	E	60.4	Low	86.5	Confident	183 Å²	183	95.6 Å²	95.6	86%	0.855	47%	0.472	S	S	*	.			trans	-96.2	1.1	-178.2	-60.2	-159.2	141.6	0	0	115
775	E	52.3	Low	85.6	Confident	234 Å²	234	93.4 Å²	93.4	100%	1.093	46%	0.461	S	S	*	.			trans	-103.4	0	173.1	-68.5	-157.7	137.7	0	0	114

Retrieved 775 of 775 residues in 323.9 ms (Link to these results)

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