A0A096NCA4_PAPAN Loading...

Zinc finger protein 280B

May function as a transcription factor.

AlphaFold DB , UniProt , Accession A0A096NCA4, Species PAPAN (Papio anubis, Olive baboon), Gene ZNF280B, Length 543 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	31.8	Very low	246 Å²	246	174.8 Å²	174.8	100%	1.212	88%	0.88	S	S	*	*				0	89.9	0	-77.5	175.8	170.2	0	0	107
2	E	34.1	Very low	31.9	Very low	203 Å²	203	175.8 Å²	175.8	95%	0.949	88%	0.879	S	S	*	*			trans	-85.5	141.5	164.4	-66.3	166.8	120.2	0	0	106.6
3	Q	33.3	Very low	31.8	Very low	186 Å²	186	171.9 Å²	171.9	87%	0.869	87%	0.874	S	S	*	*			trans	-138.4	104.7	-179.7	-165.5	166.8	17.6	0	0	108.5
4	S	31.5	Very low	31.6	Very low	113 Å²	113	173.6 Å²	173.6	79%	0.79	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-57.1	135.7	178.5	-47.1	0	0	0	0	110.4
5	C	30.8	Very low	31.9	Very low	111 Å²	111	175.5 Å²	175.5	75%	0.75	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-87.7	116.7	164.3	-65.1	0	0	0	0	108.1
6	E	31.6	Very low	31.5	Very low	192 Å²	192	173.1 Å²	173.1	90%	0.897	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-76.3	152.3	171.8	-63.3	-177.6	144.6	0	0	110.4
7	E	30.3	Very low	31.6	Very low	180 Å²	180	171.1 Å²	171.1	84%	0.841	86%	0.859	S	S	*	*			trans	-112	111.4	-171.5	-174	174.2	-137.9	0	0	109.9	K9	E7-K9 PolarHBondContact O-N 3.16Å
8	E	29.8	Very low	31.5	Very low	199 Å²	199	171.2 Å²	171.2	93%	0.93	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-72	119.7	179.1	-69.8	-172.3	136.2	0	0	111.2
9	K	32.5	Very low	31.3	Very low	194 Å²	194	170.8 Å²	170.8	84%	0.843	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-93.5	129.8	169.9	-80.2	-177.2	172.4	179.6	0	111.2	E7	E7-K9 PolarHBondContact O-N 3.16Å
10	E	30	Very low	31.1	Very low	189 Å²	189	168.3 Å²	168.3	88%	0.883	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-86.5	157.8	156.1	-90.6	-153.9	125.6	0	0	111.6
11	P	31.9	Very low	31.1	Very low	110 Å²	110	169.3 Å²	169.3	71%	0.714	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-92.2	152.5	-162.4	35.3	-36.6	0	0	0	115.5
12	E	32.2	Very low	30.9	Very low	187 Å²	187	165.5 Å²	165.5	87%	0.874	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.8	148.3	165.3	-66.3	-170.1	129.2	0	0	112.2
13	P	30.6	Very low	30.7	Very low	125 Å²	125	161.4 Å²	161.4	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.1	155	173.9	33.2	-34.8	0	0	0	113.3
14	Q	29.6	Very low	30.5	Very low	196 Å²	196	160.1 Å²	160.1	92%	0.916	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.8	152.1	-168.9	-63.3	164.6	-34.9	0	0	114.9
15	K	35.8	Very low	30.6	Very low	201 Å²	201	162.1 Å²	162.1	87%	0.874	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-99	146.5	162.1	-70.2	-179.8	178.4	175.4	0	111
16	N	26.5	Very low	31	Very low	137 Å²	137	165.7 Å²	165.7	73%	0.733	82%	0.816	S	S	*	*			trans	-111.7	131.9	155.1	-91.2	-60.2	0	0	0	106.9
17	I	32.6	Very low	31	Very low	139 Å²	139	164 Å²	164	71%	0.713	81%	0.814	S	S	*	*				58.2	116.3	78	-60.4	-178.6	0	0	0	109.5
18	K	30	Very low	31.2	Very low	174 Å²	174	159.8 Å²	159.8	76%	0.757	81%	0.81	S	S	*	*			cis	-143	-173.1	14.1	-121.6	159.8	174	-166.2	0	108.5
19	E	27.9	Very low	31.4	Very low	163 Å²	163	158.7 Å²	158.7	76%	0.762	80%	0.804	S	S	*	*			cis	-156.2	-167.3	24.3	-151.9	144.7	-119.3	0	0	112.9
20	T	27.6	Very low	31.3	Very low	120 Å²	120	157.3 Å²	157.3	74%	0.736	81%	0.805	S	S	*	*			trans	-108.9	142.8	-153.8	-29.8	0	0	0	0	116.7
21	K	30.8	Very low	31.2	Very low	191 Å²	191	155.1 Å²	155.1	83%	0.83	80%	0.798	S	S	*	*			trans	-178.3	112	140.4	-98.8	156.8	-174.7	-179.5	0	107.6
22	Q	28.7	Very low	31	Very low	166 Å²	166	160 Å²	160	78%	0.776	81%	0.809	S	S	*	*				95.6	100.9	69.6	-178.2	173	-2.3	0	0	111.4
23	V	31.6	Very low	30.8	Very low	117 Å²	117	156.9 Å²	156.9	71%	0.709	80%	0.802	S	S	*	*			trans	33.6	114.5	145.5	-173.1	0	0	0	0	118.1
24	D	27.5	Very low	30.7	Very low	158 Å²	158	154.1 Å²	154.1	85%	0.845	80%	0.796	S	S	*	*				-148	133.1	110	-86	-33.8	0	0	0	108.4
25	D	33.6	Very low	30.6	Very low	156 Å²	156	151.2 Å²	151.2	83%	0.834	79%	0.792	S	S	*	*			trans	-97.4	143.9	166.3	-85	-47.4	0	0	0	108.1
26	E	39.8	Very low	30.3	Very low	185 Å²	185	149.8 Å²	149.8	86%	0.864	79%	0.788	S	S	*	*			trans	-161.8	145.8	143.8	-97.4	-46.9	150	0	0	109.1
27	D	31.8	Very low	30.5	Very low	158 Å²	158	152.7 Å²	152.7	85%	0.845	80%	0.797	S	S	*	*			trans	-79.3	145.6	-165.9	-88.2	-56.7	0	0	0	114.8
28	A	34.8	Very low	30.3	Very low	91 Å²	91	151 Å²	151	75%	0.752	79%	0.792	S	S	*	*			trans	-136.4	96.2	165.7	0	0	0	0	0	110.4	L30	A28-L30 PolarHBondContact O-N 3.04Å
29	E	33	Very low	30.5	Very low	176 Å²	176	150.2 Å²	150.2	82%	0.822	80%	0.797	S	S	*	*			trans	-58.3	121.9	178	-62.5	-173.6	136.2	0	0	111.9
30	L	30.7	Very low	30.9	Very low	165 Å²	165	150.5 Å²	150.5	86%	0.864	80%	0.798	S	S	*	*			trans	-123.3	106.9	161.1	-78.5	179.1	0	0	0	110.8	A28 F32	A28-L30 PolarHBondContact O-N 3.04Å; L30-F32 PolarHBondContact O-N 3.2Å
31	I	28.6	Very low	31.6	Very low	142 Å²	142	152.9 Å²	152.9	73%	0.728	81%	0.806	S	S	*	*			trans	-66.9	126.7	-177	-60.2	165.8	0	0	0	110	V33	I31-V33 HydrophobicContact CG2-CG2 4.1Å; I31-V33 PolarHBondContact O-N 2.8Å
32	F	27.7	Very low	31.7	Very low	213 Å²	213	148.1 Å²	148.1	93%	0.934	80%	0.803	S	S	*	*			trans	-65.3	99.3	167	-88.6	-94.4	0	0	0	110.6	L30	L30-F32 PolarHBondContact O-N 3.2Å
33	V	28.1	Very low	32.3	Very low	121 Å²	121	149 Å²	149	73%	0.733	81%	0.807	S	S	*	*			trans	-100.7	131.4	161.6	-176.3	0	0	0	0	107.7	I31	I31-V33 HydrophobicContact CG2-CG2 4.1Å; I31-V33 PolarHBondContact O-N 2.8Å
34	G	28.7	Very low	32.2	Very low	67 Å²	67	151.2 Å²	151.2	69%	0.691	81%	0.814	S	S	*	*			trans	-62.3	135.5	-171.4	0	0	0	0	0	113.4	E36	G34-E36 PolarHBondContact O-N 3.04Å
35	V	27.5	Very low	32.3	Very low	136 Å²	136	150.3 Å²	150.3	82%	0.824	81%	0.807	S	S	*	*			trans	-71.8	111.2	172.8	177.4	0	0	0	0	109
36	E	28.3	Very low	32	Very low	171 Å²	171	152.6 Å²	152.6	80%	0.799	81%	0.81	S	S	*	*			trans	-66.8	159.1	168.8	-63.4	-176.4	142.9	0	0	110.4	G34 V38	G34-E36 PolarHBondContact O-N 3.04Å; E36-V38 PolarHBondContact O-N 3.13Å
37	H	30.8	Very low	31.5	Very low	198 Å²	198	149 Å²	149	92%	0.917	80%	0.801	S	S	*	*			trans	-62.5	110	-178.2	-78.4	75.9	0	0	0	111.2
38	V	28.8	Very low	31.2	Very low	102 Å²	102	145.3 Å²	145.3	62%	0.618	80%	0.8	S	S	*	*			trans	-77.2	123.9	171.9	-175.2	0	0	0	0	109.2	E36 E40	E36-V38 PolarHBondContact O-N 3.13Å; V38-E40 HydrophobicContact CB-CG 4.5Å; V38-E40 HydrophobicContact CG1-CG 3.83Å; V38-E40 PolarHBondContact O-N 3.42Å
39	N	34.8	Very low	30.9	Very low	158 Å²	158	146.6 Å²	146.6	85%	0.845	80%	0.798	S	S	*	*			trans	-76.8	107	165.8	-82	-20.8	0	0	0	109
40	E	35.4	Very low	30.7	Very low	170 Å²	170	145 Å²	145	79%	0.794	80%	0.8	S	S	*	*			trans	-101.3	76.2	174	-65.9	-168.6	168.4	0	0	111.5	V38	V38-E40 HydrophobicContact CB-CG 4.5Å; V38-E40 HydrophobicContact CG1-CG 3.83Å; V38-E40 PolarHBondContact O-N 3.42Å
41	D	42.5	Very low	30.8	Very low	170 Å²	170	141.6 Å²	141.6	91%	0.909	79%	0.791	S	S	*	*			trans	-133	68.2	168.2	-86.7	-50.9	0	0	0	108.9
42	A	33.4	Very low	31	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	80%	0.797	S	S	*	*			trans	-135.7	49.4	-174.5	0	0	0	0	0	113.2	L44	A42-L44 PolarHBondContact O-N 2.88Å
43	E	40	Very low	31.2	Very low	184 Å²	184	138.1 Å²	138.1	86%	0.86	79%	0.793	S	S	*	*			trans	-73.8	113.9	166.3	-72.6	-174.5	174.9	0	0	110	I45	E43-I45 PolarHBondContact O-N 3.28Å
44	L	31.2	Very low	31.7	Very low	163 Å²	163	141.8 Å²	141.8	85%	0.853	80%	0.799	S	S	*	*			trans	-72	105.3	-179.6	-75.8	166.1	0	0	0	111.5	A42	A42-L44 PolarHBondContact O-N 2.88Å
45	I	28.4	Very low	31.8	Very low	139 Å²	139	144.4 Å²	144.4	71%	0.713	80%	0.803	S	S	*	*			trans	-105.8	110.5	168.3	-53.1	-179.1	0	0	0	109.2	E43 V47	E43-I45 PolarHBondContact O-N 3.28Å; I45-V47 HydrophobicContact CG2-CG2 3.97Å; I45-V47 PolarHBondContact O-N 2.82Å
46	F	27.5	Very low	31.9	Very low	205 Å²	205	144.4 Å²	144.4	90%	0.899	80%	0.803	S	S	*	*			trans	-70.4	113.8	170.5	-91.3	-96.7	0	0	0	110.3
47	V	28.5	Very low	32	Very low	110 Å²	110	142 Å²	142	67%	0.667	80%	0.8	S	S	*	*			trans	-124.6	120.7	166.8	-175.3	0	0	0	0	108.4	I45 V49	I45-V47 HydrophobicContact CG2-CG2 3.97Å; I45-V47 PolarHBondContact O-N 2.82Å; V47-V49 PolarHBondContact O-N 3.39Å
48	G	25.6	Very low	32.2	Very low	79 Å²	79	136.9 Å²	136.9	81%	0.814	79%	0.786	S	S	*	*			trans	-69.1	114.1	175.1	0	0	0	0	0	110.8
49	V	29.7	Very low	32.2	Very low	119 Å²	119	138.1 Å²	138.1	72%	0.721	79%	0.79	S	S	*	*			trans	-90.3	113.5	-178.9	-177.9	0	0	0	0	110.4	V47	V47-V49 PolarHBondContact O-N 3.39Å
50	T	28.8	Very low	32.3	Very low	141 Å²	141	136.7 Å²	136.7	87%	0.865	78%	0.781	S	S	*	*			trans	-83.7	106.5	158.9	47.8	0	0	0	0	109.2	N52	T50-N52 PolarHBondContact O-N 3.33Å
51	S	33.3	Very low	32.5	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	78%	0.78	S	S	*	*			trans	-63.2	128	-177.5	-51.7	0	0	0	0	112.9
52	N	32.5	Very low	32.1	Very low	161 Å²	161	132.4 Å²	132.4	86%	0.861	76%	0.763	S	S	*	*				166.8	91	122.8	-83.1	-19	0	0	0	113.4	T50	T50-N52 PolarHBondContact O-N 3.33Å
53	S	31.9	Very low	32	Very low	121 Å²	121	139 Å²	139	85%	0.846	77%	0.768	S	S	*	*			trans	-157.7	139.2	155.9	50.5	0	0	0	0	110.3
54	K	37	Very low	31.4	Very low	198 Å²	198	136.5 Å²	136.5	86%	0.861	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.7	141.9	178.2	-60.7	175.4	-177.9	174.1	0	109.7	V56	K54-V56 PolarHBondContact O-N 3.34Å
55	P	30.9	Very low	31.3	Very low	121 Å²	121	134.4 Å²	134.4	79%	0.786	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-67.9	131.3	177.2	28	-33.9	0	0	0	111
56	V	30.4	Very low	31.5	Very low	136 Å²	136	133.4 Å²	133.4	82%	0.824	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-80	129.5	166.5	175.4	0	0	0	0	107.9	K54 S58	K54-V56 PolarHBondContact O-N 3.34Å; V56-S58 PolarHBondContact O-N 2.78Å
57	V	30.8	Very low	31.5	Very low	121 Å²	121	126.5 Å²	126.5	73%	0.733	75%	0.748	S	S	*	*			trans	-84.7	99.3	177.9	-179.6	0	0	0	0	109.2
58	S	34	Very low	31.4	Very low	90 Å²	90	127 Å²	127	63%	0.629	76%	0.757	S	S	*	*			trans	-79	134.9	165.2	48.9	0	0	0	0	110.2	V56 I60	V56-S58 PolarHBondContact O-N 2.78Å; S58-I60 VanDerWaalsContact C-N 3.32Å; S58-I60 PolarHBondContact O-N 2.84Å
59	N	28.9	Very low	31.4	Very low	128 Å²	128	135.1 Å²	135.1	68%	0.684	76%	0.763	S	S	*	*			trans	-82.1	72.7	-173.9	-77	-54.4	0	0	0	112	L61	N59-L61 PolarHBondContact O-N 2.84Å
60	I	37.8	Very low	31.4	Very low	128 Å²	128	135.1 Å²	135.1	66%	0.656	77%	0.768	S	S	*	*			trans	-57.5	113.6	172	-56.7	174.6	0	0	0	109.2	S58 N62	S58-I60 VanDerWaalsContact C-N 3.32Å; S58-I60 PolarHBondContact O-N 2.84Å; I60-N62 HydrophobicContact CG2-CB 4.28Å; I60-N62 PolarHBondContact O-N 2.87Å
61	L	39.1	Very low	31.4	Very low	151 Å²	151	139.9 Å²	139.9	79%	0.791	77%	0.77	S	S	*	*	S	Bend	trans	-74.5	60.3	176.5	-77.1	173.9	0	0	0	112.4	N59	N59-L61 PolarHBondContact O-N 2.84Å
62	N	34.8	Very low	31.2	Very low	100 Å²	100	147 Å²	147	54%	0.535	78%	0.782	S	S	.	*			trans	-146.3	72.9	168	-83.6	-58.2	0	0	0	109.7	I60 V64 Q357	I60-N62 HydrophobicContact CG2-CB 4.28Å; I60-N62 PolarHBondContact O-N 2.87Å; N62-V64 PolarHBondContact O-N 3.11Å; N62-Q357 PolarHBondContact OD1-NE2 3.26Å
63	R	31.1	Very low	31.2	Very low	228 Å²	228	149 Å²	149	86%	0.86	78%	0.784	S	S	*	*			trans	-74.8	104.1	174.5	-76.6	-172.1	177.1	179.4	0.4	111.1
64	V	27.7	Very low	31.1	Very low	133 Å²	133	153.1 Å²	153.1	81%	0.806	79%	0.786	S	S	*	*			trans	-103.1	115.7	151.7	179.1	0	0	0	0	107.2	N62	N62-V64 PolarHBondContact O-N 3.11Å
65	T	28.4	Very low	30.6	Very low	118 Å²	118	155.2 Å²	155.2	72%	0.724	79%	0.791	S	S	*	*			trans	-113.3	107.6	175.5	-50.2	0	0	0	0	108.8	G67	T65-G67 PolarHBondContact O-N 2.98Å
66	P	31.6	Very low	30.5	Very low	119 Å²	119	153.2 Å²	153.2	77%	0.773	79%	0.792	S	S	*	*			trans	-68.1	102.1	177.1	-20.3	33.6	0	0	0	111	S68	P66-S68 PolarHBondContact O-N 3.18Å
67	G	27.7	Very low	30.5	Very low	59 Å²	59	155.6 Å²	155.6	61%	0.608	79%	0.793	S	S	*	*			trans	-67.7	120.5	173.5	0	0	0	0	0	111	T65 W69	T65-G67 PolarHBondContact O-N 2.98Å; G67-W69 PolarHBondContact O-N 3.2Å
68	S	28.3	Very low	30.3	Very low	121 Å²	121	156.7 Å²	156.7	85%	0.846	79%	0.794	S	S	*	*			trans	-73.6	108.6	-172.9	53.5	0	0	0	0	113.1	P66	P66-S68 PolarHBondContact O-N 3.18Å
69	W	25	Very low	30	Very low	250 Å²	250	162.7 Å²	162.7	95%	0.947	80%	0.803	S	S	*	*			trans	-88.5	110	172.5	-81	75.1	0	0	0	111.7	G67	G67-W69 PolarHBondContact O-N 3.2Å
70	S	28.3	Very low	30	Very low	119 Å²	119	164.5 Å²	164.5	83%	0.832	81%	0.805	S	S	*	*			trans	-76.7	131.9	176	-173	0	0	0	0	111.8
71	R	30.8	Very low	29.4	Very low	241 Å²	241	165.8 Å²	165.8	91%	0.909	81%	0.814	S	S	*	*			trans	-72.3	125.8	178	-76.1	179.9	170.9	179.5	-1.4	111.7
72	R	28.3	Very low	28.9	Very low	243 Å²	243	164 Å²	164	92%	0.917	81%	0.809	S	S	*	*			trans	-149.8	112.2	148.2	-162.2	169.2	-71.8	-166.2	-1.3	112
73	K	32.3	Very low	28.5	Very low	204 Å²	204	163.6 Å²	163.6	89%	0.887	82%	0.819	S	S	*	*			trans	-84.2	143.2	168.8	-73.3	-177.2	175.3	-179	0	110.3
74	K	29.3	Very low	28.4	Very low	208 Å²	208	159.2 Å²	159.2	90%	0.904	81%	0.813	S	S	*	*			trans	-168	145.6	132.9	-110.8	177.7	-179.2	-174.8	0	111.5
75	Y	28.1	Very low	28.4	Very low	242 Å²	242	160.8 Å²	160.8	95%	0.949	81%	0.809	S	S	*	*			trans	-78.8	155.3	164.8	-86.6	-110.5	0	0	0	109.9
76	G	28.2	Very low	28.4	Very low	79 Å²	79	163.8 Å²	163.8	81%	0.814	82%	0.82	S	S	*	*			trans	179.9	139.4	171.5	0	0	0	0	0	112.4
77	H	29.2	Very low	28.3	Very low	185 Å²	185	165.9 Å²	165.9	86%	0.856	82%	0.819	S	S	*	*			trans	-103	159.2	-176.3	-115.8	-93.7	0	0	0	112.2
78	L	27.5	Very low	28.4	Very low	144 Å²	144	168.6 Å²	168.6	75%	0.754	83%	0.826	S	S	*	*			trans	84.2	134.2	148.3	-127	72.7	0	0	0	121.6
79	R	27.1	Very low	28.2	Very low	216 Å²	216	168.3 Å²	168.3	82%	0.815	82%	0.819	S	S	*	*			trans	42.3	114.5	147.4	-85.8	-174.9	172.9	-155.6	1	121.2
80	K	28.6	Very low	28.3	Very low	167 Å²	167	161 Å²	161	73%	0.726	81%	0.806	S	S	*	*				45.5	110.5	106.4	-171	-165.8	-177.1	-170.5	0	117
81	D	26	Very low	28.3	Very low	155 Å²	155	165.7 Å²	165.7	83%	0.829	81%	0.806	S	S	*	*				-150.2	-171.6	126.1	-121.2	-34.6	0	0	0	113.3
82	T	27.9	Very low	28.1	Very low	112 Å²	112	160.6 Å²	160.6	69%	0.687	79%	0.792	S	S	*	*			trans	-129.6	152.3	-149.6	-37.7	0	0	0	0	113.7
83	A	27	Very low	28	Very low	92 Å²	92	154.2 Å²	154.2	76%	0.76	78%	0.781	S	S	*	*			trans	70.7	163.2	169.3	0	0	0	0	0	116
84	D	29.3	Very low	27.8	Very low	136 Å²	136	151.4 Å²	151.4	73%	0.727	78%	0.775	S	S	*	*			cis	-148.2	151.7	-2.1	-150.3	9.5	0	0	0	113.9
85	K	27.3	Very low	27.7	Very low	167 Å²	167	146.7 Å²	146.7	73%	0.726	76%	0.763	S	S	*	*			trans	32.6	109.8	137.8	-176	-174.3	-171.4	177.1	0	121
86	L	28.6	Very low	27.9	Very low	180 Å²	180	139 Å²	139	94%	0.942	75%	0.745	S	S	*	*			trans	-135.9	134.5	135.6	-79.5	-177.7	0	0	0	110.9
87	Q	30.4	Very low	28.1	Very low	164 Å²	164	144 Å²	144	77%	0.766	75%	0.747	S	S	*	*			trans	-101.4	161	174.4	-87.5	-89.8	-19.4	0	0	109.8
88	P	29.7	Very low	28.1	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	74%	0.739	S	S	*	*				-140.9	122.2	112.5	32.8	-17.8	0	0	0	115.7
89	T	23.4	Very low	28.3	Very low	114 Å²	114	138.6 Å²	138.6	70%	0.699	74%	0.741	S	S	*	*				54.4	79.3	124.1	-42.7	0	0	0	0	118.8
90	S	26.6	Very low	28.3	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	73%	0.734	S	S	*	*				34.5	132.7	125	64.5	0	0	0	0	121.8
91	R	28.7	Very low	28	Very low	217 Å²	217	131.7 Å²	131.7	82%	0.819	73%	0.732	S	S	*	*				167.6	140.7	127.3	-86.6	173.8	103.8	148.8	8.9	107.2
92	E	27.6	Very low	28.2	Very low	134 Å²	134	131.6 Å²	131.6	63%	0.626	73%	0.731	S	S	*	*			cis	-150.6	156.1	-0.2	-112.8	165.9	-159.9	0	0	111.2
93	T	25.2	Very low	29.5	Very low	110 Å²	110	131.5 Å²	131.5	68%	0.675	73%	0.732	S	S	*	*			trans	14.1	141.4	139.1	-17	0	0	0	0	119.1
94	L	27.8	Very low	29.5	Very low	145 Å²	145	131.6 Å²	131.6	76%	0.759	73%	0.733	S	S	*	*			cis	-134.4	145.2	35.9	-99.7	77.2	0	0	0	112
95	T	27.1	Very low	29.4	Very low	108 Å²	108	130 Å²	130	66%	0.663	73%	0.733	S	S	*	*				56.2	149.1	86.7	87	0	0	0	0	115.8
96	S	33.5	Very low	29.6	Very low	82 Å²	82	130.2 Å²	130.2	57%	0.573	74%	0.736	S	S	*	*			cis	-151.3	158.9	16.5	-44.8	0	0	0	0	113.9
97	E	32.2	Very low	29.6	Very low	184 Å²	184	128.3 Å²	128.3	86%	0.86	73%	0.727	S	S	*	*			trans	53.7	152.8	138.6	-65.4	157.2	147.5	0	0	120.8
98	A	29.4	Very low	29.5	Very low	81 Å²	81	127.5 Å²	127.5	67%	0.669	72%	0.723	S	S	*	*			cis	-150.9	149.6	5.8	0	0	0	0	0	109
99	V	31	Very low	29.5	Very low	133 Å²	133	126 Å²	126	81%	0.806	72%	0.715	S	S	*	*				65.6	129.5	75.1	172.7	0	0	0	0	113.4
100	T	26.8	Very low	29.7	Very low	109 Å²	109	132 Å²	132	67%	0.669	72%	0.724	S	S	*	*			cis	-170.7	150.4	-8.6	-94.1	0	0	0	0	111.7
101	D	23.1	Very low	29.9	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	73%	0.729	S	S	*	*			trans	45.4	121.1	155.8	-62.9	-10.6	0	0	0	126.9
102	L	29.4	Very low	29.9	Very low	153 Å²	153	128.8 Å²	128.8	80%	0.801	73%	0.73	S	S	*	*				56.2	171.1	117.1	-61.2	175.7	0	0	0	122.8
103	P	54.9	Low	30	Very low	110 Å²	110	129 Å²	129	71%	0.714	74%	0.735	S	S	*	*			cis	-135	-175.1	-28.3	29.6	-8	0	0	0	115.5
104	A	27.5	Very low	30.6	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	74%	0.737	S	S	*	*			trans	75.1	150.1	149.8	0	0	0	0	0	120.6
105	S	27.8	Very low	31.7	Very low	102 Å²	102	126.9 Å²	126.9	71%	0.713	74%	0.735	S	S	*	*			cis	-169.6	162.2	-17.3	57.1	0	0	0	0	113.6
106	Q	30.4	Very low	31.9	Very low	172 Å²	172	129.8 Å²	129.8	80%	0.804	75%	0.745	S	S	*	*			trans	66.8	157.6	163.8	-57.7	-159.8	-19.8	0	0	117.3
107	L	29.6	Very low	31.8	Very low	140 Å²	140	132.8 Å²	132.8	73%	0.733	75%	0.753	S	S	*	*			cis	-150	178.9	-0.4	-145.3	59.1	0	0	0	107
108	E	28.2	Very low	31.8	Very low	147 Å²	147	132 Å²	132	69%	0.687	75%	0.753	S	S	*	*			cis	-144.3	-119.3	5.1	-164.1	-131.5	-89.5	0	0	112.6
109	S	29.1	Very low	32	Very low	84 Å²	84	136.8 Å²	136.8	59%	0.587	76%	0.761	S	S	*	*			trans	-151	157.6	-165.4	83.5	0	0	0	0	116
110	R	28.1	Very low	32.7	Very low	239 Å²	239	136.2 Å²	136.2	90%	0.902	76%	0.76	S	S	*	*				-177	159.4	121	-101.5	176.8	-166.7	-112.1	0.4	113.1
111	S	31.5	Very low	32.7	Very low	111 Å²	111	139.3 Å²	139.3	78%	0.776	77%	0.771	S	S	*	*			trans	-147.1	156	-179.5	54	0	0	0	0	110.8
112	T	28.3	Very low	33.2	Very low	137 Å²	137	138.1 Å²	138.1	84%	0.84	77%	0.774	S	S	*	*			trans	-153.9	129.1	165	-34.6	0	0	0	0	112.9
113	D	30.2	Very low	33.5	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	78%	0.776	S	S	*	*			trans	-3.3	122.2	169.5	-74.2	-80.1	0	0	0	126.7
114	S	35.7	Very low	33.2	Very low	102 Å²	102	140 Å²	140	71%	0.713	78%	0.775	S	S	*	*				77.4	155.6	104.2	-55.4	0	0	0	0	123.3
115	P	52.9	Low	33.4	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	77%	0.772	S	S	*	*			trans	-128	178.7	-155.8	43.8	-28.3	0	0	0	116.8
116	I	29.6	Very low	33.5	Very low	169 Å²	169	146.5 Å²	146.5	87%	0.867	78%	0.775	S	S	*	*			trans	-136.5	150.4	165.7	-63.9	-176.5	0	0	0	110.8
117	I	32.2	Very low	33.5	Very low	145 Å²	145	148 Å²	148	74%	0.744	78%	0.778	S	S	*	*			trans	-135	152.5	-175.2	-52.1	170.3	0	0	0	108.9
118	I	31.6	Very low	33.5	Very low	167 Å²	167	148.3 Å²	148.3	86%	0.856	78%	0.781	S	S	*	*			trans	166.9	153.8	133.1	-84.7	162.7	0	0	0	113
119	E	33.8	Very low	33.4	Very low	182 Å²	182	147.4 Å²	147.4	85%	0.85	79%	0.791	S	S	*	*			trans	-82.9	171.6	-168.6	-87.9	-178.9	97.8	0	0	117.4
120	P	46.9	Very low	33.5	Very low	120 Å²	120	148.4 Å²	148.4	78%	0.779	80%	0.798	S	S	*	*			trans	-85.9	173.4	174.4	37.2	-37.8	0	0	0	114.3
121	L	26.3	Very low	34.5	Very low	174 Å²	174	143.1 Å²	143.1	91%	0.911	79%	0.794	S	S	*	*			trans	-138.5	170.3	174.6	-161.3	56.4	0	0	0	112.9
122	S	33.4	Very low	34.5	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	80%	0.798	S	S	*	*			trans	-111.2	-177.3	-155.6	53.6	0	0	0	0	117.3
123	K	35.4	Very low	34.5	Very low	198 Å²	198	146.3 Å²	146.3	86%	0.861	80%	0.797	S	S	*	*			trans	-51.7	176	174.1	-50.9	-179.7	-178.6	178.6	0	114.1
124	P	49.4	Very low	34.8	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	80%	0.8	S	S	*	*			cis	-155.3	-166.3	23.9	45.4	-21.9	0	0	0	120.4
125	D	30.1	Very low	35.4	Very low	134 Å²	134	146.2 Å²	146.2	72%	0.717	80%	0.798	S	S	*	*			trans	92.8	120.1	142.2	-69.6	-17.6	0	0	0	127.2
126	Y	30.1	Very low	34.4	Very low	199 Å²	199	147 Å²	147	78%	0.78	80%	0.797	S	S	*	*			trans	38.8	122.5	136.9	-79.6	-87.1	0	0	0	124.3
127	K	30.9	Very low	34.3	Very low	202 Å²	202	146 Å²	146	88%	0.878	79%	0.793	S	S	*	*				-174.7	161.4	100.2	-102.6	172.2	-175.3	173.2	0	114.7
128	N	28.9	Very low	34.4	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	79%	0.791	S	S	*	*			trans	-89.5	159.7	-177.1	-60	-12.7	0	0	0	113.6
129	S	26.1	Very low	34.4	Very low	127 Å²	127	141.2 Å²	141.2	89%	0.888	79%	0.787	S	S	*	*				-167	150.9	128.5	-82.3	0	0	0	0	113.1
130	S	31.6	Very low	34.2	Very low	106 Å²	106	141.7 Å²	141.7	74%	0.741	79%	0.789	S	S	*	*			trans	-138.2	160.3	169.4	171.2	0	0	0	0	107.7
131	P	49	Very low	33.6	Very low	127 Å²	127	143.9 Å²	143.9	83%	0.825	79%	0.793	S	S	*	*				-140	178.5	119.4	35.8	-21.6	0	0	0	114.8
132	Q	31.1	Very low	34.3	Very low	182 Å²	182	141.1 Å²	141.1	85%	0.85	79%	0.786	S	S	*	*			trans	-82.6	171.6	-176.1	-55.1	168.4	-12	0	0	113.6
133	V	29.7	Very low	34.4	Very low	134 Å²	134	141.3 Å²	141.3	81%	0.812	79%	0.787	S	S	*	*				-172.9	145.9	119.1	143.8	0	0	0	0	110.8
134	V	35.2	Very low	35	Very low	132 Å²	132	138 Å²	138	80%	0.8	79%	0.786	S	S	*	*			trans	-144.3	147.9	167.8	-154.7	0	0	0	0	107.3
135	P	49	Very low	34.1	Very low	104 Å²	104	140.1 Å²	140.1	68%	0.675	79%	0.791	S	S	*	*				-154.8	143.8	107.3	36.2	-16.7	0	0	0	118.3
136	N	31.8	Very low	34	Very low	128 Å²	128	142 Å²	142	68%	0.684	80%	0.799	S	S	*	*			trans	60.5	125.6	133.6	-56.7	-6.4	0	0	0	125
137	N	28.7	Very low	33.9	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	79%	0.792	S	S	*	*				64.7	148	126.4	-60.7	-2.2	0	0	0	121.4
138	S	32.8	Very low	33.8	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	79%	0.789	S	S	*	*			cis	-171.2	165.3	-4.3	43.3	0	0	0	0	112.5
139	S	32.8	Very low	33.9	Very low	112 Å²	112	136.5 Å²	136.5	78%	0.783	79%	0.793	S	S	*	*			trans	75.6	148.6	164.4	-46.7	0	0	0	0	116.5
140	E	29.3	Very low	34	Very low	192 Å²	192	134.1 Å²	134.1	90%	0.897	79%	0.789	S	S	*	*			cis	-137.5	-173.8	19.4	-72.1	-168.7	131.4	0	0	114.9
141	L	34.9	Very low	33.9	Very low	165 Å²	165	134.6 Å²	134.6	86%	0.864	79%	0.792	S	S	*	*			trans	-100.3	-178.1	173.1	-78.9	165.5	0	0	0	110.9
142	P	40.4	Very low	33	Very low	116 Å²	116	135.5 Å²	135.5	75%	0.753	79%	0.789	S	S	*	*			cis	-132.2	-177.5	0.9	42.2	-25.3	0	0	0	115.8
143	S	34.8	Very low	33	Very low	109 Å²	109	135.3 Å²	135.3	76%	0.762	79%	0.788	S	S	*	*			trans	-87	172.3	162.3	-44.3	0	0	0	0	111.7
144	P	48.3	Very low	33.2	Very low	128 Å²	128	136.9 Å²	136.9	83%	0.831	79%	0.787	S	S	*	*				-153.9	-179.9	90.7	41.6	-22.9	0	0	0	117.6
145	L	31.3	Very low	33.8	Very low	151 Å²	151	135.9 Å²	135.9	79%	0.791	78%	0.783	S	S	*	*			trans	-72	167.9	172.1	-60.4	133.5	0	0	0	113.9
146	I	27.7	Very low	32.9	Very low	172 Å²	172	137 Å²	137	88%	0.882	79%	0.787	S	S	*	*			trans	-134.8	146.4	143.2	-64.1	-173.8	0	0	0	109.6
147	T	26.5	Very low	32.7	Very low	103 Å²	103	136.1 Å²	136.1	63%	0.632	79%	0.791	S	S	*	*			trans	-142.8	144	-177.2	14.3	0	0	0	0	113.2
148	F	30.8	Very low	32.8	Very low	188 Å²	188	133.8 Å²	133.8	83%	0.825	79%	0.793	S	S	*	*			trans	70.8	150.4	147.7	-88.2	-67.2	0	0	0	124.3
149	T	29.5	Very low	32.6	Very low	143 Å²	143	133 Å²	133	88%	0.877	79%	0.793	S	S	*	*			trans	71.7	145.5	154.6	52.2	0	0	0	0	121.9
150	G	28.5	Very low	32.5	Very low	77 Å²	77	136 Å²	136	79%	0.794	80%	0.798	S	S	*	*			trans	160.9	143.3	173.1	0	0	0	0	0	110.9
151	S	30	Very low	32.5	Very low	117 Å²	117	131.5 Å²	131.5	82%	0.818	79%	0.789	S	S	*	*			trans	-151.1	163.4	-176.1	-169.6	0	0	0	0	113.1
152	L	30.1	Very low	32.3	Very low	145 Å²	145	130.4 Å²	130.4	76%	0.759	79%	0.788	S	S	*	*			trans	71.2	115.6	160.6	-140.9	81.3	0	0	0	118.4
153	H	31.6	Very low	31.7	Very low	179 Å²	179	128.5 Å²	128.5	83%	0.829	79%	0.79	S	S	*	*				-169.2	151.5	118.2	-116.2	-81.1	0	0	0	113.9
154	Q	33	Very low	31.4	Very low	167 Å²	167	127.1 Å²	127.1	78%	0.78	79%	0.793	S	S	*	*			trans	-128.4	160.5	159.9	-142.6	-178	8.2	0	0	106.7
155	P	47.7	Very low	30.7	Very low	110 Å²	110	128.3 Å²	128.3	71%	0.714	79%	0.791	S	S	*	*				-157	158.3	88.3	39.4	-19	0	0	0	118.8
156	V	30.2	Very low	30.6	Very low	127 Å²	127	127.8 Å²	127.8	77%	0.77	79%	0.789	S	S	*	*			trans	46.9	120.9	136.5	-178.2	0	0	0	0	122.9
157	S	28.3	Very low	30.7	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	79%	0.788	S	S	*	*				177.6	118.4	126.9	-77.6	0	0	0	0	109.4
158	A	29.5	Very low	30.9	Very low	99 Å²	99	128.6 Å²	128.6	82%	0.818	79%	0.793	S	S	*	*				73	135.5	79.5	0	0	0	0	0	114.5
159	A	29.9	Very low	31.7	Very low	84 Å²	84	124.5 Å²	124.5	69%	0.694	79%	0.785	S	S	*	*			cis	-167.7	-177.5	-11.4	0	0	0	0	0	111
160	L	29.6	Very low	31.6	Very low	173 Å²	173	125.9 Å²	125.9	91%	0.906	78%	0.781	S	S	*	*			trans	76.8	158.7	168.1	-50.9	174.5	0	0	0	118.5
161	S	29.8	Very low	31.6	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	78%	0.78	S	S	*	*			cis	-169.9	161.3	-43.3	-155.3	0	0	0	0	111.8
162	V	30.6	Very low	31.6	Very low	141 Å²	141	129 Å²	129	86%	0.855	78%	0.778	S	S	*	*			trans	65.2	124.9	162.7	-172.7	0	0	0	0	120.2
163	G	27.6	Very low	31.5	Very low	77 Å²	77	131 Å²	131	79%	0.794	78%	0.78	S	S	*	*				120.9	128.3	127.7	0	0	0	0	0	119.6
164	G	28.8	Very low	31.4	Very low	80 Å²	80	133 Å²	133	83%	0.825	78%	0.781	S	S	*	*			trans	114.9	90.9	144.1	0	0	0	0	0	119.2
165	I	33.2	Very low	31	Very low	153 Å²	153	131.6 Å²	131.6	79%	0.785	78%	0.778	S	S	*	*			trans	-33.4	138.1	158	42.2	165.8	0	0	0	119.5
166	N	30.1	Very low	30.1	Very low	139 Å²	139	130.9 Å²	130.9	74%	0.743	78%	0.775	S	S	*	*			trans	73.7	155.6	132.5	-64.3	6.1	0	0	0	124.3
167	E	28.7	Very low	29.9	Very low	188 Å²	188	130.8 Å²	130.8	88%	0.879	78%	0.775	S	S	*	*			trans	75.5	148.9	163.7	-59.5	-78.9	106.2	0	0	119.1
168	S	30.5	Very low	30	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	78%	0.775	S	S	*	*			trans	-176.5	156.9	-169.7	173.6	0	0	0	0	109.6
169	P	47.6	Very low	30.2	Very low	101 Å²	101	136.3 Å²	136.3	66%	0.656	77%	0.77	S	S	*	*			cis	-118.9	-171.7	-32.5	38.7	-25.8	0	0	0	110.2
170	H	28.6	Very low	30.2	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.796	77%	0.769	S	S	*	*			trans	-172.6	145.5	136	-105.7	-61.3	0	0	0	116
171	I	29	Very low	30.1	Very low	151 Å²	151	136.6 Å²	136.6	77%	0.774	76%	0.764	S	S	*	*			trans	74	130.9	153.1	-64.5	163.6	0	0	0	118.4
172	S	29.4	Very low	30.1	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	77%	0.77	S	S	*	*			trans	-110.1	152.2	178.2	166.9	0	0	0	0	111.7
173	K	28.3	Very low	30.1	Very low	187 Å²	187	139.1 Å²	139.1	81%	0.813	77%	0.772	S	S	*	*			trans	-165.7	120.8	164.2	-111.4	164.9	-173.4	173.5	0	113.8
174	R	28.2	Very low	30.3	Very low	222 Å²	222	141.9 Å²	141.9	84%	0.838	77%	0.769	S	S	*	*			trans	63.4	161.6	150.1	-86.5	-175.4	164.9	-162.2	-5.1	118.2
175	L	26.1	Very low	31	Very low	137 Å²	137	143.2 Å²	143.2	72%	0.717	76%	0.763	S	S	*	*			cis	-127.6	159	-14.3	-80.4	112.8	0	0	0	107
176	S	28	Very low	30.9	Very low	95 Å²	95	145.6 Å²	145.6	66%	0.664	77%	0.768	S	S	*	*			cis	86.7	113.5	28.5	-173.4	0	0	0	0	117
177	T	26.7	Very low	30.9	Very low	124 Å²	124	148.9 Å²	148.9	76%	0.761	77%	0.77	S	S	*	*			trans	-157.9	116.5	152.9	36.7	0	0	0	0	108
178	F	30.3	Very low	30.8	Very low	173 Å²	173	144.8 Å²	144.8	76%	0.759	77%	0.768	S	S	*	*				76.5	141.4	97.5	-78.8	-136	0	0	0	113.4
179	E	32.2	Very low	31.1	Very low	153 Å²	153	147.8 Å²	147.8	72%	0.715	77%	0.768	S	S	*	*			cis	-155	134.8	3.2	-115.2	175.5	154.4	0	0	110.5
180	V	31	Very low	30.1	Very low	113 Å²	113	151.2 Å²	151.2	69%	0.685	78%	0.779	S	S	*	*				80.7	116.5	95.4	166.5	0	0	0	0	118.1
181	N	27.9	Very low	30.1	Very low	150 Å²	150	153.4 Å²	153.4	80%	0.802	78%	0.781	S	S	*	*				-167.4	161.9	120.8	-108.5	-62.4	0	0	0	112
182	S	28.8	Very low	30.3	Very low	115 Å²	115	153.6 Å²	153.6	80%	0.804	78%	0.783	S	S	*	*			trans	-160.1	140.3	-175.3	-67.6	0	0	0	0	114.1
183	I	31.7	Very low	30.3	Very low	178 Å²	178	151.4 Å²	151.4	91%	0.913	78%	0.778	S	S	*	*			trans	-136.1	148.2	162.9	-62.7	-175.6	0	0	0	108.9
184	N	30.6	Very low	30.5	Very low	134 Å²	134	149.8 Å²	149.8	72%	0.717	78%	0.777	S	S	*	*			trans	-123.4	166.2	-170	-164.9	-15.7	0	0	0	109.3	K186	N184-K186 PolarHBondContact OD1-N 2.74Å
185	P	44.9	Very low	30.5	Very low	108 Å²	108	147 Å²	147	70%	0.701	78%	0.775	S	S	*	*				-153.9	144.1	102.7	35.7	-16.2	0	0	0	119.4
186	K	30.7	Very low	30.5	Very low	204 Å²	204	148 Å²	148	89%	0.887	78%	0.776	S	S	*	*			trans	86.3	168.8	139.4	-72.3	170.2	-178.2	176.2	0	120.4	N184	N184-K186 PolarHBondContact OD1-N 2.74Å
187	R	30.1	Very low	30.6	Very low	208 Å²	208	146.2 Å²	146.2	79%	0.785	77%	0.773	S	S	*	*			trans	-150.6	150.8	-148.9	164.1	-156.4	-86	179.3	-3.3	110.5
188	A	25.9	Very low	30.5	Very low	101 Å²	101	150.4 Å²	150.4	84%	0.835	78%	0.776	S	S	*	*			trans	-130.4	163.5	151.3	0	0	0	0	0	111.5
189	K	37.3	Very low	30.7	Very low	169 Å²	169	147.8 Å²	147.8	74%	0.735	78%	0.78	S	S	*	*			trans	-154.4	137.2	179.9	-86.8	-165.9	173.1	-165.1	0	112.3
190	L	26	Very low	30.6	Very low	173 Å²	173	146.3 Å²	146.3	91%	0.906	79%	0.786	S	S	*	*			trans	-142.7	141.2	145.1	-80.7	96.1	0	0	0	105.8
191	R	28.3	Very low	30.5	Very low	217 Å²	217	145.2 Å²	145.2	82%	0.819	79%	0.789	S	S	*	*			cis	99.4	105	9.9	-158.8	-169.4	-165.4	-76.8	3.6	115.4
192	D	33.3	Very low	30.3	Very low	155 Å²	155	143.8 Å²	143.8	83%	0.829	79%	0.791	S	S	*	*			trans	-99.9	174.3	177.1	-61.1	-68.3	0	0	0	115.2
193	G	31	Very low	30.3	Very low	63 Å²	63	143.9 Å²	143.9	65%	0.649	79%	0.791	S	S	*	*			trans	145.9	150.8	168	0	0	0	0	0	112.1
194	I	32.3	Very low	31	Very low	154 Å²	154	140.8 Å²	140.8	79%	0.79	78%	0.783	S	S	*	*			cis	-166.2	148.4	6.3	-109.5	164.1	0	0	0	109.8
195	M	27.4	Very low	30.9	Very low	164 Å²	164	139.3 Å²	139.3	81%	0.808	78%	0.783	S	S	*	*			trans	62	161	165.9	-122.7	51.7	83.2	0	0	117.8
196	E	26.1	Very low	30	Very low	156 Å²	156	141.8 Å²	141.8	73%	0.729	79%	0.79	S	S	*	*			cis	-163.7	149.9	19.6	-176.3	166.8	-116.7	0	0	113.6
197	G	29.3	Very low	30	Very low	59 Å²	59	136.3 Å²	136.3	61%	0.608	77%	0.774	S	S	*	*			trans	64.5	152.6	157.8	0	0	0	0	0	119.8
198	Y	26.6	Very low	29.7	Very low	212 Å²	212	133.9 Å²	133.9	83%	0.831	77%	0.77	S	S	*	*			cis	-150.9	178.1	-0.1	-67.1	-88.9	0	0	0	110.5
199	S	32.6	Very low	29.8	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	77%	0.765	S	S	*	*			trans	-101.4	174.2	173.9	-48.6	0	0	0	0	111.3
200	S	31.6	Very low	29.1	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	76%	0.759	S	S	*	*			cis	-153.5	-168.5	16.5	-157.6	0	0	0	0	113.1
201	A	27.9	Very low	29.1	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	76%	0.755	S	S	*	*			trans	-90.4	160.9	-177.4	0	0	0	0	0	115
202	S	24.6	Very low	29	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	75%	0.753	S	S	*	*			trans	-173	146.4	136.5	50.6	0	0	0	0	113.9
203	S	28.9	Very low	28.7	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	75%	0.746	S	S	*	*			trans	-124.7	165.8	155	-42.4	0	0	0	0	106.6
204	P	45.5	Very low	28.6	Very low	113 Å²	113	133 Å²	133	73%	0.734	75%	0.754	S	S	*	*				-155.5	179.2	73.2	42.7	-22.2	0	0	0	117.2
205	S	29.3	Very low	28.3	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	76%	0.757	S	S	*	*			trans	39.5	135.7	146.5	-55.8	0	0	0	0	123.1
206	D	25.8	Very low	28.3	Very low	160 Å²	160	132.2 Å²	132.2	86%	0.856	76%	0.759	S	S	*	*				-148.3	171.5	108.6	-133.8	-28.7	0	0	0	113
207	T	29.8	Very low	28.3	Very low	89 Å²	89	131.2 Å²	131.2	55%	0.546	76%	0.763	S	S	.	*			trans	-134.1	140.9	-161.7	-27.4	0	0	0	0	110.8
208	F	25.3	Very low	28.8	Very low	157 Å²	157	134 Å²	134	69%	0.689	77%	0.771	S	S	*	*				167.7	152	87.8	-89	-70.5	0	0	0	112.4
209	H	26.4	Very low	28.8	Very low	161 Å²	161	129.1 Å²	129.1	75%	0.745	77%	0.767	S	S	*	*			trans	57.2	160	142.7	-64.8	-35.5	0	0	0	122.2
210	T	23.8	Very low	28.5	Very low	97 Å²	97	130.6 Å²	130.6	60%	0.595	77%	0.766	S	S	*	*			cis	-170.1	123.6	-26.1	-87	0	0	0	0	110
211	M	25.5	Very low	28.1	Very low	170 Å²	170	131.9 Å²	131.9	84%	0.837	76%	0.763	S	S	*	*			trans	59.8	173.8	160.8	-66	175.6	178.9	0	0	117
212	N	25.5	Very low	28.1	Very low	143 Å²	143	132.8 Å²	132.8	77%	0.765	76%	0.759	S	S	*	*			cis	-145	171.5	3.8	-149.4	-4.6	0	0	0	114.7
213	T	28.1	Very low	28.2	Very low	110 Å²	110	134.9 Å²	134.9	68%	0.675	76%	0.755	S	S	*	*			trans	-76.7	141.3	178.7	-44.8	0	0	0	0	114.8
214	Q	27.4	Very low	28	Very low	179 Å²	179	136 Å²	136	84%	0.836	76%	0.758	S	S	*	*			trans	-175.9	134.2	141	-99.7	159.2	31.7	0	0	107.1
215	Q	27.2	Very low	27.1	Very low	181 Å²	181	135.6 Å²	135.6	85%	0.846	76%	0.757	S	S	*	*			cis	85	81.7	30.9	-159.6	-173.4	37.3	0	0	115.1
216	S	26.5	Very low	26.8	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	76%	0.763	S	S	*	*			trans	-161	127.4	156.5	57.1	0	0	0	0	112.3
217	T	26	Very low	27	Very low	135 Å²	135	135.9 Å²	135.9	83%	0.828	76%	0.759	S	S	*	*			trans	-105.4	-172.9	160.6	58.8	0	0	0	0	108.2
218	P	40.9	Very low	26.8	Very low	118 Å²	118	139.5 Å²	139.5	77%	0.766	77%	0.769	S	S	*	*			cis	-122.9	174.9	-29	38.2	-25.3	0	0	0	112.2
219	S	25.6	Very low	26.9	Very low	108 Å²	108	136.7 Å²	136.7	76%	0.755	76%	0.764	S	S	*	*			trans	-179.1	128	132.6	60.3	0	0	0	0	115.3
220	N	26.2	Very low	27	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	76%	0.763	S	S	*	*			trans	40.3	102.5	135.3	-59.7	-6.7	0	0	0	122.3
221	N	24.8	Very low	27.1	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	77%	0.773	S	S	*	*				75.4	162.4	105.7	-154.4	18	0	0	0	120.9
222	V	27.4	Very low	27.2	Very low	109 Å²	109	134.4 Å²	134.4	66%	0.661	77%	0.771	S	S	*	*			trans	82.3	102	170.1	-170.7	0	0	0	0	117.2
223	H	25.7	Very low	27.3	Very low	164 Å²	164	132.3 Å²	132.3	76%	0.759	77%	0.774	S	S	*	*			trans	15.8	136.9	138.7	-54.7	-88.1	0	0	0	119.8
224	T	25.2	Very low	27.5	Very low	140 Å²	140	132.7 Å²	132.7	86%	0.859	78%	0.778	S	S	*	*				-164.8	147.9	91.2	-72.4	0	0	0	0	111.2
225	S	26	Very low	27.6	Very low	104 Å²	104	133.8 Å²	133.8	73%	0.727	78%	0.781	S	S	*	*			trans	-75	164	179.2	-47.4	0	0	0	0	113.1
226	L	24.7	Very low	27.9	Very low	160 Å²	160	131 Å²	131	84%	0.838	78%	0.778	S	S	*	*				142.8	151.1	119.7	-168.4	62.9	0	0	0	113
227	S	28.2	Very low	28.2	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	78%	0.781	S	S	*	*			trans	85.1	148.5	163.5	81.6	0	0	0	0	118.2
228	H	26.8	Very low	28.2	Very low	165 Å²	165	128.2 Å²	128.2	76%	0.764	78%	0.776	S	S	*	*			cis	-169	122	-27.9	177.1	-114.1	0	0	0	109.4
229	V	27.8	Very low	27.8	Very low	97 Å²	97	132.5 Å²	132.5	59%	0.588	78%	0.783	S	S	*	*			trans	78.5	123.8	146.2	149.9	0	0	0	0	122.5
230	Q	28.3	Very low	28	Very low	154 Å²	154	132.5 Å²	132.5	72%	0.72	78%	0.78	S	S	*	*			trans	79.6	130.9	138.9	-81.9	178.7	-22.2	0	0	125.3
231	N	26.2	Very low	28.5	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	78%	0.782	S	S	*	*			trans	71.9	121.6	140	-60	-14.2	0	0	0	119.1
232	G	27	Very low	28.7	Very low	79 Å²	79	134 Å²	134	81%	0.814	78%	0.779	S	S	*	*			trans	148.7	49	169.6	0	0	0	0	0	116.7
233	A	28	Very low	28.8	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	79%	0.788	S	S	*	*			trans	-74.8	136.8	154.8	0	0	0	0	0	107.8
234	P	32	Very low	29	Very low	119 Å²	119	134.5 Å²	134.5	77%	0.773	78%	0.782	S	S	*	*				-131	169.3	78.6	21.1	-1	0	0	0	115.2
235	F	29.1	Very low	29.3	Very low	202 Å²	202	135.1 Å²	135.1	89%	0.886	78%	0.775	S	S	*	*			trans	-59.1	141	-176.7	-52.7	-96.2	0	0	0	114.9
236	P	33.4	Very low	29.4	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	78%	0.778	S	S	*	*			trans	-101.6	123.9	148.5	33.5	-25.8	0	0	0	110.8
237	A	32.3	Very low	29.6	Very low	109 Å²	109	139 Å²	139	90%	0.901	77%	0.772	S	S	*	*			trans	-88.8	106.9	169.7	0	0	0	0	0	110.2
238	A	27.1	Very low	29.6	Very low	88 Å²	88	139.2 Å²	139.2	73%	0.727	77%	0.771	S	S	*	*			trans	-153.4	123.8	170.3	0	0	0	0	0	111.1
239	F	32.1	Very low	29.7	Very low	209 Å²	209	138.8 Å²	138.8	92%	0.917	77%	0.773	S	S	*	*			trans	-86	125.7	172.4	-68.9	-91.7	0	0	0	110.6
240	P	30.1	Very low	29.7	Very low	107 Å²	107	140.9 Å²	140.9	70%	0.695	78%	0.781	S	S	*	*			trans	-66.5	144.1	161	-17.3	32.2	0	0	0	110.8
241	K	37.3	Very low	29.6	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	78%	0.783	S	S	*	*			trans	-97.4	97.9	169.4	-80.3	-178.6	175.2	175.4	0	110	N243	K241-N243 PolarHBondContact O-N 2.89Å
242	D	27.4	Very low	29.8	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	78%	0.783	S	S	*	*			trans	-85.9	102.6	170.9	-71.5	-40.4	0	0	0	111.4	I244	D242-I244 VanDerWaalsContact C-N 3.33Å; D242-I244 PolarHBondContact O-N 2.72Å
243	N	30.9	Very low	29.9	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	79%	0.785	S	S	*	*			trans	-76.3	78.6	172.9	-77.3	-36	0	0	0	110.9	K241 H245	K241-N243 PolarHBondContact O-N 2.89Å; N243-H245 PolarHBondContact O-N 3.04Å
244	I	29.6	Very low	30	Very low	126 Å²	126	146.7 Å²	146.7	65%	0.646	79%	0.789	S	S	*	*			trans	-83.5	108.5	171.5	-60.9	-177.2	0	0	0	109.9	D242 F246	D242-I244 VanDerWaalsContact C-N 3.33Å; D242-I244 PolarHBondContact O-N 2.72Å; I244-F246 HydrophobicContact CB-CE2 4.39Å; I244-F246 HydrophobicContact CG2-CD2 4.27Å; I244-F246 HydrophobicContact CG2-CE2 3.91Å; I244-F246 HydrophobicContact CG2-CZ 4.32Å; I244-F246 WeakPolarHBondContact O-CD2 3.37Å; I244-F246 PolarHBondContact O-N 3.31Å; I244-F246 VanDerWaalsContact O-N 3.13Å
245	H	30.3	Very low	30.1	Very low	154 Å²	154	150.5 Å²	150.5	71%	0.713	79%	0.788	S	S	*	*			trans	-76.9	94.8	179.8	174.2	34.8	0	0	0	111.6	N243 K247	N243-H245 PolarHBondContact O-N 3.04Å; H245-K247 PolarHBondContact O-N 3.16Å
246	F	28.9	Very low	30.5	Very low	177 Å²	177	148 Å²	148	78%	0.776	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-70.4	117.1	169.9	-75.4	-87.6	0	0	0	111.3	I244	I244-F246 HydrophobicContact CB-CE2 4.39Å; I244-F246 HydrophobicContact CG2-CD2 4.27Å; I244-F246 HydrophobicContact CG2-CE2 3.91Å; I244-F246 HydrophobicContact CG2-CZ 4.32Å; I244-F246 WeakPolarHBondContact O-CD2 3.37Å; I244-F246 PolarHBondContact O-N 3.31Å; I244-F246 VanDerWaalsContact O-N 3.13Å
247	K	29	Very low	30.2	Very low	167 Å²	167	150.4 Å²	150.4	73%	0.726	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.5	138.6	158.9	-74.8	-178.3	176	177.1	0	109.2	H245	H245-K247 PolarHBondContact O-N 3.16Å
248	P	28.9	Very low	30	Very low	116 Å²	116	154.2 Å²	154.2	75%	0.753	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.1	128.8	175.4	29.8	-33.2	0	0	0	110.7	N250	P248-N250 PolarHBondContact O-N 3.41Å
249	I	27.5	Very low	30.2	Very low	156 Å²	156	157.5 Å²	157.5	80%	0.8	79%	0.788	S	S	*	*			trans	-81.8	108.6	165.8	-63.9	176	0	0	0	107.4
250	N	27.7	Very low	29.9	Very low	142 Å²	142	153.9 Å²	153.9	76%	0.759	78%	0.784	S	S	*	*			trans	-86.1	126.2	165.9	-93.2	-17.1	0	0	0	109.1	P248	P248-N250 PolarHBondContact O-N 3.41Å
251	T	27.3	Very low	30.4	Very low	124 Å²	124	157 Å²	157	76%	0.761	79%	0.786	S	S	*	*			trans	-124.8	77.1	168.3	-1.2	0	0	0	0	109.8
252	N	30.2	Very low	29.9	Very low	148 Å²	148	154 Å²	154	79%	0.791	78%	0.784	S	S	*	*			trans	-87.8	118.1	157.2	-76.3	-46.9	0	0	0	107.3
253	L	28.6	Very low	30.1	Very low	161 Å²	161	153 Å²	153	84%	0.843	78%	0.779	S	S	*	*			trans	-157.8	62.6	170.6	-126.7	156.8	0	0	0	112
254	D	31.4	Very low	30.2	Very low	167 Å²	167	152.8 Å²	152.8	89%	0.893	78%	0.776	S	S	*	*			trans	-75.9	122.5	150.3	-77.5	-52.6	0	0	0	108.1
255	R	34	Very low	30.1	Very low	200 Å²	200	154.4 Å²	154.4	76%	0.755	79%	0.786	S	S	*	*				173.3	120.2	122	-175.1	159.8	-170.8	165.2	10.9	112.4
256	E	36.2	Very low	30.4	Very low	148 Å²	148	152 Å²	152	69%	0.692	79%	0.786	S	S	*	*			trans	37.1	123.8	150.9	-62.2	168.8	157.8	0	0	120.6
257	N	27.1	Very low	30.3	Very low	173 Å²	173	152 Å²	152	93%	0.925	79%	0.793	S	S	*	*			trans	-150.4	138.8	136.1	-108.9	-25.3	0	0	0	109.5
258	E	29.3	Very low	30.3	Very low	189 Å²	189	150 Å²	150	88%	0.883	80%	0.795	S	S	*	*			trans	-91.5	166.2	177.5	-68	-168.8	103.2	0	0	112.5
259	L	30.7	Very low	30.5	Very low	156 Å²	156	148.7 Å²	148.7	82%	0.817	79%	0.789	S	S	*	*			trans	62.5	104.4	147.3	-157.4	76.5	0	0	0	118.6
260	T	26.5	Very low	30.7	Very low	134 Å²	134	150.5 Å²	150.5	82%	0.822	79%	0.794	S	S	*	*				-165.9	158.8	103.7	17.7	0	0	0	0	112.1
261	K	40.5	Very low	30.9	Very low	171 Å²	171	150.9 Å²	150.9	74%	0.743	80%	0.796	S	S	*	*			trans	-117.8	120.9	178.9	174.2	-154.6	169.8	-169.4	0	108.6
262	T	26.3	Very low	31	Very low	130 Å²	130	153.5 Å²	153.5	80%	0.798	80%	0.797	S	S	*	*			trans	-142.3	138.1	166.7	-44.2	0	0	0	0	109.5
263	D	31.2	Very low	31.4	Very low	116 Å²	116	153.5 Å²	153.5	62%	0.62	80%	0.802	S	S	*	*			trans	-91.5	-159.6	-174.7	-60.5	-86.1	0	0	0	112.4
264	I	33.6	Very low	31.7	Very low	153 Å²	153	154.1 Å²	154.1	79%	0.785	80%	0.799	S	S	*	*			trans	65.9	139.3	168.5	28.4	-177.3	0	0	0	116.7
265	L	27.3	Very low	31.7	Very low	161 Å²	161	152 Å²	152	84%	0.843	79%	0.787	S	S	*	*			cis	-127	137.2	21.7	-86.9	164.1	0	0	0	115.6
266	S	36.4	Very low	32.1	Very low	103 Å²	103	148.5 Å²	148.5	72%	0.72	79%	0.79	S	S	*	*			trans	-75.4	149.8	148.1	-49.9	0	0	0	0	109.9
267	L	26	Very low	32.5	Very low	176 Å²	176	149.4 Å²	149.4	92%	0.921	79%	0.792	S	S	*	*			trans	-138.1	123.7	159.7	-172	64.7	0	0	0	110.1
268	T	29.6	Very low	33.6	Very low	126 Å²	126	149.3 Å²	149.3	77%	0.773	78%	0.783	S	S	*	*			trans	-114.3	140.4	-176.6	33.9	0	0	0	0	112.3
269	S	33.8	Very low	34.8	Very low	89 Å²	89	149.3 Å²	149.3	62%	0.622	78%	0.783	S	S	*	*			trans	61.4	125.2	162.9	-163.9	0	0	0	0	119.3	N271	S269-N271 PolarHBondContact OG-N 2.94Å; S269-N271 PolarHBondContact OG-OD1 3.08Å
270	Q	30.4	Very low	36.4	Very low	194 Å²	194	144.7 Å²	144.7	91%	0.907	76%	0.759	S	S	*	*				-128.7	98	119.7	-75	-155.9	21.7	0	0	111.1
271	N	33.6	Very low	38.8	Very low	150 Å²	150	140.8 Å²	140.8	80%	0.802	74%	0.737	S	S	*	*			trans	24.1	95.1	146	-59.3	-16.3	0	0	0	118	S269	S269-N271 PolarHBondContact OG-N 2.94Å; S269-N271 PolarHBondContact OG-OD1 3.08Å
272	K	28.6	Very low	40.5	Very low	179 Å²	179	138 Å²	138	78%	0.778	73%	0.729	S	S	*	*			trans	-138.9	117.4	145	-155.4	169.9	-172.6	176.8	0	108.8	F274	K272-F274 HydrophobicContact CD-CE2 4.3Å; K272-F274 HydrophobicContact CG-CD2 4.43Å; K272-F274 HydrophobicContact CG-CE2 4.25Å; K272-F274 PolarHBondContact O-N 2.81Å
273	T	39	Very low	43.2	Very low	148 Å²	148	132.2 Å²	132.2	91%	0.908	69%	0.693	S	S	*	*			trans	-64.1	116.7	-172.8	-44.1	0	0	0	0	110.6
274	F	34.1	Very low	45.8	Very low	174 Å²	174	128.3 Å²	128.3	76%	0.763	67%	0.672	S	S	*	*			trans	-134	148.6	177.7	-97.2	-93.8	0	0	0	111.4	K272	K272-F274 HydrophobicContact CD-CE2 4.3Å; K272-F274 HydrophobicContact CG-CD2 4.43Å; K272-F274 HydrophobicContact CG-CE2 4.25Å; K272-F274 PolarHBondContact O-N 2.81Å
275	D	31.3	Very low	48.3	Very low	121 Å²	121	121.4 Å²	121.4	65%	0.647	64%	0.636	S	S	*	*			trans	-61.2	140.4	-174.4	-121.6	-29.1	0	0	0	112.7	K277	D275-K277 PolarHBondContact O-N 3.24Å
276	P	42.6	Very low	51	Low	127 Å²	127	115.8 Å²	115.8	83%	0.825	61%	0.611	S	S	*	*			trans	-76.7	58.5	178.8	33	-36.5	0	0	0	113	K278	P276-K278 VanDerWaalsContact C-N 3.34Å; P276-K278 PolarHBondContact O-N 2.8Å; P276-K278 VanDerWaalsContact O-N 3.13Å
277	K	44.2	Very low	53.4	Low	167 Å²	167	114.8 Å²	114.8	73%	0.726	60%	0.597	S	S	*	*			trans	-86	72.4	173.6	-78.7	-179.6	178.3	165.8	0	111.8	D275 E279	D275-K277 PolarHBondContact O-N 3.24Å; K277-E279 PolarHBondContact O-N 2.94Å
278	K	51.3	Low	56.3	Low	171 Å²	171	106.4 Å²	106.4	74%	0.743	55%	0.553	S	S	*	*			trans	17.3	77.3	158.4	-167.3	-179.2	-176.1	-179.4	0	114.1	P276	P276-K278 VanDerWaalsContact C-N 3.34Å; P276-K278 PolarHBondContact O-N 2.8Å; P276-K278 VanDerWaalsContact O-N 3.13Å
279	E	54.1	Low	59.2	Low	190 Å²	190	100.7 Å²	100.7	89%	0.888	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-66	137.5	178.5	-68.4	-171.1	135.6	0	0	110.9	K277	K277-E279 PolarHBondContact O-N 2.94Å
280	N	64.8	Low	62	Low	58 Å²	58	98.1 Å²	98.1	31%	0.31	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-83.1	130.9	-179.8	-63.7	-18.5	0	0	0	109.4	I282 K500	N280-I282 PolarHBondContact O-N 3.47Å; N280-K500 VanDerWaalsContact CB-O 3.22Å; N280-K500 WeakPolarHBondContact CB-O 3.45Å; N280-K500 WeakPolarHBondContact OD1-CB 3.48Å
281	P	75.3	Confident	64.9	Low	53 Å²	53	90.2 Å²	90.2	34%	0.344	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-57.8	131.3	175.3	23.1	-34.1	0	0	0	111.3	L495 T499 K500 V501 T502	P281-L495 HydrophobicContact CG-CD1 4.29Å; P281-T499 HydrophobicContact CG-CG2 4.4Å; P281-K500 WeakPolarHBondContact CD-O 3.41Å; P281-V501 HydrophobicContact CG-CG2 4.41Å; P281-V501 WeakPolarHBondContact O-CG1 3.22Å; P281-T502 PolarHBondContact O-N 3.03Å
282	I	77.2	Confident	67.8	Low	113 Å²	113	88.9 Å²	88.9	58%	0.579	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.2	176.9	-55.3	175.8	0	0	0	109	N280 T502 Q504	N280-I282 PolarHBondContact O-N 3.47Å; I282-T502 CarbonylContact C-O 3.56Å; I282-T502 WeakPolarHBondContact CA-O 3.37Å; I282-T502 HydrophobicContact CG1-CG2 4.16Å; I282-T502 HydrophobicContact CG2-CG2 4.41Å; I282-Q504 HydrophobicContact CG2-CB 4.34Å
283	V	81.9	Confident	70.9	Confident	7 Å²	7	83.6 Å²	83.6	4%	0.042	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.5	-176.3	178.2	0	0	0	0	109.8	D287 F288 Q491 V501 T502 I503 Q504	V283-D287 HydrophobicContact CG1-CB 4.38Å; V283-F288 HydrophobicContact CG1-CB 4.1Å; V283-F288 HydrophobicContact CG1-CD2 4.08Å; V283-Q491 HydrophobicContact CG1-CB 3.99Å; V283-Q491 HydrophobicContact CG1-CG 3.78Å; V283-Q491 HydrophobicContact CG2-CB 3.64Å; V283-Q491 HydrophobicContact CG2-CG 3.95Å; V283-V501 HydrophobicContact CB-CG1 3.91Å; V283-V501 HydrophobicContact CG2-CG1 3.59Å; V283-T502 PolarHBondContact N-O 2.72Å; V283-I503 CarbonylContact O-C 3.46Å; V283-I503 VanDerWaalsContact O-CA 3.3Å; V283-I503 WeakPolarHBondContact O-CA 3.33Å; V283-Q504 PolarHBondContact O-N 3.25Å
284	L	86.4	Confident	73.2	Confident	35 Å²	35	85.5 Å²	85.5	18%	0.183	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143	175.5	-66.7	171.4	0	0	0	112.2	S286 D287 F288 Q504 L507	L284-S286 WeakPolarHBondContact CB-OG 3.41Å; L284-S286 PolarHBondContact O-N 3.46Å; L284-D287 HydrophobicContact CB-CB 4.44Å; L284-D287 PolarHBondContact O-N 2.99Å; L284-F288 WeakPolarHBondContact O-CB 3.18Å; L284-F288 PolarHBondContact O-N 3.49Å; L284-F288 VanDerWaalsContact O-N 3.11Å; L284-Q504 CarbonylContact C-O 3.47Å; L284-Q504 WeakPolarHBondContact CA-O 3.3Å; L284-L507 HydrophobicContact CD1-CD1 3.98Å; L284-L507 HydrophobicContact CD1-CD2 4.17Å; L284-L507 HydrophobicContact CD1-CG 3.97Å; L284-L507 HydrophobicContact CD2-CD2 3.86Å; L284-L507 HydrophobicContact CD2-CG 3.93Å; L284-L507 HydrophobicContact CG-CD2 4.4Å
285	L	86.3	Confident	75.8	Confident	7 Å²	7	78.2 Å²	78.2	4%	0.037	40%	0.402	C	S	.	.	H	α-helix	trans	-55.1	-37.7	174.8	178.4	150.9	0	0	0	111.4	D287 F288 Y289 Y290 L388 L389 M392 I503 Q504 V505	L285-D287 VanDerWaalsContact C-N 3.35Å; L285-D287 PolarHBondContact O-N 3.41Å; L285-F288 PolarHBondContact O-N 3.41Å; L285-Y289 HydrophobicContact CG-CD2 4.17Å; L285-Y289 PolarHBondContact O-N 2.97Å; L285-Y290 HydrophobicContact CD2-CD2 4.43Å; L285-Y290 HydrophobicContact CD2-CE2 3.58Å; L285-L388 HydrophobicContact CD1-CD2 4.11Å; L285-L388 HydrophobicContact CD1-CG 4.16Å; L285-L389 HydrophobicContact CD1-CD1 3.47Å; L285-L389 VanDerWaalsContact CD1-CD1 3.47Å; L285-L389 HydrophobicContact CD1-CG 4.04Å; L285-M392 HydrophobicContact CD1-CG 3.77Å; L285-M392 HydrophobicContact CD2-CG 4.5Å; L285-M392 HydrophobicContact CG-CG 4.26Å; L285-I503 HydrophobicContact CB-CG2 3.89Å; L285-Q504 PolarHBondContact N-O 3.02Å; L285-V505 HydrophobicContact CD1-CG2 4.19Å
286	S	85.1	Confident	78.1	Confident	43 Å²	43	77.1 Å²	77.1	30%	0.301	40%	0.396	S	S	.	.	H	α-helix	trans	-54.7	-49	173.5	49.2	0	0	0	0	112.3	L284 F288 Y290	L284-S286 WeakPolarHBondContact CB-OG 3.41Å; L284-S286 PolarHBondContact O-N 3.46Å; S286-F288 VanDerWaalsContact C-N 3.29Å; S286-F288 PolarHBondContact O-N 3.46Å; S286-Y290 WeakPolarHBondContact O-CA 3.14Å; S286-Y290 WeakPolarHBondContact O-CB 3.22Å; S286-Y290 PolarHBondContact O-N 3.11Å; S286-Y290 VanDerWaalsContact O-O 3.13Å
287	D	86.1	Confident	78.9	Confident	82 Å²	82	74.4 Å²	74.4	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-81.1	-17.6	-169.6	-60.4	18	0	0	0	111.8	V283 L284 L285	V283-D287 HydrophobicContact CG1-CB 4.38Å; L284-D287 HydrophobicContact CB-CB 4.44Å; L284-D287 PolarHBondContact O-N 2.99Å; L285-D287 VanDerWaalsContact C-N 3.35Å; L285-D287 PolarHBondContact O-N 3.41Å
288	F	87.1	Confident	79.6	Confident	1 Å²	1	74 Å²	74	0%	0.004	39%	0.392	C	S	.	.	H	α-helix	trans	-93.7	-43.1	-179.5	-161.3	-95.6	0	0	0	112.9	V283 L284 L285 S286 P398 G399 P489 L492 V501 I503 V522	V283-F288 HydrophobicContact CG1-CB 4.1Å; V283-F288 HydrophobicContact CG1-CD2 4.08Å; L284-F288 WeakPolarHBondContact O-CB 3.18Å; L284-F288 PolarHBondContact O-N 3.49Å; L284-F288 VanDerWaalsContact O-N 3.11Å; L285-F288 PolarHBondContact O-N 3.41Å; S286-F288 VanDerWaalsContact C-N 3.29Å; S286-F288 PolarHBondContact O-N 3.46Å; F288-P398 HydrophobicContact CD1-CB 3.9Å; F288-P398 HydrophobicContact CD1-CG 4.14Å; F288-P398 HydrophobicContact CE1-CB 3.7Å; F288-P398 HydrophobicContact CE1-CG 3.5Å; F288-P398 VanDerWaalsContact CE1-CG 3.5Å; F288-P398 HydrophobicContact CZ-CB 4.23Å; F288-P398 HydrophobicContact CZ-CG 4.05Å; F288-P398 CarbonylContact O-C 3.55Å; F288-P398 WeakPolarHBondContact O-CA 3.24Å; F288-P398 WeakPolarHBondContact O-CB 3.44Å; F288-G399 PolarHBondContact O-N 3.1Å; F288-P489 VanDerWaalsContact O-CG 3.23Å; F288-P489 WeakPolarHBondContact O-CG 3.42Å; F288-L492 HydrophobicContact CE2-CD1 3.78Å; F288-L492 HydrophobicContact CE2-CD2 3.82Å; F288-L492 HydrophobicContact CE2-CG 3.82Å; F288-L492 HydrophobicContact CZ-CD1 3.92Å; F288-L492 HydrophobicContact CZ-CD2 4.4Å; F288-L492 HydrophobicContact CZ-CG 4.43Å; F288-V501 HydrophobicContact CE2-CG1 4.38Å; F288-I503 HydrophobicContact CD1-CD1 3.6Å; F288-I503 HydrophobicContact CD2-CD1 4.43Å; F288-I503 HydrophobicContact CE1-CD1 3.6Å; F288-I503 HydrophobicContact CE2-CD1 4.44Å; F288-I503 HydrophobicContact CG-CD1 4.02Å; F288-I503 HydrophobicContact CZ-CD1 4.05Å; F288-V522 HydrophobicContact CE1-CG2 4.03Å; F288-V522 HydrophobicContact CZ-CB 4.07Å; F288-V522 HydrophobicContact CZ-CG1 4.09Å; F288-V522 HydrophobicContact CZ-CG2 3.82Å
289	Y	89.8	Confident	80.1	Confident	6 Å²	6	71.3 Å²	71.3	2%	0.024	39%	0.392	C	S	.	.	H	α-helix	trans	-101.6	-29.7	-176.6	-76.4	-79.5	0	0	0	114.3	L285 M392 K393 H396 I503	L285-Y289 HydrophobicContact CG-CD2 4.17Å; L285-Y289 PolarHBondContact O-N 2.97Å; Y289-M392 HydrophobicContact CD1-CB 4.25Å; Y289-M392 HydrophobicContact CD1-SD 4.47Å; Y289-M392 HydrophobicContact CD2-CB 3.96Å; Y289-M392 HydrophobicContact CD2-CG 4.04Å; Y289-M392 HydrophobicContact CE1-CB 3.93Å; Y289-M392 WeakPolarHBondContact CE1-O 3.28Å; Y289-M392 HydrophobicContact CE2-CB 3.59Å; Y289-M392 HydrophobicContact CE2-CG 4.16Å; Y289-M392 HydrophobicContact CG-CB 4.27Å; Y289-M392 HydrophobicContact CG-CG 4.29Å; Y289-M392 HydrophobicContact CG-SD 4.24Å; Y289-K393 WeakPolarHBondContact OH-CA 3.33Å; Y289-K393 PolarHBondContact OH-N 3.25Å; Y289-H396 HydrophobicContact CD1-CB 4.14Å; Y289-H396 HydrophobicContact CE1-CB 4.29Å; Y289-I503 HydrophobicContact CE2-CD1 4.05Å
290	Y	92.4	Very high	80.9	Confident	34 Å²	34	64.4 Å²	64.4	13%	0.133	36%	0.36	C	S	.	.			trans	-109.1	146.2	-170.2	-49.9	-32.9	0	0	0	112.8	L285 S286 K376 I377 M392 S413	L285-Y290 HydrophobicContact CD2-CD2 4.43Å; L285-Y290 HydrophobicContact CD2-CE2 3.58Å; S286-Y290 WeakPolarHBondContact O-CA 3.14Å; S286-Y290 WeakPolarHBondContact O-CB 3.22Å; S286-Y290 PolarHBondContact O-N 3.11Å; S286-Y290 VanDerWaalsContact O-O 3.13Å; Y290-K376 HydrophobicContact CD2-CB 4.18Å; Y290-K376 HydrophobicContact CD2-CD 3.97Å; Y290-K376 HydrophobicContact CD2-CG 4.32Å; Y290-K376 HydrophobicContact CE1-CB 4.3Å; Y290-K376 HydrophobicContact CE2-CB 3.75Å; Y290-K376 HydrophobicContact CE2-CD 3.74Å; Y290-K376 HydrophobicContact CE2-CG 3.71Å; Y290-K376 PolarHBondContact OH-N 3.39Å; Y290-I377 HydrophobicContact CD1-CD1 3.94Å; Y290-I377 HydrophobicContact CD1-CG1 3.89Å; Y290-I377 HydrophobicContact CE1-CD1 3.73Å; Y290-I377 HydrophobicContact CE1-CG1 3.71Å; Y290-M392 HydrophobicContact CE1-SD 4.1Å; Y290-S413 WeakPolarHBondContact CA-OG 3.43Å
291	G	92.3	Very high	81.6	Confident	28 Å²	28	69.8 Å²	69.8	29%	0.289	38%	0.383	S	S	.	.			trans	-165.6	169.3	177.6	0	0	0	0	0	113.7	S412 S413	G291-S412 WeakPolarHBondContact O-CA 3.47Å; G291-S412 PolarHBondContact O-OG 3.33Å; G291-S413 PolarHBondContact N-OG 3.13Å; G291-S413 PolarHBondContact O-N 3.35Å; G291-S413 PolarHBondContact O-OG 2.77Å
292	Q	93.7	Very high	82	Confident	123 Å²	123	73.4 Å²	73.4	58%	0.575	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.6	173.5	-68.3	-176.7	5.8	0	0	110.4	M401 Y410 R411 D417	Q292-M401 VanDerWaalsContact CA-CE 3.49Å; Q292-Y410 PolarHBondContact OE1-OH 3.39Å; Q292-R411 CarbonylContact C-O 3.51Å; Q292-R411 WeakPolarHBondContact CA-O 3.25Å; Q292-D417 PolarHBondContact NE2-OD2 3.07Å
293	H	93.1	Very high	82.3	Confident	68 Å²	68	71 Å²	71	32%	0.315	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	112.7	179.3	179.2	-95.2	0	0	0	109	G295 M401 Y410 R411 F486	H293-G295 PolarHBondContact O-N 3.09Å; H293-M401 HydrophobicContact CB-CE 3.58Å; H293-M401 VanDerWaalsContact N-CE 3.31Å; H293-Y410 WeakPolarHBondContact O-CA 3.48Å; H293-Y410 WeakPolarHBondContact O-CD2 3.37Å; H293-R411 HydrophobicContact CB-CB 4.25Å; H293-R411 PolarHBondContact N-O 3.12Å; H293-R411 PolarHBondContact O-N 3.01Å; H293-F486 HydrophobicContact CB-CD1 4.48Å; H293-F486 HydrophobicContact CB-CE1 3.85Å; H293-F486 AromaticContact CD2-CE1 3.67Å; H293-F486 AromaticContact CG-CE1 3.57Å; H293-F486 AromaticContact ND1-CE1 3.99Å
294	K	88.6	Confident	82.3	Confident	188 Å²	188	75.9 Å²	75.9	82%	0.817	41%	0.406	S	S	*	.			trans	-64	112.8	166	-61.3	-176.2	-179.2	-175.7	0	107
295	G	87.4	Confident	82.5	Confident	21 Å²	21	76.3 Å²	76.3	22%	0.216	41%	0.41	C	S	.	.			trans	-76.6	-141.4	179.7	0	0	0	0	0	112.1	H293 G297 C408	H293-G295 PolarHBondContact O-N 3.09Å; G295-G297 PolarHBondContact O-N 3.3Å; G295-C408 CarbonylContact C-O 3.57Å; G295-C408 WeakPolarHBondContact CA-O 3.44Å
296	D	80.3	Confident	82.9	Confident	97 Å²	97	79.9 Å²	79.9	52%	0.519	43%	0.432	S	S	.	.	S	Bend	trans	-60.1	99.1	173.6	-58.9	-47.1	0	0	0	109.4	Q298 C408 H409	D296-Q298 PolarHBondContact O-N 3.48Å; D296-C408 PolarHBondContact N-O 3.24Å; D296-H409 IonicContact OD2-CE1 2.85Å; D296-H409 IonicContact OD2-CG 2.67Å; D296-H409 IonicContact OD2-ND1 3.89Å; D296-H409 PolarHBondContact OD2-ND1 3.39Å
297	G	59.3	Low	83.4	Confident	71 Å²	71	78.2 Å²	78.2	73%	0.732	42%	0.419	S	S	*	.			trans	-71.1	25.3	-169	0	0	0	0	0	115.9	G295	G295-G297 PolarHBondContact O-N 3.3Å
298	Q	59.4	Low	83.9	Confident	159 Å²	159	80.3 Å²	80.3	74%	0.743	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-94	121.2	178.4	-66.1	-60.2	-34.2	0	0	110.1	D296 E300	D296-Q298 PolarHBondContact O-N 3.48Å; Q298-E300 PolarHBondContact O-N 3.06Å
299	P	62.6	Low	84.2	Confident	113 Å²	113	80.3 Å²	80.3	73%	0.734	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-65.7	124.1	175.6	27	-32.8	0	0	0	109.8	Q301	P299-Q301 PolarHBondContact O-N 2.95Å
300	E	70.9	Confident	84.2	Confident	46 Å²	46	84.9 Å²	84.9	22%	0.215	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-63.6	133.4	178.7	-171.3	-180	-165.9	0	0	110.3	Q298 K302 V407 H426 T429 N431	Q298-E300 PolarHBondContact O-N 3.06Å; E300-K302 PolarHBondContact O-N 3.19Å; E300-K302 VanDerWaalsContact O-N 3.14Å; E300-V407 WeakPolarHBondContact OE2-CG1 3.26Å; E300-H426 IonicContact OE2-CE1 2.74Å; E300-H426 IonicContact OE2-CG 3.8Å; E300-H426 IonicContact OE2-ND1 3.75Å; E300-H426 PolarHBondContact OE2-ND1 2.86Å; E300-T429 HydrophobicContact CB-CG2 4.22Å; E300-T429 HydrophobicContact CG-CG2 4.15Å; E300-T429 VanDerWaalsContact OE2-CG2 3.29Å; E300-T429 WeakPolarHBondContact OE2-CG2 3.41Å; E300-N431 PolarHBondContact OE1-ND2 2.75Å; E300-N431 PolarHBondContact OE2-ND2 3.21Å
301	Q	78.5	Confident	84	Confident	170 Å²	170	85.6 Å²	85.6	79%	0.794	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-58.7	120.1	178.7	-70.6	-176.1	-12.9	0	0	110.6	P299 T303	P299-Q301 PolarHBondContact O-N 2.95Å; Q301-T303 PolarHBondContact O-N 3.22Å
302	K	83.3	Confident	84	Confident	130 Å²	130	86.2 Å²	86.2	57%	0.565	46%	0.459	S	S	*	.			trans	-66.6	99.4	179.1	-65.9	-177.1	177.5	-179.6	0	109.7	E300 H304 N428	E300-K302 PolarHBondContact O-N 3.19Å; E300-K302 VanDerWaalsContact O-N 3.14Å; K302-H304 VanDerWaalsContact C-N 3.26Å; K302-H304 PolarHBondContact O-CD2 3.34Å; K302-H304 PolarHBondContact O-N 2.95Å; K302-N428 HydrophobicContact CB-CB 4.44Å
303	T	82.9	Confident	83.9	Confident	62 Å²	62	84.9 Å²	84.9	38%	0.38	46%	0.458	S	S	.	.			trans	-78.3	-7.7	-179.5	56.3	0	0	0	0	113.8	Q301 T305 N428 K430	Q301-T303 PolarHBondContact O-N 3.22Å; T303-T305 WeakPolarHBondContact CB-OG1 3.02Å; T303-T305 PolarHBondContact O-N 3.44Å; T303-T305 PolarHBondContact OG1-OG1 3.19Å; T303-N428 PolarHBondContact N-O 3.02Å; T303-K430 HydrophobicContact CG2-CD 4.45Å; T303-K430 PolarHBondContact OG1-N 3.2Å; T303-K430 VanDerWaalsContact OG1-N 3.13Å
304	H	81.9	Confident	84	Confident	109 Å²	109	87.5 Å²	87.5	51%	0.505	47%	0.469	S	S	.	.			trans	54.9	23	-177.1	-75.8	-135.7	0	0	0	113.8	K302 N428	K302-H304 VanDerWaalsContact C-N 3.26Å; K302-H304 PolarHBondContact O-CD2 3.34Å; K302-H304 PolarHBondContact O-N 2.95Å; H304-N428 WeakPolarHBondContact CA-O 3.36Å; H304-N428 PolarHBondContact N-O 2.99Å
305	T	91.3	Very high	84.3	Confident	44 Å²	44	82.7 Å²	82.7	27%	0.27	46%	0.455	S	S	.	.			trans	-62.2	134.5	-173.5	-54.3	0	0	0	0	112.1	T303 F307 K430	T303-T305 WeakPolarHBondContact CB-OG1 3.02Å; T303-T305 PolarHBondContact O-N 3.44Å; T303-T305 PolarHBondContact OG1-OG1 3.19Å; T305-F307 HydrophobicContact CG2-CE1 4.38Å; T305-F307 HydrophobicContact CG2-CE2 3.89Å; T305-F307 HydrophobicContact CG2-CZ 3.76Å; T305-K430 HydrophobicContact CG2-CB 4.3Å
306	T	94.9	Very high	84.7	Confident	82 Å²	82	83.8 Å²	83.8	50%	0.503	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.2	175.5	56.1	0	0	0	0	111.8	V315 L316 K317	T306-V315 HydrophobicContact CG2-CG1 4.28Å; T306-L316 CarbonylContact C-O 3.54Å; T306-L316 WeakPolarHBondContact CA-O 3.23Å; T306-K317 HydrophobicContact CG2-CG 4.24Å
307	F	96.3	Very high	85.3	Confident	8 Å²	8	82.7 Å²	82.7	4%	0.035	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133.2	-174.1	-61.6	-91.7	0	0	0	109.3	T305 V315 L316 N318 F321 K430 L432 A444	T305-F307 HydrophobicContact CG2-CE1 4.38Å; T305-F307 HydrophobicContact CG2-CE2 3.89Å; T305-F307 HydrophobicContact CG2-CZ 3.76Å; F307-V315 WeakPolarHBondContact O-CA 3.47Å; F307-L316 PolarHBondContact N-O 2.87Å; F307-L316 PolarHBondContact O-N 3.25Å; F307-N318 HydrophobicContact CD2-CB 4.29Å; F307-N318 HydrophobicContact CE2-CB 3.76Å; F307-F321 HydrophobicContact CB-CB 4.05Å; F307-F321 HydrophobicContact CB-CD1 3.84Å; F307-F321 HydrophobicContact CB-CD2 3.42Å; F307-F321 VanDerWaalsContact CB-CD2 3.42Å; F307-F321 HydrophobicContact CB-CE1 4.1Å; F307-F321 HydrophobicContact CB-CE2 3.72Å; F307-F321 HydrophobicContact CB-CG 3.48Å; F307-F321 VanDerWaalsContact CB-CG 3.48Å; F307-F321 HydrophobicContact CB-CZ 4.05Å; F307-F321 HydrophobicContact CG-CD1 4.25Å; F307-F321 HydrophobicContact CG-CG 4.23Å; F307-K430 WeakPolarHBondContact CZ-O 3.4Å; F307-L432 HydrophobicContact CD1-CD1 3.7Å; F307-L432 HydrophobicContact CD1-CD2 4.33Å; F307-L432 HydrophobicContact CD1-CG 4.21Å; F307-L432 HydrophobicContact CD2-CD2 4.11Å; F307-L432 HydrophobicContact CE1-CD1 3.76Å; F307-L432 HydrophobicContact CE1-CD2 4.25Å; F307-L432 HydrophobicContact CE1-CG 3.89Å; F307-L432 HydrophobicContact CE2-CD2 4.06Å; F307-L432 HydrophobicContact CG-CD1 4.29Å; F307-L432 HydrophobicContact CG-CD2 4.26Å; F307-L432 HydrophobicContact CZ-CD1 4.41Å; F307-L432 HydrophobicContact CZ-CD2 4.11Å; F307-L432 HydrophobicContact CZ-CG 4.06Å; F307-A444 HydrophobicContact CB-CB 4.34Å; F307-A444 HydrophobicContact CD1-CB 4.3Å
308	K	95.8	Very high	87	Confident	127 Å²	127	79.3 Å²	79.3	55%	0.552	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.7	179.2	-173.5	-178.9	-179.9	-177.7	0	109.6	V315	K308-V315 HydrophobicContact CB-CG2 4.25Å; K308-V315 HydrophobicContact CG-CG2 4.2Å
309	C	93.6	Very high	88.6	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.007	38%	0.382	C	S	.	.			trans	-70.9	130.5	173.9	-176.7	0	0	0	0	109.7	S311 V313 K314 F321	C309-S311 PolarHBondContact SG-N 2.94Å; C309-V313 WeakPolarHBondContact O-CA 3.5Å; C309-V313 PolarHBondContact O-N 3.47Å; C309-K314 PolarHBondContact N-O 3.02Å; C309-F321 HydrophobicContact CB-CE2 4.19Å
310	L	89.9	Confident	90.2	Very high	101 Å²	101	73.8 Å²	73.8	53%	0.529	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-34.1	175.9	-69.2	93	0	0	0	111.8	C312 A444 T445 M448	L310-C312 PolarHBondContact O-N 3.47Å; L310-A444 HydrophobicContact CD1-CB 4.49Å; L310-T445 HydrophobicContact CD1-CG2 4.29Å; L310-T445 HydrophobicContact CD2-CG2 3.92Å; L310-M448 HydrophobicContact CB-CE 4.3Å; L310-M448 HydrophobicContact CB-SD 4.2Å; L310-M448 HydrophobicContact CD1-SD 3.62Å
311	S	88	Confident	91.4	Very high	50 Å²	50	71.6 Å²	71.6	35%	0.35	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-27.4	-178.9	-55.4	0	0	0	0	114.5	C309 E332	C309-S311 PolarHBondContact SG-N 2.94Å; S311-E332 PolarHBondContact OG-OE1 2.79Å
312	C	91.7	Very high	92.1	Very high	41 Å²	41	63.9 Å²	63.9	28%	0.277	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	16.4	-178.8	76.2	0	0	0	0	116	L310 K314 H324 H328	L310-C312 PolarHBondContact O-N 3.47Å; C312-K314 PolarHBondContact O-N 3.02Å; C312-H324 PolarHBondContact SG-CE1 3.33Å; C312-H324 PolarHBondContact SG-NE2 2.79Å; C312-H328 PolarHBondContact SG-NE2 3.35Å
313	V	92.9	Very high	92.5	Very high	94 Å²	94	61.4 Å²	61.4	57%	0.57	32%	0.322	S	S	*	.			trans	67.4	-12.8	172.5	-163.5	0	0	0	0	115.2	C309 V315	C309-V313 WeakPolarHBondContact O-CA 3.5Å; C309-V313 PolarHBondContact O-N 3.47Å; V313-V315 PolarHBondContact O-N 3.42Å
314	K	94.2	Very high	93.1	Very high	124 Å²	124	59.9 Å²	59.9	54%	0.539	31%	0.31	S	S	.	.			trans	-54.8	135.2	179.9	-71.9	180	-175.7	173.1	0	112.7	C309 C312	C309-K314 PolarHBondContact N-O 3.02Å; C312-K314 PolarHBondContact O-N 3.02Å
315	V	95.8	Very high	93.5	Very high	87 Å²	87	54.7 Å²	54.7	53%	0.527	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.2	178.2	178.1	0	0	0	0	109.4	T306 F307 K308 V313	T306-V315 HydrophobicContact CG2-CG1 4.28Å; F307-V315 WeakPolarHBondContact O-CA 3.47Å; K308-V315 HydrophobicContact CB-CG2 4.25Å; K308-V315 HydrophobicContact CG-CG2 4.2Å; V313-V315 PolarHBondContact O-N 3.42Å
316	L	95.1	Very high	93.4	Very high	44 Å²	44	55.5 Å²	55.5	23%	0.23	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	148.8	-171	-65.2	172.9	0	0	0	111.8	T306 F307 K320 F321 H324	T306-L316 CarbonylContact C-O 3.54Å; T306-L316 WeakPolarHBondContact CA-O 3.23Å; F307-L316 PolarHBondContact N-O 2.87Å; F307-L316 PolarHBondContact O-N 3.25Å; L316-K320 HydrophobicContact CB-CB 4.3Å; L316-K320 HydrophobicContact CD2-CB 4.44Å; L316-F321 HydrophobicContact CB-CB 3.95Å; L316-H324 HydrophobicContact CD1-CB 3.48Å; L316-H324 VanDerWaalsContact CD1-CB 3.48Å; L316-H324 WeakPolarHBondContact CD1-CD2 3.4Å; L316-H324 VanDerWaalsContact CD1-CG 3.46Å
317	K	94.1	Very high	93	Very high	73 Å²	73	58 Å²	58	32%	0.317	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	156	168.9	-64.3	-169.5	178.7	-179.8	0	111.3	T306 V319 K320 F321 N428	T306-K317 HydrophobicContact CG2-CG 4.24Å; K317-V319 PolarHBondContact O-N 2.8Å; K317-K320 CarbonylContact O-C 3.56Å; K317-K320 PolarHBondContact O-N 3.3Å; K317-F321 WeakPolarHBondContact O-CB 3.5Å; K317-F321 PolarHBondContact O-N 2.94Å; K317-N428 WeakPolarHBondContact CD-OD1 3.42Å; K317-N428 WeakPolarHBondContact CE-OD1 3.38Å; K317-N428 PolarHBondContact NZ-OD1 3.36Å
318	N	93.7	Very high	92.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-42.1	-59	-169.8	71.8	-29.1	0	0	0	115.9	F307 K320 F321 M322 H426 N428 T429 N431 L432	F307-N318 HydrophobicContact CD2-CB 4.29Å; F307-N318 HydrophobicContact CE2-CB 3.76Å; N318-K320 VanDerWaalsContact C-N 3.33Å; N318-K320 PolarHBondContact O-N 2.73Å; N318-F321 WeakPolarHBondContact O-CB 3.41Å; N318-F321 PolarHBondContact O-N 2.9Å; N318-F321 VanDerWaalsContact O-N 3.13Å; N318-M322 WeakPolarHBondContact O-CG 3.46Å; N318-M322 PolarHBondContact O-N 3.25Å; N318-H426 PolarHBondContact ND2-O 3.45Å; N318-N428 PolarHBondContact OD1-N 2.97Å; N318-T429 PolarHBondContact ND2-OG1 3.02Å; N318-N431 WeakPolarHBondContact CB-O 3.44Å; N318-N431 PolarHBondContact ND2-O 3.3Å; N318-L432 HydrophobicContact CB-CD2 3.82Å
319	V	94.2	Very high	92	Very high	20 Å²	20	53.9 Å²	53.9	12%	0.121	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-38	-177.4	-179.5	0	0	0	0	112.5	K317 M322 N323 R423 E427	K317-V319 PolarHBondContact O-N 2.8Å; V319-M322 HydrophobicContact CB-CE 4.36Å; V319-M322 HydrophobicContact CG2-CE 4.12Å; V319-N323 PolarHBondContact O-N 2.84Å; V319-R423 HydrophobicContact CG1-CG 4.31Å; V319-E427 HydrophobicContact CB-CG 4.38Å; V319-E427 HydrophobicContact CG2-CB 4.39Å; V319-E427 HydrophobicContact CG2-CG 3.74Å
320	K	94.8	Very high	91.4	Very high	137 Å²	137	54.6 Å²	54.6	60%	0.596	28%	0.278	S	S	*	.	H	α-helix	trans	-70.8	-36.1	175.8	-60.5	-169.9	179	-173.7	0	111.6	L316 K317 N318 H324	L316-K320 HydrophobicContact CB-CB 4.3Å; L316-K320 HydrophobicContact CD2-CB 4.44Å; K317-K320 CarbonylContact O-C 3.56Å; K317-K320 PolarHBondContact O-N 3.3Å; N318-K320 VanDerWaalsContact C-N 3.33Å; N318-K320 PolarHBondContact O-N 2.73Å; K320-H324 WeakPolarHBondContact O-CB 3.42Å; K320-H324 PolarHBondContact O-N 3.29Å
321	F	95.7	Very high	91.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.1	-46.7	175.8	179.6	-97	0	0	0	112.2	F307 C309 L316 K317 N318 N323 H324 V325 L432 A444 Y447 M448	F307-F321 HydrophobicContact CB-CB 4.05Å; F307-F321 HydrophobicContact CB-CD1 3.84Å; F307-F321 HydrophobicContact CB-CD2 3.42Å; F307-F321 VanDerWaalsContact CB-CD2 3.42Å; F307-F321 HydrophobicContact CB-CE1 4.1Å; F307-F321 HydrophobicContact CB-CE2 3.72Å; F307-F321 HydrophobicContact CB-CG 3.48Å; F307-F321 VanDerWaalsContact CB-CG 3.48Å; F307-F321 HydrophobicContact CB-CZ 4.05Å; F307-F321 HydrophobicContact CG-CD1 4.25Å; F307-F321 HydrophobicContact CG-CG 4.23Å; C309-F321 HydrophobicContact CB-CE2 4.19Å; L316-F321 HydrophobicContact CB-CB 3.95Å; K317-F321 WeakPolarHBondContact O-CB 3.5Å; K317-F321 PolarHBondContact O-N 2.94Å; N318-F321 WeakPolarHBondContact O-CB 3.41Å; N318-F321 PolarHBondContact O-N 2.9Å; N318-F321 VanDerWaalsContact O-N 3.13Å; F321-N323 PolarHBondContact O-N 2.89Å; F321-H324 WeakPolarHBondContact O-CB 3.47Å; F321-H324 PolarHBondContact O-N 2.8Å; F321-V325 HydrophobicContact CD1-CG2 4.15Å; F321-V325 HydrophobicContact CD2-CG2 4.35Å; F321-V325 HydrophobicContact CE1-CG2 3.74Å; F321-V325 HydrophobicContact CE2-CG2 3.94Å; F321-V325 HydrophobicContact CG-CG2 4.45Å; F321-V325 HydrophobicContact CZ-CG2 3.61Å; F321-V325 WeakPolarHBondContact O-CG2 3.38Å; F321-V325 PolarHBondContact O-N 3.27Å; F321-L432 HydrophobicContact CD1-CD1 3.85Å; F321-L432 HydrophobicContact CD1-CD2 3.74Å; F321-L432 HydrophobicContact CD1-CG 4.47Å; F321-L432 HydrophobicContact CE1-CD1 3.69Å; F321-L432 HydrophobicContact CE1-CD2 4.43Å; F321-A444 HydrophobicContact CE1-CB 4.28Å; F321-A444 HydrophobicContact CE2-CB 4.27Å; F321-A444 HydrophobicContact CZ-CB 3.66Å; F321-Y447 HydrophobicContact CD1-CD1 4.42Å; F321-Y447 HydrophobicContact CD1-CE1 4.47Å; F321-Y447 AromaticContact CE1-CD1 3.73Å; F321-Y447 HydrophobicContact CE1-CD1 3.73Å; F321-Y447 HydrophobicContact CE1-CE1 4.15Å; F321-M448 HydrophobicContact CZ-CG 4.18Å; F321-M448 HydrophobicContact CZ-SD 4.08Å
322	M	94.3	Very high	90.7	Very high	8 Å²	8	55.4 Å²	55.4	4%	0.039	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-49	177.3	-65.5	-173.2	-63	0	0	111.7	N318 V319 H324 V325 K326 F422 L432 L433 Y447	N318-M322 WeakPolarHBondContact O-CG 3.46Å; N318-M322 PolarHBondContact O-N 3.25Å; V319-M322 HydrophobicContact CB-CE 4.36Å; V319-M322 HydrophobicContact CG2-CE 4.12Å; M322-H324 VanDerWaalsContact C-N 3.29Å; M322-H324 PolarHBondContact O-N 3.47Å; M322-V325 PolarHBondContact O-N 3.46Å; M322-K326 PolarHBondContact O-N 3.29Å; M322-F422 HydrophobicContact CE-CD1 3.94Å; M322-F422 HydrophobicContact CE-CE1 3.61Å; M322-F422 HydrophobicContact SD-CE1 4Å; M322-L432 HydrophobicContact CG-CB 4.42Å; M322-L432 HydrophobicContact CG-CD2 3.85Å; M322-L432 HydrophobicContact SD-CB 4.49Å; M322-L433 HydrophobicContact SD-CB 3.94Å; M322-L433 PolarHBondContact SD-N 2.79Å; M322-L433 VanDerWaalsContact SD-O 3.41Å; M322-Y447 WeakPolarHBondContact CB-OH 3.39Å; M322-Y447 HydrophobicContact CG-CE1 4.45Å; M322-Y447 HydrophobicContact CG-CE2 4.45Å; M322-Y447 WeakPolarHBondContact CG-OH 3.28Å
323	N	92.6	Very high	89.8	Confident	77 Å²	77	54.5 Å²	54.5	41%	0.412	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-37.2	178.5	-70.8	7.2	0	0	0	112.1	V319 F321 H327 R423	V319-N323 PolarHBondContact O-N 2.84Å; F321-N323 PolarHBondContact O-N 2.89Å; N323-H327 PolarHBondContact O-N 2.97Å; N323-H327 VanDerWaalsContact O-N 3.1Å; N323-R423 PolarHBondContact OD1-NH1 3.35Å; N323-R423 PolarHBondContact OD1-NH2 3.22Å; N323-R423 VanDerWaalsContact OD1-NH2 3.1Å
324	H	93.8	Very high	88.8	Confident	30 Å²	30	54.5 Å²	54.5	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-68.8	-39.7	176.8	172.5	59.1	0	0	0	112.9	C312 L316 K320 F321 M322 H327 H328	C312-H324 PolarHBondContact SG-CE1 3.33Å; C312-H324 PolarHBondContact SG-NE2 2.79Å; L316-H324 HydrophobicContact CD1-CB 3.48Å; L316-H324 VanDerWaalsContact CD1-CB 3.48Å; L316-H324 WeakPolarHBondContact CD1-CD2 3.4Å; L316-H324 VanDerWaalsContact CD1-CG 3.46Å; K320-H324 WeakPolarHBondContact O-CB 3.42Å; K320-H324 PolarHBondContact O-N 3.29Å; F321-H324 WeakPolarHBondContact O-CB 3.47Å; F321-H324 PolarHBondContact O-N 2.8Å; M322-H324 VanDerWaalsContact C-N 3.29Å; M322-H324 PolarHBondContact O-N 3.47Å; H324-H327 PolarHBondContact O-N 3.39Å; H324-H328 AromaticContact CE1-CD2 3.19Å; H324-H328 PolarHBondContact CE1-CD2 3.36Å; H324-H328 AromaticContact CE1-NE2 3.2Å; H324-H328 PolarHBondContact CE1-NE2 3.27Å; H324-H328 AromaticContact ND1-CD2 3.68Å; H324-H328 AromaticContact NE2-CD2 3.63Å; H324-H328 AromaticContact NE2-NE2 3.77Å; H324-H328 PolarHBondContact O-N 2.57Å
325	V	90.8	Very high	87.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.8	-40.3	174	169.4	0	0	0	0	111.2	F321 M322 H327 H328 L329 Y447 M448	F321-V325 HydrophobicContact CD1-CG2 4.15Å; F321-V325 HydrophobicContact CD2-CG2 4.35Å; F321-V325 HydrophobicContact CE1-CG2 3.74Å; F321-V325 HydrophobicContact CE2-CG2 3.94Å; F321-V325 HydrophobicContact CG-CG2 4.45Å; F321-V325 HydrophobicContact CZ-CG2 3.61Å; F321-V325 WeakPolarHBondContact O-CG2 3.38Å; F321-V325 PolarHBondContact O-N 3.27Å; M322-V325 PolarHBondContact O-N 3.46Å; V325-H327 PolarHBondContact O-N 3.16Å; V325-H328 PolarHBondContact O-N 3.49Å; V325-L329 HydrophobicContact CG1-CD1 3.64Å; V325-L329 HydrophobicContact CG1-CG 4.24Å; V325-L329 WeakPolarHBondContact O-CG 3.5Å; V325-L329 PolarHBondContact O-N 2.85Å; V325-Y447 HydrophobicContact CB-CE1 4.04Å; V325-Y447 HydrophobicContact CG1-CD1 4.28Å; V325-Y447 HydrophobicContact CG1-CE1 3.82Å; V325-Y447 HydrophobicContact CG2-CE1 4.41Å; V325-M448 HydrophobicContact CG1-CG 3.97Å; V325-M448 HydrophobicContact CG2-CE 4.49Å; V325-M448 HydrophobicContact CG2-CG 3.91Å; V325-M448 HydrophobicContact CG2-SD 4.08Å
326	K	89	Confident	86.2	Confident	62 Å²	62	58.5 Å²	58.5	27%	0.27	27%	0.274	S	S	.	.	H	α-helix	trans	-51	-56.2	169.4	169.6	166.1	175.6	169.4	0	109.8	M322 H328 L329 E330 Q346 H349 Y451	M322-K326 PolarHBondContact O-N 3.29Å; K326-H328 VanDerWaalsContact C-N 3.33Å; K326-H328 PolarHBondContact O-N 2.97Å; K326-L329 PolarHBondContact O-N 3.48Å; K326-E330 WeakPolarHBondContact O-CB 3.44Å; K326-E330 PolarHBondContact O-N 3.34Å; K326-Q346 PolarHBondContact NZ-O 3.1Å; K326-Q346 VanDerWaalsContact NZ-O 3.07Å; K326-H349 VanDerWaalsContact CE-CE1 3.48Å; K326-H349 WeakPolarHBondContact CE-CE1 3.34Å; K326-H349 WeakPolarHBondContact CE-NE2 3.46Å; K326-H349 PolarHBondContact NZ-CE1 3.48Å; K326-H349 PolarHBondContact NZ-NE2 3.01Å; K326-Y451 HydrophobicContact CB-CE2 4.39Å; K326-Y451 WeakPolarHBondContact CB-OH 3.27Å; K326-Y451 WeakPolarHBondContact CG-OH 3.42Å
327	H	88.1	Confident	84.4	Confident	133 Å²	133	59.7 Å²	59.7	62%	0.616	28%	0.28	S	S	*	.	H	α-helix	trans	-60.4	-38	-179	-171.5	-47.3	0	0	0	113.1	N323 H324 V325 F331	N323-H327 PolarHBondContact O-N 2.97Å; N323-H327 VanDerWaalsContact O-N 3.1Å; H324-H327 PolarHBondContact O-N 3.39Å; V325-H327 PolarHBondContact O-N 3.16Å; H327-F331 WeakPolarHBondContact O-CB 3.29Å; H327-F331 PolarHBondContact O-N 2.91Å; H327-F331 VanDerWaalsContact O-N 3.1Å
328	H	87.5	Confident	82.6	Confident	45 Å²	45	59.9 Å²	59.9	21%	0.208	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-49.1	176.2	-98.6	-73.8	0	0	0	112.1	C312 H324 V325 K326 F331 E332	C312-H328 PolarHBondContact SG-NE2 3.35Å; H324-H328 AromaticContact CE1-CD2 3.19Å; H324-H328 PolarHBondContact CE1-CD2 3.36Å; H324-H328 AromaticContact CE1-NE2 3.2Å; H324-H328 PolarHBondContact CE1-NE2 3.27Å; H324-H328 AromaticContact ND1-CD2 3.68Å; H324-H328 AromaticContact NE2-CD2 3.63Å; H324-H328 AromaticContact NE2-NE2 3.77Å; H324-H328 PolarHBondContact O-N 2.57Å; V325-H328 PolarHBondContact O-N 3.49Å; K326-H328 VanDerWaalsContact C-N 3.33Å; K326-H328 PolarHBondContact O-N 2.97Å; H328-F331 PolarHBondContact O-N 3.26Å; H328-E332 WeakPolarHBondContact O-CB 3.48Å; H328-E332 VanDerWaalsContact O-CG 3.26Å; H328-E332 WeakPolarHBondContact O-CG 3.29Å; H328-E332 PolarHBondContact O-N 3.29Å
329	L	83.3	Confident	80.5	Confident	5 Å²	5	69.8 Å²	69.8	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-73.3	-31.5	-176	-63	175	0	0	0	112.1	V325 K326 E332 K333 Y451 R452	V325-L329 HydrophobicContact CG1-CD1 3.64Å; V325-L329 HydrophobicContact CG1-CG 4.24Å; V325-L329 WeakPolarHBondContact O-CG 3.5Å; V325-L329 PolarHBondContact O-N 2.85Å; K326-L329 PolarHBondContact O-N 3.48Å; L329-E332 PolarHBondContact O-N 3.05Å; L329-K333 PolarHBondContact O-N 3.49Å; L329-Y451 HydrophobicContact CB-CD1 4.25Å; L329-Y451 HydrophobicContact CB-CE1 4.27Å; L329-Y451 HydrophobicContact CD1-CD1 3.32Å; L329-Y451 HydrophobicContact CD1-CE1 4.08Å; L329-Y451 HydrophobicContact CD1-CG 3.71Å; L329-Y451 HydrophobicContact CG-CD1 4.4Å; L329-R452 HydrophobicContact CD2-CB 4.44Å; L329-R452 VanDerWaalsContact CD2-CZ 3.48Å
330	E	81.3	Confident	78.3	Confident	15 Å²	15	76.7 Å²	76.7	7%	0.07	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-48.2	170.5	-161.1	66.6	-115	0	0	111.7	K326 K333 Q334 Q346 W455	K326-E330 WeakPolarHBondContact O-CB 3.44Å; K326-E330 PolarHBondContact O-N 3.34Å; E330-K333 VanDerWaalsContact O-CB 3.26Å; E330-K333 WeakPolarHBondContact O-CB 3.24Å; E330-K333 PolarHBondContact O-N 2.97Å; E330-K333 VanDerWaalsContact O-N 3.12Å; E330-Q334 WeakPolarHBondContact O-CG 3.48Å; E330-Q334 PolarHBondContact O-N 3.33Å; E330-Q334 VanDerWaalsContact O-N 3.17Å; E330-Q346 PolarHBondContact OE1-NE2 2.82Å; E330-Q346 PolarHBondContact OE1-OE1 3.02Å; E330-Q346 PolarHBondContact OE2-OE1 3.36Å; E330-Q346 VanDerWaalsContact OE2-OE1 3.08Å; E330-W455 WeakPolarHBondContact OE1-CH2 3.42Å; E330-W455 WeakPolarHBondContact OE1-CZ2 3.35Å; E330-W455 WeakPolarHBondContact OE2-CH2 3.41Å
331	F	81.9	Confident	76.3	Confident	121 Å²	121	75.7 Å²	75.7	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-68.3	-35.9	177.3	-175.8	-98.5	0	0	0	112.2	H327 H328 K333 Q334 K335	H327-F331 WeakPolarHBondContact O-CB 3.29Å; H327-F331 PolarHBondContact O-N 2.91Å; H327-F331 VanDerWaalsContact O-N 3.1Å; H328-F331 PolarHBondContact O-N 3.26Å; F331-K333 PolarHBondContact O-N 3.41Å; F331-Q334 PolarHBondContact O-N 2.84Å; F331-K335 PolarHBondContact O-N 2.8Å
332	E	79.7	Confident	75	Confident	48 Å²	48	77 Å²	77	22%	0.224	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-25.2	171.5	-72.7	172.6	-147.2	0	0	112.2	S311 H328 L329 N336 R452	S311-E332 PolarHBondContact OG-OE1 2.79Å; H328-E332 WeakPolarHBondContact O-CB 3.48Å; H328-E332 VanDerWaalsContact O-CG 3.26Å; H328-E332 WeakPolarHBondContact O-CG 3.29Å; H328-E332 PolarHBondContact O-N 3.29Å; L329-E332 PolarHBondContact O-N 3.05Å; E332-N336 VanDerWaalsContact O-CG 3.23Å; E332-N336 PolarHBondContact O-ND2 2.68Å; E332-N336 VanDerWaalsContact O-ND2 3.12Å; E332-R452 IonicContact OE1-NH2 3.93Å; E332-R452 IonicContact OE2-CZ 3.18Å; E332-R452 IonicContact OE2-NH1 2.72Å; E332-R452 PolarHBondContact OE2-NH1 3.02Å; E332-R452 IonicContact OE2-NH2 2.71Å; E332-R452 PolarHBondContact OE2-NH2 3.33Å
333	K	73.7	Confident	74.2	Confident	21 Å²	21	77.8 Å²	77.8	9%	0.091	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-59.2	165.3	-166	-170.4	-123.5	139	0	111.5	L329 E330 F331 K335 N336 D337 T344 W455	L329-K333 PolarHBondContact O-N 3.49Å; E330-K333 VanDerWaalsContact O-CB 3.26Å; E330-K333 WeakPolarHBondContact O-CB 3.24Å; E330-K333 PolarHBondContact O-N 2.97Å; E330-K333 VanDerWaalsContact O-N 3.12Å; F331-K333 PolarHBondContact O-N 3.41Å; K333-K335 PolarHBondContact O-N 3.07Å; K333-N336 PolarHBondContact O-N 3.4Å; K333-D337 VanDerWaalsContact CD-OD2 3.3Å; K333-D337 WeakPolarHBondContact CD-OD2 3.25Å; K333-D337 WeakPolarHBondContact CE-OD2 3.13Å; K333-D337 HydrophobicContact CG-CB 4.15Å; K333-D337 WeakPolarHBondContact CG-OD2 3.44Å; K333-D337 PolarHBondContact O-N 3.05Å; K333-T344 PolarHBondContact NZ-OG1 2.68Å; K333-W455 HydrophobicContact CB-CZ2 3.61Å; K333-W455 HydrophobicContact CD-CZ2 3.52Å; K333-W455 HydrophobicContact CG-CZ2 3.94Å; K333-W455 VanDerWaalsContact NZ-CE2 3.34Å
334	Q	72.3	Confident	73.5	Confident	95 Å²	95	75 Å²	75	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-64	-17	-165	-67.2	169.8	5.4	0	0	112.6	E330 F331	E330-Q334 WeakPolarHBondContact O-CG 3.48Å; E330-Q334 PolarHBondContact O-N 3.33Å; E330-Q334 VanDerWaalsContact O-N 3.17Å; F331-Q334 PolarHBondContact O-N 2.84Å
335	K	71.6	Confident	72.8	Confident	168 Å²	168	73.5 Å²	73.5	73%	0.73	35%	0.35	S	S	*	.	H	α-helix	trans	-84.7	-27.8	171	-174.5	178.4	175.2	-172.3	0	114.4	F331 K333	F331-K335 PolarHBondContact O-N 2.8Å; K333-K335 PolarHBondContact O-N 3.07Å
336	N	63.5	Low	72.1	Confident	127 Å²	127	76.5 Å²	76.5	68%	0.679	36%	0.364	S	S	*	.	H	α-helix	trans	-101.5	-36.3	-172.5	-68.5	-9.9	0	0	0	113.2	E332 K333	E332-N336 VanDerWaalsContact O-CG 3.23Å; E332-N336 PolarHBondContact O-ND2 2.68Å; E332-N336 VanDerWaalsContact O-ND2 3.12Å; K333-N336 PolarHBondContact O-N 3.4Å
337	D	57.8	Low	71.4	Confident	69 Å²	69	79.2 Å²	79.2	37%	0.369	38%	0.378	S	S	.	.	S	Bend	trans	-88.3	134.3	174.9	-73.7	-26.4	0	0	0	110.2	K333	K333-D337 VanDerWaalsContact CD-OD2 3.3Å; K333-D337 WeakPolarHBondContact CD-OD2 3.25Å; K333-D337 WeakPolarHBondContact CE-OD2 3.13Å; K333-D337 HydrophobicContact CG-CB 4.15Å; K333-D337 WeakPolarHBondContact CG-OD2 3.44Å; K333-D337 PolarHBondContact O-N 3.05Å
338	S	55.3	Low	70.7	Confident	77 Å²	77	73 Å²	73	54%	0.538	35%	0.349	S	S	.	.			trans	-64.5	140.3	164.1	60.9	0	0	0	0	109.7	E340 N341	S338-E340 PolarHBondContact O-N 2.77Å; S338-N341 PolarHBondContact O-N 3.29Å
339	W	50.3	Low	70	Confident	208 Å²	208	71.2 Å²	71.2	79%	0.788	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-50.9	-31.6	-172.1	-177.6	-104.9	0	0	0	114	N341 H342	W339-N341 PolarHBondContact O-N 3.41Å; W339-H342 PolarHBondContact O-ND1 2.8Å
340	E	47.4	Very low	69.6	Low	164 Å²	164	72.6 Å²	72.6	77%	0.766	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.8	-13.6	-172	-156.7	157.8	-142.6	0	0	116.4	S338	S338-E340 PolarHBondContact O-N 2.77Å
341	N	53.7	Low	69.4	Low	117 Å²	117	75.5 Å²	75.5	63%	0.626	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-119.1	20.4	-174.4	-70.8	-83.4	0	0	0	115.3	S338 W339 T343	S338-N341 PolarHBondContact O-N 3.29Å; W339-N341 PolarHBondContact O-N 3.41Å; N341-T343 PolarHBondContact O-N 3.05Å; N341-T343 VanDerWaalsContact O-N 3.17Å
342	H	67.9	Low	69.1	Low	28 Å²	28	71.1 Å²	71.1	13%	0.13	34%	0.34	C	S	.	.			trans	-74.2	105.4	178.3	-73.4	77.6	0	0	0	112.2	W339 L358	W339-H342 PolarHBondContact O-ND1 2.8Å; H342-L358 WeakPolarHBondContact O-CD2 3.17Å
343	T	77.3	Confident	68.9	Low	23 Å²	23	74.2 Å²	74.2	14%	0.141	36%	0.364	C	S	.	.			trans	-116.3	13.1	174.4	77.1	0	0	0	0	114.7	N341 F352 P355	N341-T343 PolarHBondContact O-N 3.05Å; N341-T343 VanDerWaalsContact O-N 3.17Å; T343-F352 WeakPolarHBondContact CB-O 3.32Å; T343-F352 PolarHBondContact O-N 3.17Å; T343-F352 PolarHBondContact OG1-O 2.95Å; T343-P355 HydrophobicContact CG2-CG 4.1Å
344	T	76.8	Confident	69.2	Low	18 Å²	18	75.9 Å²	75.9	11%	0.11	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-101.4	130.9	175.6	-37.7	0	0	0	0	111.2	K333	K333-T344 PolarHBondContact NZ-OG1 2.68Å
345	C	79.3	Confident	69.6	Low	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.377	C	S	.	.			trans	-73.7	131	175.2	-179.3	0	0	0	0	112.2	H347 C348 H349 R350 F352 L358 H361 H366	C345-H347 VanDerWaalsContact C-N 3.34Å; C345-H347 PolarHBondContact O-N 3.28Å; C345-C348 VanDerWaalsContact CB-SG 3.57Å; C345-C348 VanDerWaalsContact SG-SG 3.61Å; C345-H349 WeakPolarHBondContact O-CA 3.44Å; C345-H349 PolarHBondContact O-N 3.06Å; C345-R350 PolarHBondContact N-O 3.47Å; C345-F352 HydrophobicContact CB-CE2 4.16Å; C345-L358 VanDerWaalsContact CA-CD1 3.42Å; C345-L358 HydrophobicContact CB-CD1 3.5Å; C345-L358 VanDerWaalsContact CB-CD1 3.5Å; C345-H361 PolarHBondContact SG-NE2 2.74Å; C345-H361 VanDerWaalsContact SG-NE2 3.41Å; C345-H366 VanDerWaalsContact SG-CD2 3.53Å; C345-H366 PolarHBondContact SG-NE2 2.91Å
346	Q	77	Confident	70.1	Confident	62 Å²	62	73.3 Å²	73.3	29%	0.29	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-21.2	-176	-69.1	-63.7	-14.6	0	0	114.4	K326 E330	K326-Q346 PolarHBondContact NZ-O 3.1Å; K326-Q346 VanDerWaalsContact NZ-O 3.07Å; E330-Q346 PolarHBondContact OE1-NE2 2.82Å; E330-Q346 PolarHBondContact OE1-OE1 3.02Å; E330-Q346 PolarHBondContact OE2-OE1 3.36Å; E330-Q346 VanDerWaalsContact OE2-OE1 3.08Å
347	H	74.2	Confident	71	Confident	119 Å²	119	69.8 Å²	69.8	55%	0.551	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-54.5	-178.2	-57	-95.5	0	0	0	111.5	C345 H366	C345-H347 VanDerWaalsContact C-N 3.34Å; C345-H347 PolarHBondContact O-N 3.28Å; H347-H366 VanDerWaalsContact CB-CD2 3.47Å; H347-H366 WeakPolarHBondContact CB-CD2 3.37Å; H347-H366 AromaticContact CD2-CD2 3.78Å; H347-H366 AromaticContact CG-CD2 3.75Å; H347-H366 AromaticContact CG-CG 3.94Å
348	C	73.7	Confident	72.3	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-8.5	-176.8	71.5	0	0	0	0	115.2	C345 R350 H361 E379 R466	C345-C348 VanDerWaalsContact CB-SG 3.57Å; C345-C348 VanDerWaalsContact SG-SG 3.61Å; C348-R350 PolarHBondContact O-N 3.26Å; C348-R350 WeakPolarHBondContact SG-CB 3.44Å; C348-R350 PolarHBondContact SG-N 3.33Å; C348-R350 VanDerWaalsContact SG-N 3.39Å; C348-H361 PolarHBondContact SG-NE2 3.41Å; C348-E379 WeakPolarHBondContact CB-OE2 3.24Å; C348-R466 PolarHBondContact O-NE 3.35Å; C348-R466 PolarHBondContact O-NH2 3.22Å
349	H	73.1	Confident	73.6	Confident	8 Å²	8	68 Å²	68	4%	0.037	33%	0.332	C	S	.	.			trans	64.9	9.2	-174	-68.2	-54.2	0	0	0	116.9	K326 C345 F436 Q468	K326-H349 VanDerWaalsContact CE-CE1 3.48Å; K326-H349 WeakPolarHBondContact CE-CE1 3.34Å; K326-H349 WeakPolarHBondContact CE-NE2 3.46Å; K326-H349 PolarHBondContact NZ-CE1 3.48Å; K326-H349 PolarHBondContact NZ-NE2 3.01Å; C345-H349 WeakPolarHBondContact O-CA 3.44Å; C345-H349 PolarHBondContact O-N 3.06Å; H349-F436 HydrophobicContact CB-CD1 4.12Å; H349-F436 HydrophobicContact CB-CE1 3.73Å; H349-F436 HydrophobicContact CB-CZ 4.25Å; H349-Q468 PolarHBondContact O-NE2 3.4Å
350	R	73.6	Confident	75.1	Confident	35 Å²	35	59.9 Å²	59.9	13%	0.132	31%	0.306	C	S	.	.			trans	-65.2	136.3	174	-173.8	168.8	179.2	125.6	10.3	112	C345 C348 F352 C378 L380	C345-R350 PolarHBondContact N-O 3.47Å; C348-R350 PolarHBondContact O-N 3.26Å; C348-R350 WeakPolarHBondContact SG-CB 3.44Å; C348-R350 PolarHBondContact SG-N 3.33Å; C348-R350 VanDerWaalsContact SG-N 3.39Å; R350-F352 HydrophobicContact CB-CE2 3.91Å; R350-F352 HydrophobicContact CB-CZ 4.2Å; R350-F352 HydrophobicContact CG-CE1 4.49Å; R350-F352 HydrophobicContact CG-CE2 3.79Å; R350-F352 HydrophobicContact CG-CZ 3.76Å; R350-C378 PolarHBondContact NH1-O 3.15Å; R350-L380 VanDerWaalsContact NH1-CD1 3.28Å
351	Q	76.8	Confident	76.8	Confident	76 Å²	76	52.6 Å²	52.6	36%	0.355	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-91.4	149.2	171.7	-167.1	173.2	25.1	0	0	111.2
352	F	76.9	Confident	78.2	Confident	28 Å²	28	48.7 Å²	48.7	12%	0.123	25%	0.251	C	S	.	.			trans	-126.7	151.6	178	-66	-89.9	0	0	0	111	T343 C345 R350 T354 Q357 L358 H361	T343-F352 WeakPolarHBondContact CB-O 3.32Å; T343-F352 PolarHBondContact O-N 3.17Å; T343-F352 PolarHBondContact OG1-O 2.95Å; C345-F352 HydrophobicContact CB-CE2 4.16Å; R350-F352 HydrophobicContact CB-CE2 3.91Å; R350-F352 HydrophobicContact CB-CZ 4.2Å; R350-F352 HydrophobicContact CG-CE1 4.49Å; R350-F352 HydrophobicContact CG-CE2 3.79Å; R350-F352 HydrophobicContact CG-CZ 3.76Å; F352-T354 VanDerWaalsContact C-N 3.29Å; F352-T354 PolarHBondContact O-N 2.97Å; F352-Q357 HydrophobicContact CB-CB 4.21Å; F352-Q357 HydrophobicContact CD1-CB 3.98Å; F352-Q357 HydrophobicContact CG-CB 4.42Å; F352-L358 HydrophobicContact CB-CB 4.24Å; F352-L358 HydrophobicContact CD2-CB 3.93Å; F352-L358 HydrophobicContact CD2-CD1 3.82Å; F352-L358 HydrophobicContact CD2-CG 4.5Å; F352-L358 HydrophobicContact CE2-CD1 3.98Å; F352-L358 HydrophobicContact CG-CB 4.18Å; F352-H361 HydrophobicContact CE1-CB 3.83Å; F352-H361 HydrophobicContact CE2-CB 4.17Å; F352-H361 AromaticContact CE2-CD2 3.47Å; F352-H361 VanDerWaalsContact CE2-CD2 3.47Å; F352-H361 WeakPolarHBondContact CE2-CD2 3.45Å; F352-H361 AromaticContact CE2-CG 3.84Å; F352-H361 HydrophobicContact CZ-CB 3.49Å; F352-H361 VanDerWaalsContact CZ-CB 3.49Å; F352-H361 AromaticContact CZ-CD2 3.37Å; F352-H361 WeakPolarHBondContact CZ-CD2 3.46Å; F352-H361 AromaticContact CZ-CG 3.25Å; F352-H361 AromaticContact CZ-ND1 3.8Å; F352-H361 AromaticContact CZ-NE2 3.96Å
353	P	75.9	Confident	78.9	Confident	113 Å²	113	51.4 Å²	51.4	73%	0.734	26%	0.264	S	S	*	.	S	Bend	trans	-61.5	-29.9	171	-26	33.1	0	0	0	114.8	Q357	P353-Q357 VanDerWaalsContact CD-OE1 3.25Å
354	T	79.6	Confident	78.9	Confident	56 Å²	56	53.7 Å²	53.7	34%	0.344	28%	0.275	S	S	.	.	S	Bend	trans	-138.2	154	-176.8	61.9	0	0	0	0	112.8	F352 F356 Q357 L358	F352-T354 VanDerWaalsContact C-N 3.29Å; F352-T354 PolarHBondContact O-N 2.97Å; T354-F356 PolarHBondContact O-N 3.02Å; T354-Q357 PolarHBondContact O-N 3.47Å; T354-Q357 WeakPolarHBondContact OG1-CB 3.48Å; T354-Q357 VanDerWaalsContact OG1-CG 3.31Å; T354-Q357 WeakPolarHBondContact OG1-CG 3.31Å; T354-Q357 PolarHBondContact OG1-N 2.92Å; T354-Q357 PolarHBondContact OG1-OE1 3.48Å; T354-L358 PolarHBondContact O-N 3.34Å
355	P	81.2	Confident	78.8	Confident	70 Å²	70	54.2 Å²	54.2	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-31.2	171.8	-23.9	34.4	0	0	0	113.5	T343 L358 Q359	T343-P355 HydrophobicContact CG2-CG 4.1Å; P355-L358 WeakPolarHBondContact O-CB 3.19Å; P355-L358 PolarHBondContact O-N 3.25Å; P355-Q359 PolarHBondContact O-N 3.39Å
356	F	81.4	Confident	78.8	Confident	139 Å²	139	57.2 Å²	57.2	61%	0.61	29%	0.292	S	S	*	.	H	α-helix	trans	-63.9	-48.3	176.2	177	-100.4	0	0	0	112.1	T354 L358 Q359 C360	T354-F356 PolarHBondContact O-N 3.02Å; F356-L358 VanDerWaalsContact C-N 3.26Å; F356-L358 PolarHBondContact O-N 2.93Å; F356-Q359 PolarHBondContact O-N 3.26Å; F356-Q359 VanDerWaalsContact O-N 3.11Å; F356-C360 PolarHBondContact O-N 3.46Å; F356-C360 PolarHBondContact O-SG 3.03Å; F356-C360 VanDerWaalsContact O-SG 3.41Å
357	Q	81.2	Confident	78.6	Confident	53 Å²	53	59 Å²	59	25%	0.248	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-32.9	176.1	-73.3	165.4	-24.3	0	0	112.4	N62 F352 P353 T354 H361	N62-Q357 PolarHBondContact OD1-NE2 3.26Å; F352-Q357 HydrophobicContact CB-CB 4.21Å; F352-Q357 HydrophobicContact CD1-CB 3.98Å; F352-Q357 HydrophobicContact CG-CB 4.42Å; P353-Q357 VanDerWaalsContact CD-OE1 3.25Å; T354-Q357 PolarHBondContact O-N 3.47Å; T354-Q357 WeakPolarHBondContact OG1-CB 3.48Å; T354-Q357 VanDerWaalsContact OG1-CG 3.31Å; T354-Q357 WeakPolarHBondContact OG1-CG 3.31Å; T354-Q357 PolarHBondContact OG1-N 2.92Å; T354-Q357 PolarHBondContact OG1-OE1 3.48Å; Q357-H361 WeakPolarHBondContact O-CB 3.3Å; Q357-H361 PolarHBondContact O-N 2.96Å
358	L	85.1	Confident	77.9	Confident	16 Å²	16	55.4 Å²	55.4	8%	0.084	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-48	170.4	168.5	61.8	0	0	0	111.5	H342 C345 F352 T354 P355 F356 H361 I362	H342-L358 WeakPolarHBondContact O-CD2 3.17Å; C345-L358 VanDerWaalsContact CA-CD1 3.42Å; C345-L358 HydrophobicContact CB-CD1 3.5Å; C345-L358 VanDerWaalsContact CB-CD1 3.5Å; F352-L358 HydrophobicContact CB-CB 4.24Å; F352-L358 HydrophobicContact CD2-CB 3.93Å; F352-L358 HydrophobicContact CD2-CD1 3.82Å; F352-L358 HydrophobicContact CD2-CG 4.5Å; F352-L358 HydrophobicContact CE2-CD1 3.98Å; F352-L358 HydrophobicContact CG-CB 4.18Å; T354-L358 PolarHBondContact O-N 3.34Å; P355-L358 WeakPolarHBondContact O-CB 3.19Å; P355-L358 PolarHBondContact O-N 3.25Å; F356-L358 VanDerWaalsContact C-N 3.26Å; F356-L358 PolarHBondContact O-N 2.93Å; L358-H361 WeakPolarHBondContact O-CB 3.35Å; L358-H361 PolarHBondContact O-N 2.81Å; L358-I362 HydrophobicContact CD1-CD1 3.81Å; L358-I362 HydrophobicContact CD1-CG1 4.02Å; L358-I362 HydrophobicContact CG-CD1 3.96Å; L358-I362 WeakPolarHBondContact O-CG1 3.44Å; L358-I362 PolarHBondContact O-N 3.43Å
359	Q	83.4	Confident	77	Confident	93 Å²	93	64.8 Å²	64.8	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-50	-178.6	-175.8	61.7	23.5	0	0	111.6	P355 F356 H361 I362 E363	P355-Q359 PolarHBondContact O-N 3.39Å; F356-Q359 PolarHBondContact O-N 3.26Å; F356-Q359 VanDerWaalsContact O-N 3.11Å; Q359-H361 PolarHBondContact O-N 3.08Å; Q359-I362 PolarHBondContact O-N 2.97Å; Q359-I362 VanDerWaalsContact O-N 3.08Å; Q359-E363 WeakPolarHBondContact CG-OE1 3.48Å; Q359-E363 PolarHBondContact NE2-OE1 3.45Å; Q359-E363 WeakPolarHBondContact O-CG 3.42Å; Q359-E363 PolarHBondContact O-N 3.35Å
360	C	81.9	Confident	76.1	Confident	37 Å²	37	73.2 Å²	73.2	25%	0.25	38%	0.381	C	S	.	.	H	α-helix	trans	-60	-33.2	176.9	-60.4	0	0	0	0	112.7	F356 N364	F356-C360 PolarHBondContact O-N 3.46Å; F356-C360 PolarHBondContact O-SG 3.03Å; F356-C360 VanDerWaalsContact O-SG 3.41Å; C360-N364 VanDerWaalsContact O-CB 3.27Å; C360-N364 WeakPolarHBondContact O-CB 3.4Å; C360-N364 PolarHBondContact O-N 3.32Å; C360-N364 PolarHBondContact O-ND2 2.91Å
361	H	83.3	Confident	75.1	Confident	11 Å²	11	74.2 Å²	74.2	5%	0.051	39%	0.392	C	S	.	.	H	α-helix	trans	-69.9	-41.9	173.7	161	75	0	0	0	112.7	C345 C348 F352 Q357 L358 Q359 E363 V365 H366	C345-H361 PolarHBondContact SG-NE2 2.74Å; C345-H361 VanDerWaalsContact SG-NE2 3.41Å; C348-H361 PolarHBondContact SG-NE2 3.41Å; F352-H361 HydrophobicContact CE1-CB 3.83Å; F352-H361 HydrophobicContact CE2-CB 4.17Å; F352-H361 AromaticContact CE2-CD2 3.47Å; F352-H361 VanDerWaalsContact CE2-CD2 3.47Å; F352-H361 WeakPolarHBondContact CE2-CD2 3.45Å; F352-H361 AromaticContact CE2-CG 3.84Å; F352-H361 HydrophobicContact CZ-CB 3.49Å; F352-H361 VanDerWaalsContact CZ-CB 3.49Å; F352-H361 AromaticContact CZ-CD2 3.37Å; F352-H361 WeakPolarHBondContact CZ-CD2 3.46Å; F352-H361 AromaticContact CZ-CG 3.25Å; F352-H361 AromaticContact CZ-ND1 3.8Å; F352-H361 AromaticContact CZ-NE2 3.96Å; Q357-H361 WeakPolarHBondContact O-CB 3.3Å; Q357-H361 PolarHBondContact O-N 2.96Å; L358-H361 WeakPolarHBondContact O-CB 3.35Å; L358-H361 PolarHBondContact O-N 2.81Å; Q359-H361 PolarHBondContact O-N 3.08Å; H361-E363 VanDerWaalsContact C-N 3.31Å; H361-E363 PolarHBondContact O-N 2.81Å; H361-V365 VanDerWaalsContact O-CB 3.24Å; H361-V365 WeakPolarHBondContact O-CB 3.33Å; H361-V365 WeakPolarHBondContact O-CG2 3.4Å; H361-V365 PolarHBondContact O-N 2.91Å; H361-H366 AromaticContact CE1-NE2 3.63Å; H361-H366 AromaticContact NE2-CD2 3.84Å; H361-H366 AromaticContact NE2-NE2 3.26Å; H361-H366 PolarHBondContact NE2-NE2 3.06Å
362	I	83.4	Confident	74.2	Confident	36 Å²	36	74.4 Å²	74.4	19%	0.185	40%	0.402	C	S	.	.	H	α-helix	trans	-61.3	-43.6	174.6	-66.9	167.5	0	0	0	110.2	L358 Q359 H366 T367	L358-I362 HydrophobicContact CD1-CD1 3.81Å; L358-I362 HydrophobicContact CD1-CG1 4.02Å; L358-I362 HydrophobicContact CG-CD1 3.96Å; L358-I362 WeakPolarHBondContact O-CG1 3.44Å; L358-I362 PolarHBondContact O-N 3.43Å; Q359-I362 PolarHBondContact O-N 2.97Å; Q359-I362 VanDerWaalsContact O-N 3.08Å; I362-H366 CarbonylContact O-C 3.6Å; I362-H366 WeakPolarHBondContact O-CA 3.41Å; I362-H366 WeakPolarHBondContact O-CB 3.38Å; I362-H366 PolarHBondContact O-N 3.27Å; I362-T367 PolarHBondContact O-N 2.53Å; I362-T367 PolarHBondContact O-OG1 2.79Å
363	E	81.3	Confident	74.4	Confident	84 Å²	84	73.4 Å²	73.4	39%	0.393	40%	0.399	S	S	.	.	I	π-helix	trans	-61.4	-56.7	177.3	-72.3	166	179.4	0	0	110.8	Q359 H361 V365 T367 A368	Q359-E363 WeakPolarHBondContact CG-OE1 3.48Å; Q359-E363 PolarHBondContact NE2-OE1 3.45Å; Q359-E363 WeakPolarHBondContact O-CG 3.42Å; Q359-E363 PolarHBondContact O-N 3.35Å; H361-E363 VanDerWaalsContact C-N 3.31Å; H361-E363 PolarHBondContact O-N 2.81Å; E363-V365 PolarHBondContact O-N 2.72Å; E363-T367 CarbonylContact O-C 3.58Å; E363-T367 WeakPolarHBondContact O-CB 3.4Å; E363-T367 PolarHBondContact O-N 3.1Å; E363-A368 WeakPolarHBondContact O-CB 3.43Å; E363-A368 PolarHBondContact O-N 3.46Å
364	N	77.4	Confident	74.9	Confident	72 Å²	72	69.1 Å²	69.1	39%	0.385	37%	0.37	S	S	.	.	I	π-helix	trans	-78.3	-19.9	-171.8	-62.6	-16.3	0	0	0	115.7	C360 P371 S381	C360-N364 VanDerWaalsContact O-CB 3.27Å; C360-N364 WeakPolarHBondContact O-CB 3.4Å; C360-N364 PolarHBondContact O-N 3.32Å; C360-N364 PolarHBondContact O-ND2 2.91Å; N364-P371 WeakPolarHBondContact O-CG 3.47Å; N364-S381 VanDerWaalsContact CB-CB 3.49Å; N364-S381 VanDerWaalsContact CB-OG 3.29Å; N364-S381 WeakPolarHBondContact CB-OG 3.44Å; N364-S381 PolarHBondContact ND2-OG 3.14Å
365	V	75.6	Confident	75.4	Confident	29 Å²	29	66.4 Å²	66.4	18%	0.176	35%	0.354	C	S	.	.	I	π-helix	trans	-117.5	-18.1	-173.6	-170.4	0	0	0	0	112.8	H361 E363 V374 E379	H361-V365 VanDerWaalsContact O-CB 3.24Å; H361-V365 WeakPolarHBondContact O-CB 3.33Å; H361-V365 WeakPolarHBondContact O-CG2 3.4Å; H361-V365 PolarHBondContact O-N 2.91Å; E363-V365 PolarHBondContact O-N 2.72Å; V365-V374 HydrophobicContact CG1-CG1 4.34Å; V365-E379 HydrophobicContact CG1-CB 4.3Å
366	H	78.6	Confident	75.9	Confident	63 Å²	63	68.6 Å²	68.6	29%	0.292	36%	0.356	S	S	.	.	I	π-helix	trans	-128.8	-13.6	-176.8	-56.2	-37.5	0	0	0	114.7	C345 H347 H361 I362	C345-H366 VanDerWaalsContact SG-CD2 3.53Å; C345-H366 PolarHBondContact SG-NE2 2.91Å; H347-H366 VanDerWaalsContact CB-CD2 3.47Å; H347-H366 WeakPolarHBondContact CB-CD2 3.37Å; H347-H366 AromaticContact CD2-CD2 3.78Å; H347-H366 AromaticContact CG-CD2 3.75Å; H347-H366 AromaticContact CG-CG 3.94Å; H361-H366 AromaticContact CE1-NE2 3.63Å; H361-H366 AromaticContact NE2-CD2 3.84Å; H361-H366 AromaticContact NE2-NE2 3.26Å; H361-H366 PolarHBondContact NE2-NE2 3.06Å; I362-H366 CarbonylContact O-C 3.6Å; I362-H366 WeakPolarHBondContact O-CA 3.41Å; I362-H366 WeakPolarHBondContact O-CB 3.38Å; I362-H366 PolarHBondContact O-N 3.27Å
367	T	72.2	Confident	76.4	Confident	99 Å²	99	62 Å²	62	61%	0.607	33%	0.327	S	S	*	.	I	π-helix	trans	-116.8	-32.2	-179.1	-44.2	0	0	0	0	113	I362 E363 Q369	I362-T367 PolarHBondContact O-N 2.53Å; I362-T367 PolarHBondContact O-OG1 2.79Å; E363-T367 CarbonylContact O-C 3.58Å; E363-T367 WeakPolarHBondContact O-CB 3.4Å; E363-T367 PolarHBondContact O-N 3.1Å; T367-Q369 PolarHBondContact O-N 3.19Å
368	A	60.6	Low	76.9	Confident	43 Å²	43	59.5 Å²	59.5	36%	0.355	32%	0.316	S	S	.	.			trans	-59.3	123.4	179.6	0	0	0	0	0	111.7	E363 P371	E363-A368 WeakPolarHBondContact O-CB 3.43Å; E363-A368 PolarHBondContact O-N 3.46Å; A368-P371 HydrophobicContact CB-CB 4.09Å; A368-P371 HydrophobicContact CB-CG 3.94Å
369	Q	54.1	Low	77	Confident	199 Å²	199	59.7 Å²	59.7	93%	0.93	32%	0.316	S	S	*	.	S	Bend	trans	-73	-29.3	-177.6	-168.2	169.7	-4.9	0	0	112.4	T367	T367-Q369 PolarHBondContact O-N 3.19Å
370	E	54.6	Low	77.1	Confident	185 Å²	185	58 Å²	58	86%	0.864	31%	0.31	S	S	*	.			trans	-139.7	118	160.6	-72.9	-161.3	126.3	0	0	110.8
371	P	53.1	Low	77.2	Confident	56 Å²	56	57.8 Å²	57.8	36%	0.364	31%	0.309	S	S	.	.			trans	-123.6	97.9	160.1	37.5	-26.1	0	0	0	109.9	N364 A368 A373 V374	N364-P371 WeakPolarHBondContact O-CG 3.47Å; A368-P371 HydrophobicContact CB-CB 4.09Å; A368-P371 HydrophobicContact CB-CG 3.94Å; P371-A373 VanDerWaalsContact C-N 3.26Å; P371-A373 PolarHBondContact O-N 3.1Å; P371-V374 HydrophobicContact CB-CG2 3.73Å; P371-V374 HydrophobicContact CG-CG2 3.73Å
372	S	57.3	Low	77.2	Confident	81 Å²	81	59.4 Å²	59.4	57%	0.566	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-41.1	178.1	61.8	0	0	0	0	112	V374 D385	S372-V374 VanDerWaalsContact C-N 3.29Å; S372-V374 PolarHBondContact O-N 3.41Å; S372-D385 PolarHBondContact OG-OD1 3.14Å
373	A	80.8	Confident	77	Confident	6 Å²	6	65.8 Å²	65.8	5%	0.05	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	46.3	-170.7	0	0	0	0	0	113.8	P371 F382 L388	P371-A373 VanDerWaalsContact C-N 3.26Å; P371-A373 PolarHBondContact O-N 3.1Å; A373-F382 HydrophobicContact CB-CB 4.22Å; A373-F382 WeakPolarHBondContact CB-O 3.39Å; A373-F382 WeakPolarHBondContact O-CD2 3.13Å; A373-F382 PolarHBondContact O-N 2.91Å; A373-L388 HydrophobicContact CB-CB 4.3Å
374	V	86.6	Confident	77.1	Confident	23 Å²	23	64.4 Å²	64.4	14%	0.139	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-108.5	128.7	175.1	179.2	0	0	0	0	111.8	V365 P371 S372 K376 L380	V365-V374 HydrophobicContact CG1-CG1 4.34Å; P371-V374 HydrophobicContact CB-CG2 3.73Å; P371-V374 HydrophobicContact CG-CG2 3.73Å; S372-V374 VanDerWaalsContact C-N 3.29Å; S372-V374 PolarHBondContact O-N 3.41Å; V374-K376 PolarHBondContact O-N 3.39Å; V374-L380 WeakPolarHBondContact CA-O 3.46Å
375	C	90.7	Very high	77.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.334	C	S	.	.			trans	-71.5	113.6	170.7	177.2	0	0	0	0	110.9	I377 C378 E379 L380 F382 L388 M392	C375-I377 PolarHBondContact O-N 2.85Å; C375-I377 PolarHBondContact SG-N 3.37Å; C375-I377 VanDerWaalsContact SG-N 3.36Å; C375-C378 WeakPolarHBondContact CB-SG 3.38Å; C375-C378 PolarHBondContact SG-N 3.4Å; C375-C378 PolarHBondContact SG-SG 3.27Å; C375-E379 VanDerWaalsContact O-CA 3.29Å; C375-E379 WeakPolarHBondContact O-CA 3.27Å; C375-E379 PolarHBondContact O-N 3.41Å; C375-L380 PolarHBondContact N-O 2.78Å; C375-F382 HydrophobicContact CB-CE2 4.11Å; C375-L388 HydrophobicContact CB-CD1 3.98Å; C375-M392 HydrophobicContact CB-CE 3.56Å; C375-M392 WeakPolarHBondContact SG-CE 3.29Å
376	K	90.4	Very high	77.9	Confident	115 Å²	115	65.3 Å²	65.3	50%	0.5	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-12.1	178.6	-54.7	-173.5	-178.2	177.8	0	113.9	Y290 V374 V414	Y290-K376 HydrophobicContact CD2-CB 4.18Å; Y290-K376 HydrophobicContact CD2-CD 3.97Å; Y290-K376 HydrophobicContact CD2-CG 4.32Å; Y290-K376 HydrophobicContact CE1-CB 4.3Å; Y290-K376 HydrophobicContact CE2-CB 3.75Å; Y290-K376 HydrophobicContact CE2-CD 3.74Å; Y290-K376 HydrophobicContact CE2-CG 3.71Å; Y290-K376 PolarHBondContact OH-N 3.39Å; V374-K376 PolarHBondContact O-N 3.39Å; K376-V414 HydrophobicContact CB-CG2 3.88Å
377	I	93.3	Very high	78.3	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-61.5	171.9	-59.3	160.3	0	0	0	110.5	Y290 C375 H396 E400 P402 Y403 S413	Y290-I377 HydrophobicContact CD1-CD1 3.94Å; Y290-I377 HydrophobicContact CD1-CG1 3.89Å; Y290-I377 HydrophobicContact CE1-CD1 3.73Å; Y290-I377 HydrophobicContact CE1-CG1 3.71Å; C375-I377 PolarHBondContact O-N 2.85Å; C375-I377 PolarHBondContact SG-N 3.37Å; C375-I377 VanDerWaalsContact SG-N 3.36Å; I377-H396 HydrophobicContact CD1-CB 4.14Å; I377-H396 WeakPolarHBondContact CD1-ND1 3.32Å; I377-H396 VanDerWaalsContact CG2-CE1 3.44Å; I377-H396 WeakPolarHBondContact CG2-CE1 3.48Å; I377-E400 HydrophobicContact CD1-CG 3.85Å; I377-P402 HydrophobicContact CG2-CG 3.74Å; I377-Y403 HydrophobicContact CG2-CE2 4.31Å; I377-Y403 WeakPolarHBondContact O-CE2 3.44Å; I377-Y403 PolarHBondContact O-OH 3.23Å; I377-S413 WeakPolarHBondContact CA-O 3.47Å; I377-S413 VanDerWaalsContact CG1-O 3.3Å; I377-S413 WeakPolarHBondContact CG1-O 3.44Å
378	C	91.1	Very high	79.1	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.007	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-7.1	-169.1	71.5	0	0	0	0	114.8	R350 C375 L380 H391	R350-C378 PolarHBondContact NH1-O 3.15Å; C375-C378 WeakPolarHBondContact CB-SG 3.38Å; C375-C378 PolarHBondContact SG-N 3.4Å; C375-C378 PolarHBondContact SG-SG 3.27Å; C378-L380 VanDerWaalsContact C-N 3.3Å; C378-L380 HydrophobicContact CB-CD1 4.09Å; C378-L380 PolarHBondContact O-N 2.73Å; C378-L380 WeakPolarHBondContact SG-CD1 3.34Å; C378-H391 PolarHBondContact SG-NE2 2.75Å
379	E	87.2	Confident	80.4	Confident	20 Å²	20	59.1 Å²	59.1	9%	0.093	31%	0.305	C	S	.	.			trans	59.6	35.8	179.6	-64.1	171.7	-156.6	0	0	113.5	C348 V365 C375 R466	C348-E379 WeakPolarHBondContact CB-OE2 3.24Å; V365-E379 HydrophobicContact CG1-CB 4.3Å; C375-E379 VanDerWaalsContact O-CA 3.29Å; C375-E379 WeakPolarHBondContact O-CA 3.27Å; C375-E379 PolarHBondContact O-N 3.41Å; E379-R466 VanDerWaalsContact CD-NH1 3.32Å; E379-R466 WeakPolarHBondContact OE1-CD 3.24Å; E379-R466 IonicContact OE1-CZ 3.68Å; E379-R466 IonicContact OE1-NE 2.72Å; E379-R466 IonicContact OE1-NH1 3.08Å; E379-R466 PolarHBondContact OE1-NH1 2.97Å; E379-R466 WeakPolarHBondContact OE2-CD 3.41Å; E379-R466 IonicContact OE2-CZ 2.81Å; E379-R466 IonicContact OE2-NE 3.61Å; E379-R466 IonicContact OE2-NH1 3.65Å; E379-R466 PolarHBondContact OE2-NH1 3.26Å; E379-R466 VanDerWaalsContact OE2-NH1 3.08Å
380	L	85.1	Confident	82.1	Confident	59 Å²	59	53.2 Å²	53.2	31%	0.309	28%	0.278	S	S	.	.			trans	-89	138.9	159.3	-81.5	90.9	0	0	0	110.7	R350 V374 C375 C378 F382	R350-L380 VanDerWaalsContact NH1-CD1 3.28Å; V374-L380 WeakPolarHBondContact CA-O 3.46Å; C375-L380 PolarHBondContact N-O 2.78Å; C378-L380 VanDerWaalsContact C-N 3.3Å; C378-L380 HydrophobicContact CB-CD1 4.09Å; C378-L380 PolarHBondContact O-N 2.73Å; C378-L380 WeakPolarHBondContact SG-CD1 3.34Å; L380-F382 HydrophobicContact CB-CE1 4.33Å; L380-F382 HydrophobicContact CB-CE2 3.69Å; L380-F382 HydrophobicContact CB-CZ 3.48Å; L380-F382 VanDerWaalsContact CB-CZ 3.48Å; L380-F382 HydrophobicContact CD2-CE1 4.29Å; L380-F382 HydrophobicContact CD2-CZ 4.02Å; L380-F382 HydrophobicContact CG-CZ 4.34Å; L380-F382 WeakPolarHBondContact O-CE2 3.16Å
381	S	84.9	Confident	83.8	Confident	32 Å²	32	45.4 Å²	45.4	22%	0.224	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-90.2	145.5	164.4	57.1	0	0	0	0	111.3	N364	N364-S381 VanDerWaalsContact CB-CB 3.49Å; N364-S381 VanDerWaalsContact CB-OG 3.29Å; N364-S381 WeakPolarHBondContact CB-OG 3.44Å; N364-S381 PolarHBondContact ND2-OG 3.14Å
382	F	83.5	Confident	85.6	Confident	45 Å²	45	42.7 Å²	42.7	20%	0.197	22%	0.224	C	C	.	.			trans	-123.9	160	174.9	-58.3	-80.4	0	0	0	111	A373 C375 L380 V387 L388 H391	A373-F382 HydrophobicContact CB-CB 4.22Å; A373-F382 WeakPolarHBondContact CB-O 3.39Å; A373-F382 WeakPolarHBondContact O-CD2 3.13Å; A373-F382 PolarHBondContact O-N 2.91Å; C375-F382 HydrophobicContact CB-CE2 4.11Å; L380-F382 HydrophobicContact CB-CE1 4.33Å; L380-F382 HydrophobicContact CB-CE2 3.69Å; L380-F382 HydrophobicContact CB-CZ 3.48Å; L380-F382 VanDerWaalsContact CB-CZ 3.48Å; L380-F382 HydrophobicContact CD2-CE1 4.29Å; L380-F382 HydrophobicContact CD2-CZ 4.02Å; L380-F382 HydrophobicContact CG-CZ 4.34Å; L380-F382 WeakPolarHBondContact O-CE2 3.16Å; F382-V387 HydrophobicContact CB-CB 4.22Å; F382-V387 HydrophobicContact CB-CG1 4.12Å; F382-V387 HydrophobicContact CD1-CG1 3.68Å; F382-V387 HydrophobicContact CG-CG1 4.21Å; F382-L388 HydrophobicContact CB-CB 4.37Å; F382-L388 HydrophobicContact CD2-CB 4.01Å; F382-L388 HydrophobicContact CD2-CD1 3.79Å; F382-L388 HydrophobicContact CE2-CD1 3.99Å; F382-L388 HydrophobicContact CG-CB 4.4Å; F382-H391 HydrophobicContact CE1-CB 3.96Å; F382-H391 AromaticContact CE1-CG 3.88Å; F382-H391 HydrophobicContact CE2-CB 4.27Å; F382-H391 AromaticContact CE2-CD2 3.29Å; F382-H391 WeakPolarHBondContact CE2-CD2 3.37Å; F382-H391 AromaticContact CE2-CG 3.85Å; F382-H391 AromaticContact CE2-NE2 3.95Å; F382-H391 HydrophobicContact CZ-CB 3.78Å; F382-H391 AromaticContact CZ-CD2 3.12Å; F382-H391 WeakPolarHBondContact CZ-CD2 3.12Å; F382-H391 AromaticContact CZ-CG 3.28Å; F382-H391 AromaticContact CZ-ND1 3.83Å; F382-H391 AromaticContact CZ-NE2 3.63Å
383	E	79.2	Confident	87.1	Confident	170 Å²	170	43.6 Å²	43.6	79%	0.794	22%	0.217	S	C	*	.	S	Bend	trans	-74.1	-30.2	-178.2	-172.7	174.5	-167.4	0	0	112.5
384	T	83.6	Confident	87.5	Confident	54 Å²	54	47.6 Å²	47.6	33%	0.331	24%	0.238	S	C	.	.	S	Bend	trans	-142.5	158	177.2	74.3	0	0	0	0	112.4	Q386 V387 L388	T384-Q386 PolarHBondContact O-N 3.49Å; T384-V387 PolarHBondContact O-N 3.34Å; T384-V387 VanDerWaalsContact O-N 3.09Å; T384-V387 PolarHBondContact OG1-N 2.72Å; T384-L388 PolarHBondContact O-N 2.84Å
385	D	84.8	Confident	87.6	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.214	25%	0.249	C	C	.	.	H	α-helix	trans	-57.1	-32.9	174	-80.1	11.8	0	0	0	112.7	S372 L388 L389 V505	S372-D385 PolarHBondContact OG-OD1 3.14Å; D385-L388 PolarHBondContact O-N 3.08Å; D385-L389 WeakPolarHBondContact O-CD1 3.46Å; D385-L389 PolarHBondContact O-N 3.41Å; D385-V505 HydrophobicContact CB-CB 4.25Å; D385-V505 HydrophobicContact CB-CG2 3.66Å; D385-V505 VanDerWaalsContact OD2-CB 3.25Å; D385-V505 WeakPolarHBondContact OD2-CB 3.26Å; D385-V505 WeakPolarHBondContact OD2-CG1 3.42Å
386	Q	84.3	Confident	87.7	Confident	81 Å²	81	50.5 Å²	50.5	38%	0.379	25%	0.25	S	C	.	.	H	α-helix	trans	-63.9	-43.9	173.3	-69.6	-172.1	24.5	0	0	112.5	T384 L389 Q390 E516 A518	T384-Q386 PolarHBondContact O-N 3.49Å; Q386-L389 PolarHBondContact O-N 3.11Å; Q386-Q390 PolarHBondContact O-N 3.33Å; Q386-E516 PolarHBondContact NE2-OE1 3.25Å; Q386-E516 PolarHBondContact NE2-OE2 3.38Å; Q386-A518 HydrophobicContact CG-CB 3.84Å
387	V	86.9	Confident	87.7	Confident	71 Å²	71	50.1 Å²	50.1	43%	0.43	25%	0.248	S	C	.	.	H	α-helix	trans	-69.1	-37.3	-179.9	-179.7	0	0	0	0	110.2	F382 T384 H391	F382-V387 HydrophobicContact CB-CB 4.22Å; F382-V387 HydrophobicContact CB-CG1 4.12Å; F382-V387 HydrophobicContact CD1-CG1 3.68Å; F382-V387 HydrophobicContact CG-CG1 4.21Å; T384-V387 PolarHBondContact O-N 3.34Å; T384-V387 VanDerWaalsContact O-N 3.09Å; T384-V387 PolarHBondContact OG1-N 2.72Å; V387-H391 VanDerWaalsContact O-CB 3.31Å; V387-H391 WeakPolarHBondContact O-CB 3.29Å; V387-H391 PolarHBondContact O-N 3.41Å
388	L	89.1	Confident	87.5	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-46.2	168.4	171.7	63.7	0	0	0	111.4	L285 A373 C375 F382 T384 D385 H391 M392 V505	L285-L388 HydrophobicContact CD1-CD2 4.11Å; L285-L388 HydrophobicContact CD1-CG 4.16Å; A373-L388 HydrophobicContact CB-CB 4.3Å; C375-L388 HydrophobicContact CB-CD1 3.98Å; F382-L388 HydrophobicContact CB-CB 4.37Å; F382-L388 HydrophobicContact CD2-CB 4.01Å; F382-L388 HydrophobicContact CD2-CD1 3.79Å; F382-L388 HydrophobicContact CE2-CD1 3.99Å; F382-L388 HydrophobicContact CG-CB 4.4Å; T384-L388 PolarHBondContact O-N 2.84Å; D385-L388 PolarHBondContact O-N 3.08Å; L388-H391 PolarHBondContact O-N 3.19Å; L388-M392 HydrophobicContact CD1-CE 3.72Å; L388-M392 HydrophobicContact CD1-CG 4.34Å; L388-M392 WeakPolarHBondContact O-CG 3.45Å; L388-M392 PolarHBondContact O-N 3.24Å; L388-V505 HydrophobicContact CD2-CG1 4.48Å
389	L	88.4	Confident	87.3	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-43.9	-179.1	-111.1	88	0	0	0	113.1	L285 D385 Q386 H391 M392 K393 I503 V505 A518 I520	L285-L389 HydrophobicContact CD1-CD1 3.47Å; L285-L389 VanDerWaalsContact CD1-CD1 3.47Å; L285-L389 HydrophobicContact CD1-CG 4.04Å; D385-L389 WeakPolarHBondContact O-CD1 3.46Å; D385-L389 PolarHBondContact O-N 3.41Å; Q386-L389 PolarHBondContact O-N 3.11Å; L389-H391 VanDerWaalsContact C-N 3.33Å; L389-M392 WeakPolarHBondContact O-CB 3.44Å; L389-M392 PolarHBondContact O-N 3.03Å; L389-K393 PolarHBondContact O-N 3.01Å; L389-I503 HydrophobicContact CD2-CB 3.98Å; L389-I503 HydrophobicContact CD2-CG2 4.04Å; L389-I503 HydrophobicContact CG-CG2 4.39Å; L389-V505 HydrophobicContact CD1-CG2 3.17Å; L389-A518 HydrophobicContact CD2-CB 3.9Å; L389-A518 WeakPolarHBondContact CD2-O 3.38Å; L389-I520 HydrophobicContact CB-CD1 3.74Å; L389-I520 HydrophobicContact CD2-CB 4.45Å; L389-I520 HydrophobicContact CD2-CD1 3.93Å; L389-I520 HydrophobicContact CD2-CG1 3.99Å; L389-I520 HydrophobicContact CG-CD1 4.24Å
390	Q	88.9	Confident	87.6	Confident	75 Å²	75	50.2 Å²	50.2	35%	0.35	25%	0.252	S	S	.	.	H	α-helix	trans	-66	-39.2	177	-175.5	54.7	31.3	0	0	110.6	Q386 M392 K393 D394	Q386-Q390 PolarHBondContact O-N 3.33Å; Q390-M392 PolarHBondContact O-N 3.19Å; Q390-K393 PolarHBondContact O-N 3.03Å; Q390-D394 PolarHBondContact NE2-OD1 3.11Å; Q390-D394 PolarHBondContact NE2-OD2 3.41Å; Q390-D394 VanDerWaalsContact O-CG 3.28Å; Q390-D394 PolarHBondContact O-N 2.92Å; Q390-D394 VanDerWaalsContact O-N 3.07Å
391	H	90.8	Very high	88	Confident	20 Å²	20	47.7 Å²	47.7	9%	0.093	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-40.1	170.7	169.3	64.8	0	0	0	112.9	C378 F382 V387 L388 L389 H395 H396	C378-H391 PolarHBondContact SG-NE2 2.75Å; F382-H391 HydrophobicContact CE1-CB 3.96Å; F382-H391 AromaticContact CE1-CG 3.88Å; F382-H391 HydrophobicContact CE2-CB 4.27Å; F382-H391 AromaticContact CE2-CD2 3.29Å; F382-H391 WeakPolarHBondContact CE2-CD2 3.37Å; F382-H391 AromaticContact CE2-CG 3.85Å; F382-H391 AromaticContact CE2-NE2 3.95Å; F382-H391 HydrophobicContact CZ-CB 3.78Å; F382-H391 AromaticContact CZ-CD2 3.12Å; F382-H391 WeakPolarHBondContact CZ-CD2 3.12Å; F382-H391 AromaticContact CZ-CG 3.28Å; F382-H391 AromaticContact CZ-ND1 3.83Å; F382-H391 AromaticContact CZ-NE2 3.63Å; V387-H391 VanDerWaalsContact O-CB 3.31Å; V387-H391 WeakPolarHBondContact O-CB 3.29Å; V387-H391 PolarHBondContact O-N 3.41Å; L388-H391 PolarHBondContact O-N 3.19Å; L389-H391 VanDerWaalsContact C-N 3.33Å; H391-H395 AromaticContact CE1-CD2 3.74Å; H391-H395 AromaticContact CE1-CG 3.75Å; H391-H395 AromaticContact ND1-CD2 3.1Å; H391-H395 PolarHBondContact ND1-CD2 3.08Å; H391-H395 AromaticContact ND1-CG 3.59Å; H391-H395 AromaticContact ND1-NE2 3.74Å; H391-H395 WeakPolarHBondContact O-CB 3.41Å; H391-H395 PolarHBondContact O-CD2 2.75Å; H391-H395 PolarHBondContact O-N 3.27Å; H391-H396 AromaticContact CE1-NE2 3.85Å; H391-H396 AromaticContact NE2-CD2 3.92Å; H391-H396 AromaticContact NE2-NE2 3.46Å; H391-H396 PolarHBondContact NE2-NE2 2.95Å
392	M	91.1	Very high	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-47.6	175	-74.5	-52.9	89.3	0	0	111.2	L285 Y289 Y290 C375 L388 L389 Q390 D394 H396	L285-M392 HydrophobicContact CD1-CG 3.77Å; L285-M392 HydrophobicContact CD2-CG 4.5Å; L285-M392 HydrophobicContact CG-CG 4.26Å; Y289-M392 HydrophobicContact CD1-CB 4.25Å; Y289-M392 HydrophobicContact CD1-SD 4.47Å; Y289-M392 HydrophobicContact CD2-CB 3.96Å; Y289-M392 HydrophobicContact CD2-CG 4.04Å; Y289-M392 HydrophobicContact CE1-CB 3.93Å; Y289-M392 WeakPolarHBondContact CE1-O 3.28Å; Y289-M392 HydrophobicContact CE2-CB 3.59Å; Y289-M392 HydrophobicContact CE2-CG 4.16Å; Y289-M392 HydrophobicContact CG-CB 4.27Å; Y289-M392 HydrophobicContact CG-CG 4.29Å; Y289-M392 HydrophobicContact CG-SD 4.24Å; Y290-M392 HydrophobicContact CE1-SD 4.1Å; C375-M392 HydrophobicContact CB-CE 3.56Å; C375-M392 WeakPolarHBondContact SG-CE 3.29Å; L388-M392 HydrophobicContact CD1-CE 3.72Å; L388-M392 HydrophobicContact CD1-CG 4.34Å; L388-M392 WeakPolarHBondContact O-CG 3.45Å; L388-M392 PolarHBondContact O-N 3.24Å; L389-M392 WeakPolarHBondContact O-CB 3.44Å; L389-M392 PolarHBondContact O-N 3.03Å; Q390-M392 PolarHBondContact O-N 3.19Å; M392-D394 PolarHBondContact O-N 3.21Å; M392-H396 WeakPolarHBondContact O-CA 3.42Å; M392-H396 WeakPolarHBondContact O-CB 3.29Å; M392-H396 PolarHBondContact O-N 3.48Å; M392-H396 VanDerWaalsContact O-O 3.11Å
393	K	88.9	Confident	89.2	Confident	99 Å²	99	44.1 Å²	44.1	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-44.8	-179.1	-179.5	-160.3	177.2	-168.5	0	112.7	Y289 L389 Q390 I520	Y289-K393 WeakPolarHBondContact OH-CA 3.33Å; Y289-K393 PolarHBondContact OH-N 3.25Å; L389-K393 PolarHBondContact O-N 3.01Å; Q390-K393 PolarHBondContact O-N 3.03Å; K393-I520 HydrophobicContact CB-CD1 4.3Å; K393-I520 HydrophobicContact CD-CD1 4.28Å; K393-I520 HydrophobicContact CD-CG2 4.05Å; K393-I520 HydrophobicContact CG-CG2 4.34Å
394	D	89.1	Confident	90	Very high	91 Å²	91	37 Å²	37	49%	0.487	19%	0.187	S	C	.	.	H	α-helix	trans	-83	-39	-171.4	-61.7	-13.9	0	0	0	112	Q390 M392	Q390-D394 PolarHBondContact NE2-OD1 3.11Å; Q390-D394 PolarHBondContact NE2-OD2 3.41Å; Q390-D394 VanDerWaalsContact O-CG 3.28Å; Q390-D394 PolarHBondContact O-N 2.92Å; Q390-D394 VanDerWaalsContact O-N 3.07Å; M392-D394 PolarHBondContact O-N 3.21Å
395	H	89.1	Confident	90.5	Very high	81 Å²	81	34.4 Å²	34.4	38%	0.375	17%	0.171	S	C	.	.	H	α-helix	trans	-97.2	-29.8	-172.8	-64.2	-93.1	0	0	0	114.1	H391 K464	H391-H395 AromaticContact CE1-CD2 3.74Å; H391-H395 AromaticContact CE1-CG 3.75Å; H391-H395 AromaticContact ND1-CD2 3.1Å; H391-H395 PolarHBondContact ND1-CD2 3.08Å; H391-H395 AromaticContact ND1-CG 3.59Å; H391-H395 AromaticContact ND1-NE2 3.74Å; H391-H395 WeakPolarHBondContact O-CB 3.41Å; H391-H395 PolarHBondContact O-CD2 2.75Å; H391-H395 PolarHBondContact O-N 3.27Å; H395-K464 VanDerWaalsContact O-CD 3.25Å; H395-K464 WeakPolarHBondContact O-CD 3.39Å; H395-K464 WeakPolarHBondContact O-CE 3.35Å; H395-K464 PolarHBondContact O-NZ 3.35Å
396	H	92.5	Very high	91	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.014	18%	0.184	C	C	.	.			trans	-116.1	153.4	-170.8	-61	-80.5	0	0	0	112.2	Y289 I377 H391 M392 E400 K464	Y289-H396 HydrophobicContact CD1-CB 4.14Å; Y289-H396 HydrophobicContact CE1-CB 4.29Å; I377-H396 HydrophobicContact CD1-CB 4.14Å; I377-H396 WeakPolarHBondContact CD1-ND1 3.32Å; I377-H396 VanDerWaalsContact CG2-CE1 3.44Å; I377-H396 WeakPolarHBondContact CG2-CE1 3.48Å; H391-H396 AromaticContact CE1-NE2 3.85Å; H391-H396 AromaticContact NE2-CD2 3.92Å; H391-H396 AromaticContact NE2-NE2 3.46Å; H391-H396 PolarHBondContact NE2-NE2 2.95Å; M392-H396 WeakPolarHBondContact O-CA 3.42Å; M392-H396 WeakPolarHBondContact O-CB 3.29Å; M392-H396 PolarHBondContact O-N 3.48Å; M392-H396 VanDerWaalsContact O-O 3.11Å; H396-E400 WeakPolarHBondContact CA-OE2 3.33Å; H396-E400 HydrophobicContact CB-CG 4.34Å; H396-E400 IonicContact CE1-OE1 3.75Å; H396-E400 IonicContact CG-OE1 3.71Å; H396-E400 IonicContact ND1-OE1 2.79Å; H396-E400 PolarHBondContact ND1-OE1 3.07Å; H396-K464 PolarHBondContact CE1-O 3.2Å
397	K	90.8	Very high	91.4	Very high	106 Å²	106	35.5 Å²	35.5	46%	0.461	18%	0.178	S	C	.	.			trans	-98.5	148.5	169.5	-60.1	-54.4	-174.2	-174.6	0	110.7	G399 E400	K397-G399 PolarHBondContact O-N 2.78Å; K397-E400 HydrophobicContact CB-CB 4.3Å; K397-E400 PolarHBondContact N-OE2 3.35Å; K397-E400 WeakPolarHBondContact O-CB 3.25Å; K397-E400 WeakPolarHBondContact O-CG 3.5Å; K397-E400 PolarHBondContact O-N 2.81Å; K397-E400 VanDerWaalsContact O-N 3.1Å
398	P	89.1	Confident	91.7	Very high	17 Å²	17	32.8 Å²	32.8	11%	0.11	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	136.4	176.8	-18.5	30.9	0	0	0	109.7	F288 E400 M485 P489	F288-P398 HydrophobicContact CD1-CB 3.9Å; F288-P398 HydrophobicContact CD1-CG 4.14Å; F288-P398 HydrophobicContact CE1-CB 3.7Å; F288-P398 HydrophobicContact CE1-CG 3.5Å; F288-P398 VanDerWaalsContact CE1-CG 3.5Å; F288-P398 HydrophobicContact CZ-CB 4.23Å; F288-P398 HydrophobicContact CZ-CG 4.05Å; F288-P398 CarbonylContact O-C 3.55Å; F288-P398 WeakPolarHBondContact O-CA 3.24Å; F288-P398 WeakPolarHBondContact O-CB 3.44Å; P398-E400 PolarHBondContact O-N 3.41Å; P398-M485 HydrophobicContact CB-CE 3.99Å; P398-M485 HydrophobicContact CG-CE 4.09Å; P398-M485 WeakPolarHBondContact O-CB 3.29Å; P398-M485 VanDerWaalsContact O-CG 3.27Å; P398-M485 WeakPolarHBondContact O-CG 3.48Å; P398-P489 HydrophobicContact CB-CG 3.87Å
399	G	85.6	Confident	91.9	Very high	7 Å²	7	37.5 Å²	37.5	7%	0.072	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	30	-174.6	0	0	0	0	0	115.2	F288 K397 F486	F288-G399 PolarHBondContact O-N 3.1Å; K397-G399 PolarHBondContact O-N 2.78Å; G399-F486 PolarHBondContact O-N 3.18Å
400	E	93.1	Very high	92.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-75.5	139.5	169.4	79.4	168	-137.7	0	0	111.5	I377 H396 K397 P398 S413 H483 Q484	I377-E400 HydrophobicContact CD1-CG 3.85Å; H396-E400 WeakPolarHBondContact CA-OE2 3.33Å; H396-E400 HydrophobicContact CB-CG 4.34Å; H396-E400 IonicContact CE1-OE1 3.75Å; H396-E400 IonicContact CG-OE1 3.71Å; H396-E400 IonicContact ND1-OE1 2.79Å; H396-E400 PolarHBondContact ND1-OE1 3.07Å; K397-E400 HydrophobicContact CB-CB 4.3Å; K397-E400 PolarHBondContact N-OE2 3.35Å; K397-E400 WeakPolarHBondContact O-CB 3.25Å; K397-E400 WeakPolarHBondContact O-CG 3.5Å; K397-E400 PolarHBondContact O-N 2.81Å; K397-E400 VanDerWaalsContact O-N 3.1Å; P398-E400 PolarHBondContact O-N 3.41Å; E400-S413 WeakPolarHBondContact O-CB 3.41Å; E400-S413 PolarHBondContact O-OG 2.95Å; E400-H483 IonicContact OE1-CE1 3.69Å; E400-H483 PolarHBondContact OE1-CE1 3.34Å; E400-H483 IonicContact OE1-CG 2.69Å; E400-H483 IonicContact OE1-ND1 3.15Å; E400-H483 PolarHBondContact OE1-ND1 2.71Å; E400-H483 IonicContact OE2-ND1 3.95Å; E400-Q484 WeakPolarHBondContact CA-O 3.09Å; E400-Q484 WeakPolarHBondContact CB-O 3.43Å
401	M	95.2	Very high	92.6	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.03	18%	0.18	C	C	.	.			trans	-139.2	70.4	-169.9	-61.2	173.8	63.3	0	0	109.5	Q292 H293 Y403 R411 S412 F486	Q292-M401 VanDerWaalsContact CA-CE 3.49Å; H293-M401 HydrophobicContact CB-CE 3.58Å; H293-M401 VanDerWaalsContact N-CE 3.31Å; M401-Y403 VanDerWaalsContact C-N 3.31Å; M401-Y403 PolarHBondContact O-N 3.3Å; M401-R411 HydrophobicContact CB-CB 4.15Å; M401-R411 HydrophobicContact CE-CB 3.84Å; M401-R411 WeakPolarHBondContact CE-O 3.47Å; M401-S412 CarbonylContact C-O 3.56Å; M401-F486 HydrophobicContact CB-CB 4.08Å; M401-F486 HydrophobicContact CB-CG 4.48Å; M401-F486 HydrophobicContact CE-CD1 4.35Å; M401-F486 HydrophobicContact CG-CB 4.24Å; M401-F486 HydrophobicContact SD-CB 4.14Å; M401-F486 HydrophobicContact SD-CD1 3.63Å; M401-F486 HydrophobicContact SD-CG 4.27Å
402	P	96.1	Very high	92.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.176	C	C	.	.			trans	-77.2	-15.9	-166.2	30.4	-36.1	0	0	0	113.9	I377 H478 C482	I377-P402 HydrophobicContact CG2-CG 3.74Å; P402-H478 PolarHBondContact O-CE1 3.02Å; P402-C482 WeakPolarHBondContact CA-O 3.29Å; P402-C482 HydrophobicContact CB-CB 4.05Å
403	Y	97.1	Very high	93	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.9	177.5	-54.8	-63.7	0	0	0	109.7	I377 M401 R411 S412 S413 V414 F415 L438 C465 R466 L467	I377-Y403 HydrophobicContact CG2-CE2 4.31Å; I377-Y403 WeakPolarHBondContact O-CE2 3.44Å; I377-Y403 PolarHBondContact O-OH 3.23Å; M401-Y403 VanDerWaalsContact C-N 3.31Å; M401-Y403 PolarHBondContact O-N 3.3Å; Y403-R411 VanDerWaalsContact O-CA 3.24Å; Y403-R411 WeakPolarHBondContact O-CA 3.3Å; Y403-S412 PolarHBondContact N-O 2.84Å; Y403-S412 PolarHBondContact O-N 3.33Å; Y403-S413 WeakPolarHBondContact CD2-O 3.15Å; Y403-S413 WeakPolarHBondContact CE2-O 3.38Å; Y403-V414 VanDerWaalsContact CD2-C 3.44Å; Y403-F415 HydrophobicContact CD1-CB 4.13Å; Y403-F415 AromaticContact CD1-CD2 3.69Å; Y403-F415 HydrophobicContact CD1-CD2 3.69Å; Y403-F415 HydrophobicContact CD1-CG 4.34Å; Y403-F415 HydrophobicContact CD2-CB 4.15Å; Y403-F415 VanDerWaalsContact CD2-N 3.33Å; Y403-F415 HydrophobicContact CE1-CB 4.01Å; Y403-F415 AromaticContact CE1-CD2 3.68Å; Y403-F415 HydrophobicContact CE1-CD2 3.68Å; Y403-F415 HydrophobicContact CE1-CG 4.34Å; Y403-F415 HydrophobicContact CE2-CB 4.02Å; Y403-F415 HydrophobicContact CG-CB 4.2Å; Y403-F415 HydrophobicContact CG-CD2 4.44Å; Y403-L438 HydrophobicContact CD1-CD1 3.92Å; Y403-L438 HydrophobicContact CG-CD1 4.43Å; Y403-C465 HydrophobicContact CE1-CB 4.18Å; Y403-C465 WeakPolarHBondContact OH-CB 3.31Å; Y403-R466 HydrophobicContact CE1-CG 4.16Å; Y403-R466 PolarHBondContact OH-N 3.1Å; Y403-R466 VanDerWaalsContact OH-N 3.1Å; Y403-L467 HydrophobicContact CD1-CD1 4.28Å; Y403-L467 HydrophobicContact CD1-CD2 3.98Å; Y403-L467 HydrophobicContact CD1-CG 4.13Å; Y403-L467 HydrophobicContact CE1-CD1 4.39Å; Y403-L467 HydrophobicContact CE1-CD2 3.79Å; Y403-L467 HydrophobicContact CE1-CG 3.8Å
404	V	95.6	Very high	93.3	Very high	21 Å²	21	33.2 Å²	33.2	13%	0.127	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.3	-171.7	-173.1	0	0	0	0	109.8	Q406 R411	V404-Q406 PolarHBondContact O-N 2.69Å; V404-R411 HydrophobicContact CB-CG 4.35Å; V404-R411 HydrophobicContact CG1-CG 4.09Å; V404-R411 HydrophobicContact CG2-CG 3.97Å
405	C	95.2	Very high	93.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.			trans	-78.4	112.7	168.1	-172.2	0	0	0	0	109.3	V407 H409 Y410 V418 H421	C405-V407 PolarHBondContact O-N 2.76Å; C405-V407 VanDerWaalsContact O-N 3.08Å; C405-H409 VanDerWaalsContact O-CA 3.3Å; C405-H409 WeakPolarHBondContact O-CA 3.46Å; C405-H409 PolarHBondContact O-N 3.3Å; C405-Y410 PolarHBondContact N-O 3.05Å; C405-V418 HydrophobicContact CB-CG1 4.14Å; C405-H421 PolarHBondContact SG-NE2 2.92Å; C405-H421 VanDerWaalsContact SG-NE2 3.36Å
406	Q	93.8	Very high	93.7	Very high	103 Å²	103	27.2 Å²	27.2	48%	0.481	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	2.8	-176.6	-52.7	178.3	-10.5	0	0	114	V404 I440	V404-Q406 PolarHBondContact O-N 2.69Å; Q406-I440 HydrophobicContact CB-CG1 3.81Å
407	V	93.1	Very high	93.8	Very high	41 Å²	41	29.1 Å²	29.1	25%	0.248	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-39.9	179.2	-168.2	0	0	0	0	112.5	E300 C405 F422 H426 N431 I440	E300-V407 WeakPolarHBondContact OE2-CG1 3.26Å; C405-V407 PolarHBondContact O-N 2.76Å; C405-V407 VanDerWaalsContact O-N 3.08Å; V407-F422 HydrophobicContact CG2-CE2 4Å; V407-H426 WeakPolarHBondContact CG1-CE1 3.44Å; V407-N431 WeakPolarHBondContact CG1-ND2 3.47Å; V407-N431 HydrophobicContact CG2-CB 4.31Å; V407-I440 HydrophobicContact CG2-CD1 3.73Å; V407-I440 HydrophobicContact CG2-CG1 3.76Å; V407-I440 HydrophobicContact CG2-CG2 4.17Å
408	C	93.4	Very high	94	Very high	13 Å²	13	24.1 Å²	24.1	9%	0.088	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.7	8.9	-175.5	64.6	0	0	0	0	113.6	G295 D296 Y410 H421 H426	G295-C408 CarbonylContact C-O 3.57Å; G295-C408 WeakPolarHBondContact CA-O 3.44Å; D296-C408 PolarHBondContact N-O 3.24Å; C408-Y410 PolarHBondContact O-N 3.18Å; C408-H421 PolarHBondContact SG-CE1 3.22Å; C408-H421 PolarHBondContact SG-NE2 3.07Å; C408-H426 PolarHBondContact SG-NE2 3.18Å; C408-H426 VanDerWaalsContact SG-NE2 3.39Å
409	H	93.8	Very high	94.3	Very high	102 Å²	102	25.5 Å²	25.5	47%	0.472	14%	0.135	S	C	.	.			trans	56.9	21.3	-178	-49.7	106.6	0	0	0	115.5	D296 C405 R411	D296-H409 IonicContact OD2-CE1 2.85Å; D296-H409 IonicContact OD2-CG 2.67Å; D296-H409 IonicContact OD2-ND1 3.89Å; D296-H409 PolarHBondContact OD2-ND1 3.39Å; C405-H409 VanDerWaalsContact O-CA 3.3Å; C405-H409 WeakPolarHBondContact O-CA 3.46Å; C405-H409 PolarHBondContact O-N 3.3Å; H409-R411 PolarHBondContact O-N 3.3Å
410	Y	95	Very high	94.7	Very high	24 Å²	24	29.2 Å²	29.2	9%	0.094	16%	0.156	C	C	.	.			trans	-56.6	136.1	163.3	175.6	-95.8	0	0	0	109.5	Q292 H293 C405 C408 D417 V418 H421	Q292-Y410 PolarHBondContact OE1-OH 3.39Å; H293-Y410 WeakPolarHBondContact O-CA 3.48Å; H293-Y410 WeakPolarHBondContact O-CD2 3.37Å; C405-Y410 PolarHBondContact N-O 3.05Å; C408-Y410 PolarHBondContact O-N 3.18Å; Y410-D417 HydrophobicContact CE1-CB 4.4Å; Y410-V418 HydrophobicContact CD1-CG2 4.03Å; Y410-V418 HydrophobicContact CE1-CG2 3.88Å; Y410-H421 HydrophobicContact CD1-CB 3.94Å; Y410-H421 AromaticContact CD1-CD2 3.51Å; Y410-H421 AromaticContact CD1-CG 3.58Å; Y410-H421 HydrophobicContact CE1-CB 3.89Å; Y410-H421 AromaticContact CG-CD2 3.8Å; Y410-H421 AromaticContact CG-CG 3.81Å; Y410-H421 AromaticContact CG-ND1 3.98Å; Y410-H421 AromaticContact CG-NE2 3.98Å
411	R	95.6	Very high	94.8	Very high	51 Å²	51	30.3 Å²	30.3	19%	0.192	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.5	177.7	-58.4	-168.4	178.3	-140.9	4.9	112	Q292 H293 M401 Y403 V404 H409	Q292-R411 CarbonylContact C-O 3.51Å; Q292-R411 WeakPolarHBondContact CA-O 3.25Å; H293-R411 HydrophobicContact CB-CB 4.25Å; H293-R411 PolarHBondContact N-O 3.12Å; H293-R411 PolarHBondContact O-N 3.01Å; M401-R411 HydrophobicContact CB-CB 4.15Å; M401-R411 HydrophobicContact CE-CB 3.84Å; M401-R411 WeakPolarHBondContact CE-O 3.47Å; Y403-R411 VanDerWaalsContact O-CA 3.24Å; Y403-R411 WeakPolarHBondContact O-CA 3.3Å; V404-R411 HydrophobicContact CB-CG 4.35Å; V404-R411 HydrophobicContact CG1-CG 4.09Å; V404-R411 HydrophobicContact CG2-CG 3.97Å; H409-R411 PolarHBondContact O-N 3.3Å
412	S	96.2	Very high	94.8	Very high	1 Å²	1	30 Å²	30	1%	0.007	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.6	165.3	-175.1	0	0	0	0	111.6	G291 M401 Y403 V414 D417	G291-S412 WeakPolarHBondContact O-CA 3.47Å; G291-S412 PolarHBondContact O-OG 3.33Å; M401-S412 CarbonylContact C-O 3.56Å; Y403-S412 PolarHBondContact N-O 2.84Å; Y403-S412 PolarHBondContact O-N 3.33Å; S412-V414 WeakPolarHBondContact CB-O 3.39Å; S412-V414 PolarHBondContact OG-N 3.33Å; S412-V414 PolarHBondContact OG-O 3.13Å; S412-D417 WeakPolarHBondContact CB-OD2 3.36Å; S412-D417 PolarHBondContact OG-OD2 3.13Å
413	S	95.4	Very high	94.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-70.7	-18.6	162.2	-51.7	0	0	0	0	112.7	Y290 G291 I377 E400 Y403	Y290-S413 WeakPolarHBondContact CA-OG 3.43Å; G291-S413 PolarHBondContact N-OG 3.13Å; G291-S413 PolarHBondContact O-N 3.35Å; G291-S413 PolarHBondContact O-OG 2.77Å; I377-S413 WeakPolarHBondContact CA-O 3.47Å; I377-S413 VanDerWaalsContact CG1-O 3.3Å; I377-S413 WeakPolarHBondContact CG1-O 3.44Å; E400-S413 WeakPolarHBondContact O-CB 3.41Å; E400-S413 PolarHBondContact O-OG 2.95Å; Y403-S413 WeakPolarHBondContact CD2-O 3.15Å; Y403-S413 WeakPolarHBondContact CE2-O 3.38Å
414	V	94.1	Very high	94.5	Very high	29 Å²	29	37.8 Å²	37.8	18%	0.176	20%	0.199	C	C	.	.	S	Bend	trans	-112	133.4	-177.4	-167.5	0	0	0	0	110.8	K376 Y403 S412 A416	K376-V414 HydrophobicContact CB-CG2 3.88Å; Y403-V414 VanDerWaalsContact CD2-C 3.44Å; S412-V414 WeakPolarHBondContact CB-O 3.39Å; S412-V414 PolarHBondContact OG-N 3.33Å; S412-V414 PolarHBondContact OG-O 3.13Å; V414-A416 HydrophobicContact CG1-CB 4.36Å
415	F	94.4	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-43.4	-177.9	-178.1	-75.5	0	0	0	112.3	Y403 D417 V418 E419 P435 L438 R466 L467	Y403-F415 HydrophobicContact CD1-CB 4.13Å; Y403-F415 AromaticContact CD1-CD2 3.69Å; Y403-F415 HydrophobicContact CD1-CD2 3.69Å; Y403-F415 HydrophobicContact CD1-CG 4.34Å; Y403-F415 HydrophobicContact CD2-CB 4.15Å; Y403-F415 VanDerWaalsContact CD2-N 3.33Å; Y403-F415 HydrophobicContact CE1-CB 4.01Å; Y403-F415 AromaticContact CE1-CD2 3.68Å; Y403-F415 HydrophobicContact CE1-CD2 3.68Å; Y403-F415 HydrophobicContact CE1-CG 4.34Å; Y403-F415 HydrophobicContact CE2-CB 4.02Å; Y403-F415 HydrophobicContact CG-CB 4.2Å; Y403-F415 HydrophobicContact CG-CD2 4.44Å; F415-D417 PolarHBondContact O-N 2.72Å; F415-D417 VanDerWaalsContact O-N 3.16Å; F415-V418 PolarHBondContact O-N 3.17Å; F415-E419 HydrophobicContact CD1-CB 4.22Å; F415-E419 HydrophobicContact CE1-CB 3.82Å; F415-E419 WeakPolarHBondContact CE1-OE2 3.17Å; F415-E419 PolarHBondContact O-N 3.46Å; F415-P435 WeakPolarHBondContact CE2-O 3.15Å; F415-P435 WeakPolarHBondContact CZ-O 3.49Å; F415-L438 HydrophobicContact CD2-CD2 4.43Å; F415-L438 HydrophobicContact CE2-CD1 4.39Å; F415-L438 HydrophobicContact CE2-CD2 3.65Å; F415-L438 HydrophobicContact CE2-CG 4.02Å; F415-L438 HydrophobicContact CZ-CD2 3.78Å; F415-R466 HydrophobicContact CB-CG 4.32Å; F415-R466 VanDerWaalsContact CD1-NH2 3.28Å; F415-R466 HydrophobicContact CD2-CG 3.92Å; F415-R466 HydrophobicContact CG-CG 4.3Å; F415-R466 VanDerWaalsContact CG-CZ 3.46Å; F415-L467 HydrophobicContact CD2-CD2 3.84Å; F415-L467 HydrophobicContact CE2-CD2 3.63Å
416	A	92.5	Very high	94.2	Very high	46 Å²	46	40.3 Å²	40.3	38%	0.38	22%	0.216	S	C	.	.	H	α-helix	trans	-56.6	-32.8	-175.8	0	0	0	0	0	112.7	V414 T420	V414-A416 HydrophobicContact CG1-CB 4.36Å; A416-T420 VanDerWaalsContact O-CB 3.24Å; A416-T420 WeakPolarHBondContact O-CB 3.4Å; A416-T420 PolarHBondContact O-N 3.44Å; A416-T420 PolarHBondContact O-OG1 2.85Å
417	D	95.1	Very high	94.1	Very high	44 Å²	44	38.5 Å²	38.5	24%	0.235	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-47.1	174.3	-63.1	-12.7	0	0	0	111.6	Q292 Y410 S412 F415 T420 H421	Q292-D417 PolarHBondContact NE2-OD2 3.07Å; Y410-D417 HydrophobicContact CE1-CB 4.4Å; S412-D417 WeakPolarHBondContact CB-OD2 3.36Å; S412-D417 PolarHBondContact OG-OD2 3.13Å; F415-D417 PolarHBondContact O-N 2.72Å; F415-D417 VanDerWaalsContact O-N 3.16Å; D417-T420 PolarHBondContact O-N 3.3Å; D417-H421 WeakPolarHBondContact O-CB 3.38Å; D417-H421 PolarHBondContact O-N 3.3Å
418	V	95.4	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-71.1	-37.3	-177.5	-178.3	0	0	0	0	111.2	C405 Y410 F415 F422 L438	C405-V418 HydrophobicContact CB-CG1 4.14Å; Y410-V418 HydrophobicContact CD1-CG2 4.03Å; Y410-V418 HydrophobicContact CE1-CG2 3.88Å; F415-V418 PolarHBondContact O-N 3.17Å; V418-F422 WeakPolarHBondContact O-CB 3.32Å; V418-F422 PolarHBondContact O-N 2.78Å; V418-L438 HydrophobicContact CG1-CD1 4.14Å; V418-L438 HydrophobicContact CG1-CD2 4.31Å
419	E	94.4	Very high	93.9	Very high	47 Å²	47	36.5 Å²	36.5	22%	0.22	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-45.7	171.8	179.8	170.1	-168.6	0	0	111.6	F415 F422 R423	F415-E419 HydrophobicContact CD1-CB 4.22Å; F415-E419 HydrophobicContact CE1-CB 3.82Å; F415-E419 WeakPolarHBondContact CE1-OE2 3.17Å; F415-E419 PolarHBondContact O-N 3.46Å; E419-F422 PolarHBondContact O-N 2.78Å; E419-R423 HydrophobicContact CG-CG 4.41Å; E419-R423 WeakPolarHBondContact O-CB 3.41Å; E419-R423 VanDerWaalsContact O-CG 3.24Å; E419-R423 WeakPolarHBondContact O-CG 3.33Å; E419-R423 PolarHBondContact O-N 3.36Å; E419-R423 IonicContact OE1-CZ 3.37Å; E419-R423 IonicContact OE1-NE 3.63Å; E419-R423 PolarHBondContact OE1-NE 2.75Å; E419-R423 IonicContact OE1-NH2 3.77Å; E419-R423 PolarHBondContact OE1-NH2 3.36Å
420	T	94.8	Very high	93.9	Very high	84 Å²	84	35.9 Å²	35.9	52%	0.515	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-43.9	179	-58.1	0	0	0	0	111.5	A416 D417 F422 R423 T424	A416-T420 VanDerWaalsContact O-CB 3.24Å; A416-T420 WeakPolarHBondContact O-CB 3.4Å; A416-T420 PolarHBondContact O-N 3.44Å; A416-T420 PolarHBondContact O-OG1 2.85Å; D417-T420 PolarHBondContact O-N 3.3Å; T420-F422 PolarHBondContact O-N 3.39Å; T420-R423 PolarHBondContact O-N 2.76Å; T420-T424 WeakPolarHBondContact O-CG2 3.38Å; T420-T424 PolarHBondContact O-N 3.36Å; T420-T424 PolarHBondContact O-OG1 3.04Å
421	H	94.9	Very high	93.9	Very high	24 Å²	24	34.9 Å²	34.9	11%	0.111	19%	0.187	C	C	.	.	H	α-helix	trans	-56.9	-46.5	171.6	156.5	71.3	0	0	0	111.3	C405 C408 Y410 D417 R423 T424 C425 H426	C405-H421 PolarHBondContact SG-NE2 2.92Å; C405-H421 VanDerWaalsContact SG-NE2 3.36Å; C408-H421 PolarHBondContact SG-CE1 3.22Å; C408-H421 PolarHBondContact SG-NE2 3.07Å; Y410-H421 HydrophobicContact CD1-CB 3.94Å; Y410-H421 AromaticContact CD1-CD2 3.51Å; Y410-H421 AromaticContact CD1-CG 3.58Å; Y410-H421 HydrophobicContact CE1-CB 3.89Å; Y410-H421 AromaticContact CG-CD2 3.8Å; Y410-H421 AromaticContact CG-CG 3.81Å; Y410-H421 AromaticContact CG-ND1 3.98Å; Y410-H421 AromaticContact CG-NE2 3.98Å; D417-H421 WeakPolarHBondContact O-CB 3.38Å; D417-H421 PolarHBondContact O-N 3.3Å; H421-R423 PolarHBondContact O-N 3.36Å; H421-T424 PolarHBondContact O-N 2.94Å; H421-T424 PolarHBondContact O-OG1 3.24Å; H421-C425 PolarHBondContact ND1-SG 3.1Å; H421-C425 VanDerWaalsContact O-CB 3.25Å; H421-C425 WeakPolarHBondContact O-CB 3.24Å; H421-C425 PolarHBondContact O-N 3.37Å; H421-H426 AromaticContact CE1-NE2 3.79Å; H421-H426 AromaticContact NE2-CD2 3.72Å; H421-H426 AromaticContact NE2-NE2 3.6Å
422	F	95.1	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-42.6	178	-172.4	-89.7	0	0	0	111.9	M322 V407 V418 E419 T420 T424 H426 N431 L433 I440	M322-F422 HydrophobicContact CE-CD1 3.94Å; M322-F422 HydrophobicContact CE-CE1 3.61Å; M322-F422 HydrophobicContact SD-CE1 4Å; V407-F422 HydrophobicContact CG2-CE2 4Å; V418-F422 WeakPolarHBondContact O-CB 3.32Å; V418-F422 PolarHBondContact O-N 2.78Å; E419-F422 PolarHBondContact O-N 2.78Å; T420-F422 PolarHBondContact O-N 3.39Å; F422-T424 VanDerWaalsContact C-N 3.25Å; F422-T424 PolarHBondContact O-N 3.35Å; F422-H426 HydrophobicContact CD2-CB 3.88Å; F422-H426 AromaticContact CD2-CD2 3.96Å; F422-H426 HydrophobicContact CE2-CB 3.74Å; F422-H426 HydrophobicContact CG-CB 4.35Å; F422-H426 HydrophobicContact CZ-CB 4.09Å; F422-H426 CarbonylContact O-C 3.56Å; F422-H426 WeakPolarHBondContact O-CA 3.49Å; F422-H426 WeakPolarHBondContact O-CB 3.4Å; F422-H426 PolarHBondContact O-N 2.95Å; F422-H426 VanDerWaalsContact O-N 3.14Å; F422-N431 HydrophobicContact CE2-CB 4.12Å; F422-N431 HydrophobicContact CZ-CB 3.87Å; F422-L433 HydrophobicContact CB-CD2 3.83Å; F422-L433 HydrophobicContact CD1-CB 3.63Å; F422-L433 HydrophobicContact CD1-CD2 4.01Å; F422-L433 HydrophobicContact CD1-CG 4.41Å; F422-L433 HydrophobicContact CD2-CB 4.2Å; F422-L433 HydrophobicContact CD2-CD1 4.44Å; F422-L433 HydrophobicContact CD2-CD2 4.44Å; F422-L433 HydrophobicContact CE1-CB 3.6Å; F422-L433 HydrophobicContact CE2-CB 4.17Å; F422-L433 HydrophobicContact CG-CB 3.94Å; F422-L433 HydrophobicContact CG-CD2 3.81Å; F422-L433 HydrophobicContact CG-CG 4.34Å; F422-L433 HydrophobicContact CZ-CB 3.88Å; F422-I440 HydrophobicContact CD2-CD1 4.07Å; F422-I440 HydrophobicContact CE2-CD1 3.44Å; F422-I440 VanDerWaalsContact CE2-CD1 3.44Å; F422-I440 HydrophobicContact CZ-CD1 4.05Å
423	R	93.9	Very high	94	Very high	74 Å²	74	32.8 Å²	32.8	28%	0.279	18%	0.179	S	C	.	.	H	α-helix	trans	-67	-21.9	179.7	-71.8	173.9	179.5	-73.5	2.6	113.8	V319 N323 E419 T420 H421 E427	V319-R423 HydrophobicContact CG1-CG 4.31Å; N323-R423 PolarHBondContact OD1-NH1 3.35Å; N323-R423 PolarHBondContact OD1-NH2 3.22Å; N323-R423 VanDerWaalsContact OD1-NH2 3.1Å; E419-R423 HydrophobicContact CG-CG 4.41Å; E419-R423 WeakPolarHBondContact O-CB 3.41Å; E419-R423 VanDerWaalsContact O-CG 3.24Å; E419-R423 WeakPolarHBondContact O-CG 3.33Å; E419-R423 PolarHBondContact O-N 3.36Å; E419-R423 IonicContact OE1-CZ 3.37Å; E419-R423 IonicContact OE1-NE 3.63Å; E419-R423 PolarHBondContact OE1-NE 2.75Å; E419-R423 IonicContact OE1-NH2 3.77Å; E419-R423 PolarHBondContact OE1-NH2 3.36Å; T420-R423 PolarHBondContact O-N 2.76Å; H421-R423 PolarHBondContact O-N 3.36Å; R423-E427 WeakPolarHBondContact O-CB 3.48Å
424	T	93.1	Very high	94	Very high	89 Å²	89	32.8 Å²	32.8	55%	0.546	18%	0.179	S	C	.	.	H	α-helix	trans	-104.2	-54.7	179.6	53.4	0	0	0	0	112.7	T420 H421 F422	T420-T424 WeakPolarHBondContact O-CG2 3.38Å; T420-T424 PolarHBondContact O-N 3.36Å; T420-T424 PolarHBondContact O-OG1 3.04Å; H421-T424 PolarHBondContact O-N 2.94Å; H421-T424 PolarHBondContact O-OG1 3.24Å; F422-T424 VanDerWaalsContact C-N 3.25Å; F422-T424 PolarHBondContact O-N 3.35Å
425	C	91.9	Very high	93.8	Very high	69 Å²	69	32.3 Å²	32.3	47%	0.466	18%	0.177	S	C	.	.	H	α-helix	trans	-73	-31.1	-177.2	-59.3	0	0	0	0	113.4	H421	H421-C425 PolarHBondContact ND1-SG 3.1Å; H421-C425 VanDerWaalsContact O-CB 3.25Å; H421-C425 WeakPolarHBondContact O-CB 3.24Å; H421-C425 PolarHBondContact O-N 3.37Å
426	H	92	Very high	93.7	Very high	5 Å²	5	32.5 Å²	32.5	2%	0.023	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	20.1	-180	-61.5	-77	0	0	0	113	E300 N318 V407 C408 H421 F422 T429	E300-H426 IonicContact OE2-CE1 2.74Å; E300-H426 IonicContact OE2-CG 3.8Å; E300-H426 IonicContact OE2-ND1 3.75Å; E300-H426 PolarHBondContact OE2-ND1 2.86Å; N318-H426 PolarHBondContact ND2-O 3.45Å; V407-H426 WeakPolarHBondContact CG1-CE1 3.44Å; C408-H426 PolarHBondContact SG-NE2 3.18Å; C408-H426 VanDerWaalsContact SG-NE2 3.39Å; H421-H426 AromaticContact CE1-NE2 3.79Å; H421-H426 AromaticContact NE2-CD2 3.72Å; H421-H426 AromaticContact NE2-NE2 3.6Å; F422-H426 HydrophobicContact CD2-CB 3.88Å; F422-H426 AromaticContact CD2-CD2 3.96Å; F422-H426 HydrophobicContact CE2-CB 3.74Å; F422-H426 HydrophobicContact CG-CB 4.35Å; F422-H426 HydrophobicContact CZ-CB 4.09Å; F422-H426 CarbonylContact O-C 3.56Å; F422-H426 WeakPolarHBondContact O-CA 3.49Å; F422-H426 WeakPolarHBondContact O-CB 3.4Å; F422-H426 PolarHBondContact O-N 2.95Å; F422-H426 VanDerWaalsContact O-N 3.14Å; H426-T429 HydrophobicContact CB-CG2 4.19Å; H426-T429 WeakPolarHBondContact O-CB 3.21Å; H426-T429 VanDerWaalsContact O-CG2 3.29Å; H426-T429 WeakPolarHBondContact O-CG2 3.24Å; H426-T429 PolarHBondContact O-N 3.44Å; H426-T429 PolarHBondContact O-OG1 3.08Å
427	E	91.9	Very high	93.8	Very high	66 Å²	66	30.7 Å²	30.7	31%	0.308	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	140	173.9	-148.7	-121.8	150.9	0	0	111.7	V319 R423 T429	V319-E427 HydrophobicContact CB-CG 4.38Å; V319-E427 HydrophobicContact CG2-CB 4.39Å; V319-E427 HydrophobicContact CG2-CG 3.74Å; R423-E427 WeakPolarHBondContact O-CB 3.48Å; E427-T429 PolarHBondContact O-N 3.21Å
428	N	89.1	Confident	93.8	Very high	11 Å²	11	28.8 Å²	28.8	6%	0.059	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	15.9	-175.4	-44.4	-95.2	0	0	0	115	K302 T303 H304 K317 N318	K302-N428 HydrophobicContact CB-CB 4.44Å; T303-N428 PolarHBondContact N-O 3.02Å; H304-N428 WeakPolarHBondContact CA-O 3.36Å; H304-N428 PolarHBondContact N-O 2.99Å; K317-N428 WeakPolarHBondContact CD-OD1 3.42Å; K317-N428 WeakPolarHBondContact CE-OD1 3.38Å; K317-N428 PolarHBondContact NZ-OD1 3.36Å; N318-N428 PolarHBondContact OD1-N 2.97Å
429	T	93.3	Very high	93.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-88.8	176.2	173.8	69.1	0	0	0	0	111.4	E300 N318 H426 E427 N431	E300-T429 HydrophobicContact CB-CG2 4.22Å; E300-T429 HydrophobicContact CG-CG2 4.15Å; E300-T429 VanDerWaalsContact OE2-CG2 3.29Å; E300-T429 WeakPolarHBondContact OE2-CG2 3.41Å; N318-T429 PolarHBondContact ND2-OG1 3.02Å; H426-T429 HydrophobicContact CB-CG2 4.19Å; H426-T429 WeakPolarHBondContact O-CB 3.21Å; H426-T429 VanDerWaalsContact O-CG2 3.29Å; H426-T429 WeakPolarHBondContact O-CG2 3.24Å; H426-T429 PolarHBondContact O-N 3.44Å; H426-T429 PolarHBondContact O-OG1 3.08Å; E427-T429 PolarHBondContact O-N 3.21Å; T429-N431 PolarHBondContact O-N 2.83Å; T429-N431 PolarHBondContact OG1-N 2.85Å
430	K	93.8	Very high	93.9	Very high	89 Å²	89	31.5 Å²	31.5	39%	0.387	16%	0.164	S	C	.	.	S	Bend	trans	-79.6	4.2	172	67.5	-164.9	171.2	-164.6	0	114.3	T303 T305 F307 K442	T303-K430 HydrophobicContact CG2-CD 4.45Å; T303-K430 PolarHBondContact OG1-N 3.2Å; T303-K430 VanDerWaalsContact OG1-N 3.13Å; T305-K430 HydrophobicContact CG2-CB 4.3Å; F307-K430 WeakPolarHBondContact CZ-O 3.4Å; K430-K442 WeakPolarHBondContact O-CA 3.47Å
431	N	95.8	Very high	94	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	15%	0.146	C	C	.	.			trans	-100.5	140.9	-173.2	-60.6	-46.9	0	0	0	112.2	E300 N318 V407 F422 T429 I440 F441	E300-N431 PolarHBondContact OE1-ND2 2.75Å; E300-N431 PolarHBondContact OE2-ND2 3.21Å; N318-N431 WeakPolarHBondContact CB-O 3.44Å; N318-N431 PolarHBondContact ND2-O 3.3Å; V407-N431 WeakPolarHBondContact CG1-ND2 3.47Å; V407-N431 HydrophobicContact CG2-CB 4.31Å; F422-N431 HydrophobicContact CE2-CB 4.12Å; F422-N431 HydrophobicContact CZ-CB 3.87Å; T429-N431 PolarHBondContact O-N 2.83Å; T429-N431 PolarHBondContact OG1-N 2.85Å; N431-I440 HydrophobicContact CB-CG2 3.89Å; N431-F441 CarbonylContact C-O 3.57Å; N431-F441 WeakPolarHBondContact CA-O 3.43Å
432	L	96.6	Very high	94	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.1	175.1	-58.7	176.5	0	0	0	109.3	F307 N318 F321 M322 I440 F441 Y447	F307-L432 HydrophobicContact CD1-CD1 3.7Å; F307-L432 HydrophobicContact CD1-CD2 4.33Å; F307-L432 HydrophobicContact CD1-CG 4.21Å; F307-L432 HydrophobicContact CD2-CD2 4.11Å; F307-L432 HydrophobicContact CE1-CD1 3.76Å; F307-L432 HydrophobicContact CE1-CD2 4.25Å; F307-L432 HydrophobicContact CE1-CG 3.89Å; F307-L432 HydrophobicContact CE2-CD2 4.06Å; F307-L432 HydrophobicContact CG-CD1 4.29Å; F307-L432 HydrophobicContact CG-CD2 4.26Å; F307-L432 HydrophobicContact CZ-CD1 4.41Å; F307-L432 HydrophobicContact CZ-CD2 4.11Å; F307-L432 HydrophobicContact CZ-CG 4.06Å; N318-L432 HydrophobicContact CB-CD2 3.82Å; F321-L432 HydrophobicContact CD1-CD1 3.85Å; F321-L432 HydrophobicContact CD1-CD2 3.74Å; F321-L432 HydrophobicContact CD1-CG 4.47Å; F321-L432 HydrophobicContact CE1-CD1 3.69Å; F321-L432 HydrophobicContact CE1-CD2 4.43Å; M322-L432 HydrophobicContact CG-CB 4.42Å; M322-L432 HydrophobicContact CG-CD2 3.85Å; M322-L432 HydrophobicContact SD-CB 4.49Å; L432-I440 WeakPolarHBondContact O-CA 3.33Å; L432-F441 HydrophobicContact CB-CB 4.29Å; L432-F441 PolarHBondContact N-O 3.27Å; L432-F441 PolarHBondContact O-N 2.88Å; L432-Y447 HydrophobicContact CB-CD2 3.57Å; L432-Y447 HydrophobicContact CB-CE2 3.86Å; L432-Y447 HydrophobicContact CB-CG 4.01Å; L432-Y447 HydrophobicContact CD1-CD1 4.05Å; L432-Y447 HydrophobicContact CD1-CD2 4.17Å; L432-Y447 HydrophobicContact CD1-CG 3.7Å; L432-Y447 HydrophobicContact CG-CG 4.5Å
433	L	96.8	Very high	94	Very high	9 Å²	9	37.9 Å²	37.9	5%	0.047	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.7	178.8	-176.5	73.8	0	0	0	111.3	M322 F422 L438 I440 Y447	M322-L433 HydrophobicContact SD-CB 3.94Å; M322-L433 PolarHBondContact SD-N 2.79Å; M322-L433 VanDerWaalsContact SD-O 3.41Å; F422-L433 HydrophobicContact CB-CD2 3.83Å; F422-L433 HydrophobicContact CD1-CB 3.63Å; F422-L433 HydrophobicContact CD1-CD2 4.01Å; F422-L433 HydrophobicContact CD1-CG 4.41Å; F422-L433 HydrophobicContact CD2-CB 4.2Å; F422-L433 HydrophobicContact CD2-CD1 4.44Å; F422-L433 HydrophobicContact CD2-CD2 4.44Å; F422-L433 HydrophobicContact CE1-CB 3.6Å; F422-L433 HydrophobicContact CE2-CB 4.17Å; F422-L433 HydrophobicContact CG-CB 3.94Å; F422-L433 HydrophobicContact CG-CD2 3.81Å; F422-L433 HydrophobicContact CG-CG 4.34Å; F422-L433 HydrophobicContact CZ-CB 3.88Å; L433-L438 HydrophobicContact CD1-CB 4.1Å; L433-L438 HydrophobicContact CD1-CD2 3.95Å; L433-L438 WeakPolarHBondContact CD1-O 3.35Å; L433-L438 HydrophobicContact CD2-CD2 3.97Å; L433-L438 HydrophobicContact CG-CD2 4.25Å; L433-I440 HydrophobicContact CB-CD1 4.15Å; L433-I440 HydrophobicContact CD1-CD1 3.6Å; L433-Y447 WeakPolarHBondContact O-CE2 3.35Å; L433-Y447 PolarHBondContact O-OH 2.89Å
434	C	94.8	Very high	94.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.			trans	-80.4	121.7	166.9	-176.9	0	0	0	0	110.4	F436 C437 L438 K439 F441 H450	C434-F436 VanDerWaalsContact C-N 3.26Å; C434-F436 PolarHBondContact O-N 2.83Å; C434-C437 VanDerWaalsContact CB-SG 3.59Å; C434-L438 VanDerWaalsContact O-CA 3.28Å; C434-L438 WeakPolarHBondContact O-CA 3.38Å; C434-L438 PolarHBondContact O-N 2.78Å; C434-K439 PolarHBondContact N-O 3.14Å; C434-F441 HydrophobicContact CB-CE2 4.3Å; C434-H450 VanDerWaalsContact SG-CD2 3.51Å
435	P	91.3	Very high	94.1	Very high	19 Å²	19	34.2 Å²	34.2	12%	0.123	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.1	-175.5	29.9	-35.8	0	0	0	114.1	F415 Y451	F415-P435 WeakPolarHBondContact CE2-O 3.15Å; F415-P435 WeakPolarHBondContact CZ-O 3.49Å; P435-Y451 HydrophobicContact CG-CE2 3.71Å
436	F	91.6	Very high	94.3	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.018	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-35.8	179.2	-65.6	-88.7	0	0	0	113.5	H349 C434 Y451 H454 W455 L467 Q468	H349-F436 HydrophobicContact CB-CD1 4.12Å; H349-F436 HydrophobicContact CB-CE1 3.73Å; H349-F436 HydrophobicContact CB-CZ 4.25Å; C434-F436 VanDerWaalsContact C-N 3.26Å; C434-F436 PolarHBondContact O-N 2.83Å; F436-Y451 HydrophobicContact CE2-CD1 4.13Å; F436-Y451 AromaticContact CE2-CE1 3.73Å; F436-Y451 HydrophobicContact CE2-CE1 3.73Å; F436-Y451 HydrophobicContact CE2-CE2 4.33Å; F436-Y451 AromaticContact CE2-CZ 3.82Å; F436-Y451 HydrophobicContact CZ-CE1 4.42Å; F436-H454 HydrophobicContact CB-CB 4.22Å; F436-H454 WeakPolarHBondContact CB-ND1 3.33Å; F436-H454 HydrophobicContact CD1-CB 3.89Å; F436-H454 HydrophobicContact CD2-CB 3.61Å; F436-H454 AromaticContact CD2-CD2 3.86Å; F436-H454 AromaticContact CD2-CG 3.67Å; F436-H454 HydrophobicContact CE1-CB 4.1Å; F436-H454 HydrophobicContact CE2-CB 3.85Å; F436-H454 HydrophobicContact CG-CB 3.64Å; F436-H454 AromaticContact CG-CG 3.52Å; F436-H454 AromaticContact CG-ND1 3.79Å; F436-H454 HydrophobicContact CZ-CB 4.08Å; F436-W455 AromaticContact CZ-CE3 3.97Å; F436-W455 HydrophobicContact CZ-CE3 3.97Å; F436-W455 AromaticContact CZ-CZ3 3.86Å; F436-W455 HydrophobicContact CZ-CZ3 3.86Å; F436-L467 CarbonylContact O-C 3.59Å; F436-L467 VanDerWaalsContact O-CA 3.24Å; F436-L467 WeakPolarHBondContact O-CA 3.31Å; F436-L467 WeakPolarHBondContact O-CD2 3.33Å; F436-Q468 CarbonylContact C-O 3.57Å; F436-Q468 PolarHBondContact O-N 2.91Å
437	C	94.4	Very high	94.4	Very high	7 Å²	7	33.8 Å²	33.8	5%	0.047	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-1.4	-168.2	61.4	0	0	0	0	114.4	C434 K439 H450 Q468 F469	C434-C437 VanDerWaalsContact CB-SG 3.59Å; C437-K439 PolarHBondContact O-N 2.92Å; C437-K439 VanDerWaalsContact O-N 3.13Å; C437-K439 WeakPolarHBondContact SG-CB 3.48Å; C437-K439 PolarHBondContact SG-N 3.48Å; C437-H450 PolarHBondContact SG-NE2 2.84Å; C437-Q468 VanDerWaalsContact CB-O 3.26Å; C437-Q468 WeakPolarHBondContact CB-O 3.46Å; C437-F469 HydrophobicContact CB-CD1 3.98Å; C437-F469 HydrophobicContact CB-CE1 4.01Å
438	L	95.8	Very high	94.5	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	16%	0.162	C	C	.	.			trans	58.2	15.7	-172.9	-57.3	174.6	0	0	0	115.4	Y403 F415 V418 L433 C434 L467	Y403-L438 HydrophobicContact CD1-CD1 3.92Å; Y403-L438 HydrophobicContact CG-CD1 4.43Å; F415-L438 HydrophobicContact CD2-CD2 4.43Å; F415-L438 HydrophobicContact CE2-CD1 4.39Å; F415-L438 HydrophobicContact CE2-CD2 3.65Å; F415-L438 HydrophobicContact CE2-CG 4.02Å; F415-L438 HydrophobicContact CZ-CD2 3.78Å; V418-L438 HydrophobicContact CG1-CD1 4.14Å; V418-L438 HydrophobicContact CG1-CD2 4.31Å; L433-L438 HydrophobicContact CD1-CB 4.1Å; L433-L438 HydrophobicContact CD1-CD2 3.95Å; L433-L438 WeakPolarHBondContact CD1-O 3.35Å; L433-L438 HydrophobicContact CD2-CD2 3.97Å; L433-L438 HydrophobicContact CG-CD2 4.25Å; C434-L438 VanDerWaalsContact O-CA 3.28Å; C434-L438 WeakPolarHBondContact O-CA 3.38Å; C434-L438 PolarHBondContact O-N 2.78Å; L438-L467 HydrophobicContact CD1-CD1 4.37Å; L438-L467 HydrophobicContact CD1-CD2 4.26Å; L438-L467 HydrophobicContact CG-CD2 4.08Å
439	K	95.9	Very high	94.6	Very high	73 Å²	73	33.7 Å²	33.7	32%	0.317	18%	0.18	S	C	.	.			trans	-70.2	135.3	177.4	-162.6	170	-168.4	171.3	0	111.4	C434 C437 F441 E474	C434-K439 PolarHBondContact N-O 3.14Å; C437-K439 PolarHBondContact O-N 2.92Å; C437-K439 VanDerWaalsContact O-N 3.13Å; C437-K439 WeakPolarHBondContact SG-CB 3.48Å; C437-K439 PolarHBondContact SG-N 3.48Å; K439-F441 HydrophobicContact CB-CE2 4.01Å; K439-F441 HydrophobicContact CD-CE2 4.35Å; K439-F441 HydrophobicContact CD-CZ 4.03Å; K439-F441 HydrophobicContact CG-CE2 3.98Å; K439-F441 HydrophobicContact CG-CZ 4.11Å; K439-E474 IonicContact NZ-OE1 2.75Å; K439-E474 PolarHBondContact NZ-OE1 3.13Å
440	I	96.1	Very high	94.6	Very high	31 Å²	31	34.6 Å²	34.6	16%	0.159	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.9	-177	-62.7	-67.4	0	0	0	112	Q406 V407 F422 N431 L432 L433	Q406-I440 HydrophobicContact CB-CG1 3.81Å; V407-I440 HydrophobicContact CG2-CD1 3.73Å; V407-I440 HydrophobicContact CG2-CG1 3.76Å; V407-I440 HydrophobicContact CG2-CG2 4.17Å; F422-I440 HydrophobicContact CD2-CD1 4.07Å; F422-I440 HydrophobicContact CE2-CD1 3.44Å; F422-I440 VanDerWaalsContact CE2-CD1 3.44Å; F422-I440 HydrophobicContact CZ-CD1 4.05Å; N431-I440 HydrophobicContact CB-CG2 3.89Å; L432-I440 WeakPolarHBondContact O-CA 3.33Å; L433-I440 HydrophobicContact CB-CD1 4.15Å; L433-I440 HydrophobicContact CD1-CD1 3.6Å
441	F	96.8	Very high	94.4	Very high	30 Å²	30	30.4 Å²	30.4	13%	0.132	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.6	175	-63.8	-92.9	0	0	0	110.9	N431 L432 C434 K439 P446 Y447 H450	N431-F441 CarbonylContact C-O 3.57Å; N431-F441 WeakPolarHBondContact CA-O 3.43Å; L432-F441 HydrophobicContact CB-CB 4.29Å; L432-F441 PolarHBondContact N-O 3.27Å; L432-F441 PolarHBondContact O-N 2.88Å; C434-F441 HydrophobicContact CB-CE2 4.3Å; K439-F441 HydrophobicContact CB-CE2 4.01Å; K439-F441 HydrophobicContact CD-CE2 4.35Å; K439-F441 HydrophobicContact CD-CZ 4.03Å; K439-F441 HydrophobicContact CG-CE2 3.98Å; K439-F441 HydrophobicContact CG-CZ 4.11Å; F441-P446 HydrophobicContact CD1-CB 4.01Å; F441-P446 HydrophobicContact CE1-CB 4.37Å; F441-Y447 HydrophobicContact CB-CD2 4.18Å; F441-Y447 AromaticContact CD2-CD2 3.86Å; F441-Y447 HydrophobicContact CD2-CD2 3.86Å; F441-Y447 HydrophobicContact CG-CD2 4.22Å; F441-H450 HydrophobicContact CE1-CB 3.93Å; F441-H450 HydrophobicContact CE2-CB 4.08Å; F441-H450 AromaticContact CE2-CD2 3.36Å; F441-H450 WeakPolarHBondContact CE2-CD2 3.09Å; F441-H450 AromaticContact CE2-CG 3.7Å; F441-H450 AromaticContact CE2-NE2 3.92Å; F441-H450 HydrophobicContact CZ-CB 3.48Å; F441-H450 VanDerWaalsContact CZ-CB 3.48Å; F441-H450 AromaticContact CZ-CD2 3.42Å; F441-H450 VanDerWaalsContact CZ-CD2 3.42Å; F441-H450 WeakPolarHBondContact CZ-CD2 3.31Å; F441-H450 AromaticContact CZ-CG 3.24Å; F441-H450 AromaticContact CZ-ND1 3.7Å; F441-H450 AromaticContact CZ-NE2 3.97Å
442	K	95	Very high	94.1	Very high	136 Å²	136	36 Å²	36	59%	0.591	19%	0.187	S	C	*	.	S	Bend	trans	-110.8	1	-178.5	-68.7	169.6	-176.4	165.9	0	113.9	K430	K430-K442 WeakPolarHBondContact O-CA 3.47Å
443	T	95	Very high	93.7	Very high	77 Å²	77	37.4 Å²	37.4	47%	0.472	20%	0.202	S	C	.	.	S	Bend	trans	-146.4	152.6	-174.1	47.2	0	0	0	0	110.9	P446 Y447	T443-P446 VanDerWaalsContact OG1-CD 3.29Å; T443-P446 WeakPolarHBondContact OG1-CD 3.39Å; T443-P446 WeakPolarHBondContact OG1-CG 3.49Å; T443-Y447 WeakPolarHBondContact O-CB 3.48Å
444	A	94.5	Very high	93.2	Very high	13 Å²	13	37.4 Å²	37.4	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-68.4	-46.5	-171.6	0	0	0	0	0	113.9	F307 L310 F321 Y447 M448	F307-A444 HydrophobicContact CB-CB 4.34Å; F307-A444 HydrophobicContact CD1-CB 4.3Å; L310-A444 HydrophobicContact CD1-CB 4.49Å; F321-A444 HydrophobicContact CE1-CB 4.28Å; F321-A444 HydrophobicContact CE2-CB 4.27Å; F321-A444 HydrophobicContact CZ-CB 3.66Å; A444-Y447 WeakPolarHBondContact O-CB 3.4Å; A444-Y447 PolarHBondContact O-N 2.79Å; A444-M448 WeakPolarHBondContact O-CG 3.42Å; A444-M448 PolarHBondContact O-N 3.27Å
445	T	93.9	Very high	92.2	Very high	73 Å²	73	39.9 Å²	39.9	45%	0.448	21%	0.211	S	C	.	.	H	α-helix	trans	-64.9	-51.4	-172.7	-35.9	0	0	0	0	112.9	L310 Y447 M448 C449	L310-T445 HydrophobicContact CD1-CG2 4.29Å; L310-T445 HydrophobicContact CD2-CG2 3.92Å; T445-Y447 VanDerWaalsContact C-N 3.27Å; T445-Y447 PolarHBondContact O-N 2.93Å; T445-M448 PolarHBondContact O-N 2.95Å; T445-M448 VanDerWaalsContact O-N 3.16Å; T445-C449 PolarHBondContact O-N 2.86Å; T445-C449 PolarHBondContact O-SG 3.46Å; T445-C449 VanDerWaalsContact O-SG 3.38Å
446	P	95.3	Very high	91.2	Very high	61 Å²	61	40.7 Å²	40.7	40%	0.396	22%	0.223	S	C	.	.	H	α-helix	trans	-64.1	-33.3	179.3	-22.2	36.4	0	0	0	112.5	F441 T443 H450	F441-P446 HydrophobicContact CD1-CB 4.01Å; F441-P446 HydrophobicContact CE1-CB 4.37Å; T443-P446 VanDerWaalsContact OG1-CD 3.29Å; T443-P446 WeakPolarHBondContact OG1-CD 3.39Å; T443-P446 WeakPolarHBondContact OG1-CG 3.49Å; P446-H450 WeakPolarHBondContact O-CB 3.38Å; P446-H450 PolarHBondContact O-N 3.17Å
447	Y	95.8	Very high	89.7	Confident	3 Å²	3	50.6 Å²	50.6	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-61.8	-48.8	172.4	176.9	-97.8	0	0	0	112.1	F321 M322 V325 L432 L433 F441 T443 A444 T445 H450 Y451	F321-Y447 HydrophobicContact CD1-CD1 4.42Å; F321-Y447 HydrophobicContact CD1-CE1 4.47Å; F321-Y447 AromaticContact CE1-CD1 3.73Å; F321-Y447 HydrophobicContact CE1-CD1 3.73Å; F321-Y447 HydrophobicContact CE1-CE1 4.15Å; M322-Y447 WeakPolarHBondContact CB-OH 3.39Å; M322-Y447 HydrophobicContact CG-CE1 4.45Å; M322-Y447 HydrophobicContact CG-CE2 4.45Å; M322-Y447 WeakPolarHBondContact CG-OH 3.28Å; V325-Y447 HydrophobicContact CB-CE1 4.04Å; V325-Y447 HydrophobicContact CG1-CD1 4.28Å; V325-Y447 HydrophobicContact CG1-CE1 3.82Å; V325-Y447 HydrophobicContact CG2-CE1 4.41Å; L432-Y447 HydrophobicContact CB-CD2 3.57Å; L432-Y447 HydrophobicContact CB-CE2 3.86Å; L432-Y447 HydrophobicContact CB-CG 4.01Å; L432-Y447 HydrophobicContact CD1-CD1 4.05Å; L432-Y447 HydrophobicContact CD1-CD2 4.17Å; L432-Y447 HydrophobicContact CD1-CG 3.7Å; L432-Y447 HydrophobicContact CG-CG 4.5Å; L433-Y447 WeakPolarHBondContact O-CE2 3.35Å; L433-Y447 PolarHBondContact O-OH 2.89Å; F441-Y447 HydrophobicContact CB-CD2 4.18Å; F441-Y447 AromaticContact CD2-CD2 3.86Å; F441-Y447 HydrophobicContact CD2-CD2 3.86Å; F441-Y447 HydrophobicContact CG-CD2 4.22Å; T443-Y447 WeakPolarHBondContact O-CB 3.48Å; A444-Y447 WeakPolarHBondContact O-CB 3.4Å; A444-Y447 PolarHBondContact O-N 2.79Å; T445-Y447 VanDerWaalsContact C-N 3.27Å; T445-Y447 PolarHBondContact O-N 2.93Å; Y447-H450 PolarHBondContact O-N 3.29Å; Y447-Y451 HydrophobicContact CE1-CD2 4.32Å; Y447-Y451 WeakPolarHBondContact O-CB 3.42Å; Y447-Y451 PolarHBondContact O-N 2.98Å
448	M	92.7	Very high	88.5	Confident	11 Å²	11	54.5 Å²	54.5	5%	0.054	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-41.3	180	-73.2	-174.7	66.2	0	0	112.1	L310 F321 V325 A444 T445 R452	L310-M448 HydrophobicContact CB-CE 4.3Å; L310-M448 HydrophobicContact CB-SD 4.2Å; L310-M448 HydrophobicContact CD1-SD 3.62Å; F321-M448 HydrophobicContact CZ-CG 4.18Å; F321-M448 HydrophobicContact CZ-SD 4.08Å; V325-M448 HydrophobicContact CG1-CG 3.97Å; V325-M448 HydrophobicContact CG2-CE 4.49Å; V325-M448 HydrophobicContact CG2-CG 3.91Å; V325-M448 HydrophobicContact CG2-SD 4.08Å; A444-M448 WeakPolarHBondContact O-CG 3.42Å; A444-M448 PolarHBondContact O-N 3.27Å; T445-M448 PolarHBondContact O-N 2.95Å; T445-M448 VanDerWaalsContact O-N 3.16Å; M448-R452 WeakPolarHBondContact O-CB 3.39Å; M448-R452 PolarHBondContact O-N 2.8Å
449	C	91.3	Very high	88	Confident	65 Å²	65	55.4 Å²	55.4	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175.4	-62.6	0	0	0	0	111.7	T445 R452 G453	T445-C449 PolarHBondContact O-N 2.86Å; T445-C449 PolarHBondContact O-SG 3.46Å; T445-C449 VanDerWaalsContact O-SG 3.38Å; C449-R452 PolarHBondContact O-N 3.06Å; C449-G453 PolarHBondContact O-N 3.23Å
450	H	93.3	Very high	87.8	Confident	18 Å²	18	55 Å²	55	8%	0.083	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-43.1	177.4	178.8	79.8	0	0	0	112.8	C434 C437 F441 P446 Y447 G453 H454 L470	C434-H450 VanDerWaalsContact SG-CD2 3.51Å; C437-H450 PolarHBondContact SG-NE2 2.84Å; F441-H450 HydrophobicContact CE1-CB 3.93Å; F441-H450 HydrophobicContact CE2-CB 4.08Å; F441-H450 AromaticContact CE2-CD2 3.36Å; F441-H450 WeakPolarHBondContact CE2-CD2 3.09Å; F441-H450 AromaticContact CE2-CG 3.7Å; F441-H450 AromaticContact CE2-NE2 3.92Å; F441-H450 HydrophobicContact CZ-CB 3.48Å; F441-H450 VanDerWaalsContact CZ-CB 3.48Å; F441-H450 AromaticContact CZ-CD2 3.42Å; F441-H450 VanDerWaalsContact CZ-CD2 3.42Å; F441-H450 WeakPolarHBondContact CZ-CD2 3.31Å; F441-H450 AromaticContact CZ-CG 3.24Å; F441-H450 AromaticContact CZ-ND1 3.7Å; F441-H450 AromaticContact CZ-NE2 3.97Å; P446-H450 WeakPolarHBondContact O-CB 3.38Å; P446-H450 PolarHBondContact O-N 3.17Å; Y447-H450 PolarHBondContact O-N 3.29Å; H450-G453 PolarHBondContact O-N 3.1Å; H450-G453 VanDerWaalsContact O-N 3.13Å; H450-H454 AromaticContact CD2-CD2 3.98Å; H450-H454 AromaticContact CD2-NE2 3.69Å; H450-H454 AromaticContact CE1-NE2 3.38Å; H450-H454 PolarHBondContact CE1-NE2 2.88Å; H450-H454 AromaticContact NE2-CD2 3.73Å; H450-H454 AromaticContact NE2-NE2 2.97Å; H450-H454 PolarHBondContact NE2-NE2 2.86Å; H450-H454 PolarHBondContact O-CD2 2.94Å; H450-H454 VanDerWaalsContact O-CD2 3.28Å; H450-H454 PolarHBondContact O-N 2.76Å; H450-L470 WeakPolarHBondContact ND1-CD1 3.46Å
451	Y	90.3	Very high	87.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-45.5	176	-164	-61.2	0	0	0	110.5	K326 L329 P435 F436 Y447 G453 H454	K326-Y451 HydrophobicContact CB-CE2 4.39Å; K326-Y451 WeakPolarHBondContact CB-OH 3.27Å; K326-Y451 WeakPolarHBondContact CG-OH 3.42Å; L329-Y451 HydrophobicContact CB-CD1 4.25Å; L329-Y451 HydrophobicContact CB-CE1 4.27Å; L329-Y451 HydrophobicContact CD1-CD1 3.32Å; L329-Y451 HydrophobicContact CD1-CE1 4.08Å; L329-Y451 HydrophobicContact CD1-CG 3.71Å; L329-Y451 HydrophobicContact CG-CD1 4.4Å; P435-Y451 HydrophobicContact CG-CE2 3.71Å; F436-Y451 HydrophobicContact CE2-CD1 4.13Å; F436-Y451 AromaticContact CE2-CE1 3.73Å; F436-Y451 HydrophobicContact CE2-CE1 3.73Å; F436-Y451 HydrophobicContact CE2-CE2 4.33Å; F436-Y451 AromaticContact CE2-CZ 3.82Å; F436-Y451 HydrophobicContact CZ-CE1 4.42Å; Y447-Y451 HydrophobicContact CE1-CD2 4.32Å; Y447-Y451 WeakPolarHBondContact O-CB 3.42Å; Y447-Y451 PolarHBondContact O-N 2.98Å; Y451-G453 PolarHBondContact O-N 3.48Å; Y451-H454 PolarHBondContact O-N 2.93Å; Y451-H454 VanDerWaalsContact O-N 3.16Å
452	R	88	Confident	87.3	Confident	119 Å²	119	54.3 Å²	54.3	45%	0.449	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-33	174.8	-171	-176.1	-63.7	-77.5	2.6	112.1	L329 E332 M448 C449 H454 W455	L329-R452 HydrophobicContact CD2-CB 4.44Å; L329-R452 VanDerWaalsContact CD2-CZ 3.48Å; E332-R452 IonicContact OE1-NH2 3.93Å; E332-R452 IonicContact OE2-CZ 3.18Å; E332-R452 IonicContact OE2-NH1 2.72Å; E332-R452 PolarHBondContact OE2-NH1 3.02Å; E332-R452 IonicContact OE2-NH2 2.71Å; E332-R452 PolarHBondContact OE2-NH2 3.33Å; M448-R452 WeakPolarHBondContact O-CB 3.39Å; M448-R452 PolarHBondContact O-N 2.8Å; C449-R452 PolarHBondContact O-N 3.06Å; R452-H454 VanDerWaalsContact C-N 3.34Å; R452-H454 PolarHBondContact O-N 3.3Å; R452-W455 WeakPolarHBondContact O-CB 3.39Å; R452-W455 PolarHBondContact O-N 3.07Å
453	G	88.4	Confident	87	Confident	31 Å²	31	51.9 Å²	51.9	32%	0.32	30%	0.295	S	S	.	.	H	α-helix	trans	-58.7	-38.5	174.6	0	0	0	0	0	114	C449 H450 Y451 W455 G456	C449-G453 PolarHBondContact O-N 3.23Å; H450-G453 PolarHBondContact O-N 3.1Å; H450-G453 VanDerWaalsContact O-N 3.13Å; Y451-G453 PolarHBondContact O-N 3.48Å; G453-W455 PolarHBondContact O-N 3.1Å; G453-G456 PolarHBondContact O-N 3.39Å; G453-G456 VanDerWaalsContact O-N 3.13Å
454	H	86.2	Confident	86.9	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.037	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-6.9	176.7	-71.2	-76.8	0	0	0	113.5	F436 H450 Y451 R452 T459 Q468 L470	F436-H454 HydrophobicContact CB-CB 4.22Å; F436-H454 WeakPolarHBondContact CB-ND1 3.33Å; F436-H454 HydrophobicContact CD1-CB 3.89Å; F436-H454 HydrophobicContact CD2-CB 3.61Å; F436-H454 AromaticContact CD2-CD2 3.86Å; F436-H454 AromaticContact CD2-CG 3.67Å; F436-H454 HydrophobicContact CE1-CB 4.1Å; F436-H454 HydrophobicContact CE2-CB 3.85Å; F436-H454 HydrophobicContact CG-CB 3.64Å; F436-H454 AromaticContact CG-CG 3.52Å; F436-H454 AromaticContact CG-ND1 3.79Å; F436-H454 HydrophobicContact CZ-CB 4.08Å; H450-H454 AromaticContact CD2-CD2 3.98Å; H450-H454 AromaticContact CD2-NE2 3.69Å; H450-H454 AromaticContact CE1-NE2 3.38Å; H450-H454 PolarHBondContact CE1-NE2 2.88Å; H450-H454 AromaticContact NE2-CD2 3.73Å; H450-H454 AromaticContact NE2-NE2 2.97Å; H450-H454 PolarHBondContact NE2-NE2 2.86Å; H450-H454 PolarHBondContact O-CD2 2.94Å; H450-H454 VanDerWaalsContact O-CD2 3.28Å; H450-H454 PolarHBondContact O-N 2.76Å; Y451-H454 PolarHBondContact O-N 2.93Å; Y451-H454 VanDerWaalsContact O-N 3.16Å; R452-H454 VanDerWaalsContact C-N 3.34Å; R452-H454 PolarHBondContact O-N 3.3Å; H454-T459 HydrophobicContact CB-CG2 4.36Å; H454-T459 WeakPolarHBondContact O-CG2 3.44Å; H454-Q468 PolarHBondContact CE1-O 3.3Å; H454-Q468 VanDerWaalsContact CE1-O 3.25Å; H454-L470 HydrophobicContact CB-CD2 4.32Å
455	W	75	Confident	86.8	Confident	52 Å²	52	49.6 Å²	49.6	20%	0.197	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-6.1	-179.9	-139.7	-94	0	0	0	113.3	E330 K333 F436 R452 G453	E330-W455 WeakPolarHBondContact OE1-CH2 3.42Å; E330-W455 WeakPolarHBondContact OE1-CZ2 3.35Å; E330-W455 WeakPolarHBondContact OE2-CH2 3.41Å; K333-W455 HydrophobicContact CB-CZ2 3.61Å; K333-W455 HydrophobicContact CD-CZ2 3.52Å; K333-W455 HydrophobicContact CG-CZ2 3.94Å; K333-W455 VanDerWaalsContact NZ-CE2 3.34Å; F436-W455 AromaticContact CZ-CE3 3.97Å; F436-W455 HydrophobicContact CZ-CE3 3.97Å; F436-W455 AromaticContact CZ-CZ3 3.86Å; F436-W455 HydrophobicContact CZ-CZ3 3.86Å; R452-W455 WeakPolarHBondContact O-CB 3.39Å; R452-W455 PolarHBondContact O-N 3.07Å; G453-W455 PolarHBondContact O-N 3.1Å
456	G	69.1	Low	86.6	Confident	36 Å²	36	47 Å²	47	37%	0.371	26%	0.258	S	S	.	.	S	Bend	trans	-71.2	160.4	168.7	0	0	0	0	0	111.8	G453 S458	G453-G456 PolarHBondContact O-N 3.39Å; G453-G456 VanDerWaalsContact O-N 3.13Å; G456-S458 PolarHBondContact O-N 3.12Å
457	K	60.6	Low	86.5	Confident	212 Å²	212	44.3 Å²	44.3	92%	0.922	24%	0.24	S	C	*	.	S	Bend	trans	-71.8	13.9	-176.8	-64.3	-175.5	176.6	-178	0	114.8
458	S	68.9	Low	86.4	Confident	90 Å²	90	44.3 Å²	44.3	63%	0.629	24%	0.241	S	C	*	.			trans	-143.2	55.7	-168.2	62.9	0	0	0	0	112.5	G456	G456-S458 PolarHBondContact O-N 3.12Å
459	T	86.1	Confident	86.5	Confident	23 Å²	23	44.5 Å²	44.5	14%	0.141	24%	0.241	C	C	.	.			trans	-90.3	154	166.1	67.8	0	0	0	0	111	H454	H454-T459 HydrophobicContact CB-CG2 4.36Å; H454-T459 WeakPolarHBondContact O-CG2 3.44Å
460	H	90.8	Very high	86.6	Confident	64 Å²	64	43.9 Å²	43.9	30%	0.296	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	90.4	179.1	-63.1	-83.1	0	0	0	109.7	F469 F472 K475	H460-F469 PolarHBondContact N-O 3.4Å; H460-F469 PolarHBondContact O-N 2.87Å; H460-F469 VanDerWaalsContact O-N 3.1Å; H460-F472 PolarHBondContact CD2-N 3.17Å; H460-F472 PolarHBondContact NE2-N 3.2Å; H460-K475 HydrophobicContact CB-CB 4.04Å; H460-K475 HydrophobicContact CB-CD 3.82Å; H460-K475 HydrophobicContact CB-CG 4.49Å
461	Q	89.9	Confident	86.6	Confident	45 Å²	45	46 Å²	46	21%	0.21	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	137.1	175.5	-172.5	176.7	-5.2	0	0	112.1	Q468 K475	Q461-Q468 HydrophobicContact CB-CG 3.87Å; Q461-Q468 HydrophobicContact CG-CG 3.99Å; Q461-K475 VanDerWaalsContact O-CD 3.31Å; Q461-K475 WeakPolarHBondContact O-CD 3.46Å; Q461-K475 WeakPolarHBondContact O-CE 3.22Å; Q461-K475 PolarHBondContact O-NZ 3.16Å
462	C	92.7	Very high	86.7	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.007	27%	0.272	C	S	.	.			trans	-73.2	135.5	167.8	-178.4	0	0	0	0	110.8	K464 C465 L467 F469	C462-K464 VanDerWaalsContact C-N 3.27Å; C462-K464 PolarHBondContact O-N 3.25Å; C462-K464 PolarHBondContact SG-N 3.19Å; C462-C465 WeakPolarHBondContact CB-SG 3.04Å; C462-C465 VanDerWaalsContact O-O 3.07Å; C462-C465 VanDerWaalsContact SG-SG 3.65Å; C462-L467 PolarHBondContact N-O 3.32Å; C462-F469 HydrophobicContact CB-CE2 4.37Å
463	S	90.1	Very high	87	Confident	86 Å²	86	52.6 Å²	52.6	60%	0.601	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.7	178.7	47.4	0	0	0	0	114.2
464	K	91.4	Very high	87.3	Confident	41 Å²	41	52.8 Å²	52.8	18%	0.178	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-4	-177.5	-65.3	-172.1	170.2	-142.4	0	114.7	H395 H396 C462 H483	H395-K464 VanDerWaalsContact O-CD 3.25Å; H395-K464 WeakPolarHBondContact O-CD 3.39Å; H395-K464 WeakPolarHBondContact O-CE 3.35Å; H395-K464 PolarHBondContact O-NZ 3.35Å; H396-K464 PolarHBondContact CE1-O 3.2Å; C462-K464 VanDerWaalsContact C-N 3.27Å; C462-K464 PolarHBondContact O-N 3.25Å; C462-K464 PolarHBondContact SG-N 3.19Å; K464-H483 WeakPolarHBondContact CB-CE1 3.44Å; K464-H483 WeakPolarHBondContact CB-ND1 3.26Å; K464-H483 HydrophobicContact CD-CB 3.82Å; K464-H483 PolarHBondContact O-CE1 3.36Å; K464-H483 VanDerWaalsContact O-CE1 3.27Å
465	C	93.4	Very high	87.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	-150.4	-179.5	-178.8	74.4	0	0	0	0	110.7	Y403 C462 L467 H478	Y403-C465 HydrophobicContact CE1-CB 4.18Å; Y403-C465 WeakPolarHBondContact OH-CB 3.31Å; C462-C465 WeakPolarHBondContact CB-SG 3.04Å; C462-C465 VanDerWaalsContact O-O 3.07Å; C462-C465 VanDerWaalsContact SG-SG 3.65Å; C465-L467 VanDerWaalsContact C-N 3.35Å; C465-L467 VanDerWaalsContact SG-CB 3.6Å; C465-L467 PolarHBondContact SG-N 3Å; C465-H478 PolarHBondContact SG-NE2 3.38Å
466	R	90.2	Very high	88.7	Confident	19 Å²	19	54.6 Å²	54.6	7%	0.072	28%	0.283	C	S	.	.	S	Bend	trans	-83.9	-4.3	175.2	69.7	-174.7	-108.4	-162.7	-6.4	114.7	C348 E379 Y403 F415	C348-R466 PolarHBondContact O-NE 3.35Å; C348-R466 PolarHBondContact O-NH2 3.22Å; E379-R466 VanDerWaalsContact CD-NH1 3.32Å; E379-R466 WeakPolarHBondContact OE1-CD 3.24Å; E379-R466 IonicContact OE1-CZ 3.68Å; E379-R466 IonicContact OE1-NE 2.72Å; E379-R466 IonicContact OE1-NH1 3.08Å; E379-R466 PolarHBondContact OE1-NH1 2.97Å; E379-R466 WeakPolarHBondContact OE2-CD 3.41Å; E379-R466 IonicContact OE2-CZ 2.81Å; E379-R466 IonicContact OE2-NE 3.61Å; E379-R466 IonicContact OE2-NH1 3.65Å; E379-R466 PolarHBondContact OE2-NH1 3.26Å; E379-R466 VanDerWaalsContact OE2-NH1 3.08Å; Y403-R466 HydrophobicContact CE1-CG 4.16Å; Y403-R466 PolarHBondContact OH-N 3.1Å; Y403-R466 VanDerWaalsContact OH-N 3.1Å; F415-R466 HydrophobicContact CB-CG 4.32Å; F415-R466 VanDerWaalsContact CD1-NH2 3.28Å; F415-R466 HydrophobicContact CD2-CG 3.92Å; F415-R466 HydrophobicContact CG-CG 4.3Å; F415-R466 VanDerWaalsContact CG-CZ 3.46Å
467	L	93.1	Very high	89.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	28%	0.282	C	S	.	.			trans	-71.3	143.7	-176.1	-56	-171.4	0	0	0	113	Y403 F415 F436 L438 C462 C465 F469	Y403-L467 HydrophobicContact CD1-CD1 4.28Å; Y403-L467 HydrophobicContact CD1-CD2 3.98Å; Y403-L467 HydrophobicContact CD1-CG 4.13Å; Y403-L467 HydrophobicContact CE1-CD1 4.39Å; Y403-L467 HydrophobicContact CE1-CD2 3.79Å; Y403-L467 HydrophobicContact CE1-CG 3.8Å; F415-L467 HydrophobicContact CD2-CD2 3.84Å; F415-L467 HydrophobicContact CE2-CD2 3.63Å; F436-L467 CarbonylContact O-C 3.59Å; F436-L467 VanDerWaalsContact O-CA 3.24Å; F436-L467 WeakPolarHBondContact O-CA 3.31Å; F436-L467 WeakPolarHBondContact O-CD2 3.33Å; L438-L467 HydrophobicContact CD1-CD1 4.37Å; L438-L467 HydrophobicContact CD1-CD2 4.26Å; L438-L467 HydrophobicContact CG-CD2 4.08Å; C462-L467 PolarHBondContact N-O 3.32Å; C465-L467 VanDerWaalsContact C-N 3.35Å; C465-L467 VanDerWaalsContact SG-CB 3.6Å; C465-L467 PolarHBondContact SG-N 3Å; L467-F469 HydrophobicContact CB-CE2 3.69Å; L467-F469 HydrophobicContact CB-CZ 3.69Å; L467-F469 HydrophobicContact CD1-CZ 3.86Å; L467-F469 HydrophobicContact CG-CZ 4.43Å
468	Q	93.1	Very high	91.6	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.019	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.9	175.7	-73.2	158.5	64.1	0	0	109.2	H349 F436 C437 H454 Q461	H349-Q468 PolarHBondContact O-NE2 3.4Å; F436-Q468 CarbonylContact C-O 3.57Å; F436-Q468 PolarHBondContact O-N 2.91Å; C437-Q468 VanDerWaalsContact CB-O 3.26Å; C437-Q468 WeakPolarHBondContact CB-O 3.46Å; H454-Q468 PolarHBondContact CE1-O 3.3Å; H454-Q468 VanDerWaalsContact CE1-O 3.25Å; Q461-Q468 HydrophobicContact CB-CG 3.87Å; Q461-Q468 HydrophobicContact CG-CG 3.99Å
469	F	94.2	Very high	92.7	Very high	14 Å²	14	47.7 Å²	47.7	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	153.4	-175.8	-59.8	-84.2	0	0	0	110.7	C437 H460 C462 L467 T471 E474 K475 H478	C437-F469 HydrophobicContact CB-CD1 3.98Å; C437-F469 HydrophobicContact CB-CE1 4.01Å; H460-F469 PolarHBondContact N-O 3.4Å; H460-F469 PolarHBondContact O-N 2.87Å; H460-F469 VanDerWaalsContact O-N 3.1Å; C462-F469 HydrophobicContact CB-CE2 4.37Å; L467-F469 HydrophobicContact CB-CE2 3.69Å; L467-F469 HydrophobicContact CB-CZ 3.69Å; L467-F469 HydrophobicContact CD1-CZ 3.86Å; L467-F469 HydrophobicContact CG-CZ 4.43Å; F469-T471 VanDerWaalsContact C-N 3.28Å; F469-E474 HydrophobicContact CB-CB 3.84Å; F469-E474 HydrophobicContact CD1-CB 3.76Å; F469-E474 HydrophobicContact CG-CB 4.03Å; F469-K475 HydrophobicContact CB-CB 4.25Å; F469-K475 HydrophobicContact CD2-CB 3.84Å; F469-K475 HydrophobicContact CD2-CG 4.35Å; F469-K475 HydrophobicContact CG-CB 4.28Å; F469-H478 HydrophobicContact CE1-CB 4.07Å; F469-H478 HydrophobicContact CE2-CB 3.89Å; F469-H478 AromaticContact CE2-CD2 3.6Å; F469-H478 AromaticContact CE2-CG 3.79Å; F469-H478 HydrophobicContact CZ-CB 3.48Å; F469-H478 VanDerWaalsContact CZ-CB 3.48Å; F469-H478 AromaticContact CZ-CD2 3.61Å; F469-H478 AromaticContact CZ-CG 3.37Å; F469-H478 AromaticContact CZ-ND1 3.95Å
470	L	93	Very high	93	Very high	52 Å²	52	50.4 Å²	50.4	27%	0.272	25%	0.249	S	C	.	.	S	Bend	trans	-78.6	-18.2	178.3	-60.3	-169.1	0	0	0	112.2	H450 H454 E474	H450-L470 WeakPolarHBondContact ND1-CD1 3.46Å; H454-L470 HydrophobicContact CB-CD2 4.32Å; L470-E474 PolarHBondContact N-OE2 2.8Å
471	T	93.1	Very high	93	Very high	62 Å²	62	53.5 Å²	53.5	38%	0.38	26%	0.264	S	S	.	.	S	Bend	trans	-131.4	148.7	-179.8	64.7	0	0	0	0	111.7	F469 K473 E474 K475	F469-T471 VanDerWaalsContact C-N 3.28Å; T471-K473 PolarHBondContact O-N 3.17Å; T471-E474 PolarHBondContact N-OE2 3.43Å; T471-E474 PolarHBondContact O-N 3.02Å; T471-E474 WeakPolarHBondContact OG1-CB 3.34Å; T471-E474 WeakPolarHBondContact OG1-CG 3.26Å; T471-E474 PolarHBondContact OG1-N 3.49Å; T471-E474 VanDerWaalsContact OG1-N 3.17Å; T471-E474 PolarHBondContact OG1-OE2 2.84Å; T471-K475 PolarHBondContact O-N 3.37Å
472	F	93.1	Very high	93.2	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.522	26%	0.26	S	S	.	.	H	α-helix	trans	-59.5	-34.7	172.4	-178.9	-99.2	0	0	0	111.9	H460 K475 M476	H460-F472 PolarHBondContact CD2-N 3.17Å; H460-F472 PolarHBondContact NE2-N 3.2Å; F472-K475 WeakPolarHBondContact O-CB 3.46Å; F472-K475 PolarHBondContact O-N 3.43Å; F472-M476 HydrophobicContact CD1-CG 3.93Å; F472-M476 HydrophobicContact CD2-CE 4.41Å; F472-M476 HydrophobicContact CE1-CG 3.45Å; F472-M476 VanDerWaalsContact CE1-CG 3.45Å; F472-M476 HydrophobicContact CE1-SD 4.27Å; F472-M476 HydrophobicContact CE2-CE 3.79Å; F472-M476 HydrophobicContact CE2-CG 4.27Å; F472-M476 HydrophobicContact CE2-SD 4.36Å; F472-M476 HydrophobicContact CZ-CE 3.91Å; F472-M476 HydrophobicContact CZ-CG 3.64Å; F472-M476 HydrophobicContact CZ-SD 3.85Å; F472-M476 WeakPolarHBondContact O-CG 3.44Å; F472-M476 PolarHBondContact O-N 3.4Å
473	K	94.5	Very high	93.1	Very high	141 Å²	141	52.8 Å²	52.8	61%	0.613	26%	0.263	S	S	*	.	H	α-helix	trans	-59.9	-53.3	176.5	179.8	174.6	172.2	178.1	0	111.9	T471 K475 M476 E477	T471-K473 PolarHBondContact O-N 3.17Å; K473-K475 VanDerWaalsContact C-N 3.26Å; K473-K475 PolarHBondContact O-N 2.99Å; K473-M476 PolarHBondContact O-N 2.88Å; K473-E477 WeakPolarHBondContact CE-OE1 3.2Å; K473-E477 HydrophobicContact CG-CG 4.42Å; K473-E477 IonicContact NZ-OE1 3.87Å; K473-E477 WeakPolarHBondContact O-CG 3.35Å; K473-E477 PolarHBondContact O-N 3.3Å
474	E	95	Very high	93.1	Very high	36 Å²	36	54 Å²	54	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-38.7	176.4	-74.2	169.4	130.5	0	0	111.7	K439 F469 L470 T471 H478	K439-E474 IonicContact NZ-OE1 2.75Å; K439-E474 PolarHBondContact NZ-OE1 3.13Å; F469-E474 HydrophobicContact CB-CB 3.84Å; F469-E474 HydrophobicContact CD1-CB 3.76Å; F469-E474 HydrophobicContact CG-CB 4.03Å; L470-E474 PolarHBondContact N-OE2 2.8Å; T471-E474 PolarHBondContact N-OE2 3.43Å; T471-E474 PolarHBondContact O-N 3.02Å; T471-E474 WeakPolarHBondContact OG1-CB 3.34Å; T471-E474 WeakPolarHBondContact OG1-CG 3.26Å; T471-E474 PolarHBondContact OG1-N 3.49Å; T471-E474 VanDerWaalsContact OG1-N 3.17Å; T471-E474 PolarHBondContact OG1-OE2 2.84Å; E474-H478 WeakPolarHBondContact O-CB 3.1Å; E474-H478 PolarHBondContact O-N 3.16Å
475	K	95.1	Very high	92.9	Very high	44 Å²	44	55.5 Å²	55.5	19%	0.191	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-42.6	173.9	177.2	-172.3	161.4	165.1	0	112.2	H460 Q461 F469 T471 F472 K473 K479	H460-K475 HydrophobicContact CB-CB 4.04Å; H460-K475 HydrophobicContact CB-CD 3.82Å; H460-K475 HydrophobicContact CB-CG 4.49Å; Q461-K475 VanDerWaalsContact O-CD 3.31Å; Q461-K475 WeakPolarHBondContact O-CD 3.46Å; Q461-K475 WeakPolarHBondContact O-CE 3.22Å; Q461-K475 PolarHBondContact O-NZ 3.16Å; F469-K475 HydrophobicContact CB-CB 4.25Å; F469-K475 HydrophobicContact CD2-CB 3.84Å; F469-K475 HydrophobicContact CD2-CG 4.35Å; F469-K475 HydrophobicContact CG-CB 4.28Å; T471-K475 PolarHBondContact O-N 3.37Å; F472-K475 WeakPolarHBondContact O-CB 3.46Å; F472-K475 PolarHBondContact O-N 3.43Å; K473-K475 VanDerWaalsContact C-N 3.26Å; K473-K475 PolarHBondContact O-N 2.99Å; K475-K479 WeakPolarHBondContact O-CB 3.3Å; K475-K479 PolarHBondContact O-N 3.25Å
476	M	95.5	Very high	92.5	Very high	53 Å²	53	59.2 Å²	59.2	26%	0.261	28%	0.283	S	S	.	.	H	α-helix	trans	-72.2	-40.1	179.7	-72.5	-54	104.8	0	0	112.4	F472 K473 H478 K479 T480	F472-M476 HydrophobicContact CD1-CG 3.93Å; F472-M476 HydrophobicContact CD2-CE 4.41Å; F472-M476 HydrophobicContact CE1-CG 3.45Å; F472-M476 VanDerWaalsContact CE1-CG 3.45Å; F472-M476 HydrophobicContact CE1-SD 4.27Å; F472-M476 HydrophobicContact CE2-CE 3.79Å; F472-M476 HydrophobicContact CE2-CG 4.27Å; F472-M476 HydrophobicContact CE2-SD 4.36Å; F472-M476 HydrophobicContact CZ-CE 3.91Å; F472-M476 HydrophobicContact CZ-CG 3.64Å; F472-M476 HydrophobicContact CZ-SD 3.85Å; F472-M476 WeakPolarHBondContact O-CG 3.44Å; F472-M476 PolarHBondContact O-N 3.4Å; K473-M476 PolarHBondContact O-N 2.88Å; M476-H478 VanDerWaalsContact C-N 3.32Å; M476-H478 PolarHBondContact O-N 3.13Å; M476-K479 HydrophobicContact CE-CD 4.23Å; M476-K479 PolarHBondContact O-N 3.44Å; M476-K479 HydrophobicContact SD-CD 4.2Å; M476-T480 WeakPolarHBondContact O-CB 3.07Å; M476-T480 WeakPolarHBondContact O-CG2 3.38Å; M476-T480 PolarHBondContact O-N 3.27Å; M476-T480 PolarHBondContact O-OG1 3.19Å
477	E	95	Very high	92	Very high	78 Å²	78	64.6 Å²	64.6	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-43.3	172.5	-71.8	173.2	169.3	0	0	110.7	K473 T480 Q481	K473-E477 WeakPolarHBondContact CE-OE1 3.2Å; K473-E477 HydrophobicContact CG-CG 4.42Å; K473-E477 IonicContact NZ-OE1 3.87Å; K473-E477 WeakPolarHBondContact O-CG 3.35Å; K473-E477 PolarHBondContact O-N 3.3Å; E477-T480 PolarHBondContact O-OG1 2.67Å; E477-T480 VanDerWaalsContact O-OG1 3.07Å; E477-Q481 VanDerWaalsContact O-CB 3.24Å; E477-Q481 WeakPolarHBondContact O-CB 3.33Å; E477-Q481 WeakPolarHBondContact O-CG 3.44Å; E477-Q481 PolarHBondContact O-N 2.91Å
478	H	94.8	Very high	91.2	Very high	14 Å²	14	69 Å²	69	7%	0.065	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-48	171.7	174.3	70.4	0	0	0	113.2	P402 C465 F469 E474 M476 T480 Q481 C482 H483	P402-H478 PolarHBondContact O-CE1 3.02Å; C465-H478 PolarHBondContact SG-NE2 3.38Å; F469-H478 HydrophobicContact CE1-CB 4.07Å; F469-H478 HydrophobicContact CE2-CB 3.89Å; F469-H478 AromaticContact CE2-CD2 3.6Å; F469-H478 AromaticContact CE2-CG 3.79Å; F469-H478 HydrophobicContact CZ-CB 3.48Å; F469-H478 VanDerWaalsContact CZ-CB 3.48Å; F469-H478 AromaticContact CZ-CD2 3.61Å; F469-H478 AromaticContact CZ-CG 3.37Å; F469-H478 AromaticContact CZ-ND1 3.95Å; E474-H478 WeakPolarHBondContact O-CB 3.1Å; E474-H478 PolarHBondContact O-N 3.16Å; M476-H478 VanDerWaalsContact C-N 3.32Å; M476-H478 PolarHBondContact O-N 3.13Å; H478-T480 PolarHBondContact O-N 3.28Å; H478-Q481 PolarHBondContact O-N 3.42Å; H478-C482 WeakPolarHBondContact CE1-CB 3.48Å; H478-C482 VanDerWaalsContact ND1-CB 3.31Å; H478-C482 WeakPolarHBondContact ND1-CB 3.37Å; H478-C482 PolarHBondContact ND1-SG 3.39Å; H478-C482 VanDerWaalsContact ND1-SG 3.36Å; H478-C482 VanDerWaalsContact O-CB 3.26Å; H478-C482 WeakPolarHBondContact O-CB 3.5Å; H478-C482 PolarHBondContact O-N 2.97Å; H478-H483 AromaticContact NE2-CD2 3.75Å; H478-H483 AromaticContact NE2-NE2 3.4Å; H478-H483 PolarHBondContact NE2-NE2 2.95Å
479	K	92.9	Very high	90.3	Very high	101 Å²	101	69.2 Å²	69.2	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-53.9	-41.3	178.1	-176.2	-171.7	175.1	-169.6	0	111	K475 M476	K475-K479 WeakPolarHBondContact O-CB 3.3Å; K475-K479 PolarHBondContact O-N 3.25Å; M476-K479 HydrophobicContact CE-CD 4.23Å; M476-K479 PolarHBondContact O-N 3.44Å; M476-K479 HydrophobicContact SD-CD 4.2Å
480	T	92.3	Very high	89.2	Confident	81 Å²	81	76.2 Å²	76.2	50%	0.497	36%	0.359	S	S	.	.	H	α-helix	trans	-80.6	-40	-178	50.7	0	0	0	0	113.5	M476 E477 H478 Q484	M476-T480 WeakPolarHBondContact O-CB 3.07Å; M476-T480 WeakPolarHBondContact O-CG2 3.38Å; M476-T480 PolarHBondContact O-N 3.27Å; M476-T480 PolarHBondContact O-OG1 3.19Å; E477-T480 PolarHBondContact O-OG1 2.67Å; E477-T480 VanDerWaalsContact O-OG1 3.07Å; H478-T480 PolarHBondContact O-N 3.28Å; T480-Q484 WeakPolarHBondContact O-CG 3.18Å; T480-Q484 PolarHBondContact O-NE2 2.8Å
481	Q	91.4	Very high	87.9	Confident	128 Å²	128	78.3 Å²	78.3	60%	0.598	37%	0.367	S	S	*	.	H	α-helix	trans	-92.4	-19.8	-172.5	-61.6	171.9	26.4	0	0	114.8	E477 H478	E477-Q481 VanDerWaalsContact O-CB 3.24Å; E477-Q481 WeakPolarHBondContact O-CB 3.33Å; E477-Q481 WeakPolarHBondContact O-CG 3.44Å; E477-Q481 PolarHBondContact O-N 2.91Å; H478-Q481 PolarHBondContact O-N 3.42Å
482	C	92.7	Very high	86.6	Confident	20 Å²	20	75.6 Å²	75.6	14%	0.135	35%	0.35	C	S	.	.	H	α-helix	trans	-112.7	-26.7	-171.3	-67.8	0	0	0	0	114.3	P402 H478 Q484	P402-C482 WeakPolarHBondContact CA-O 3.29Å; P402-C482 HydrophobicContact CB-CB 4.05Å; H478-C482 WeakPolarHBondContact CE1-CB 3.48Å; H478-C482 VanDerWaalsContact ND1-CB 3.31Å; H478-C482 WeakPolarHBondContact ND1-CB 3.37Å; H478-C482 PolarHBondContact ND1-SG 3.39Å; H478-C482 VanDerWaalsContact ND1-SG 3.36Å; H478-C482 VanDerWaalsContact O-CB 3.26Å; H478-C482 WeakPolarHBondContact O-CB 3.5Å; H478-C482 PolarHBondContact O-N 2.97Å; C482-Q484 VanDerWaalsContact C-N 3.32Å; C482-Q484 PolarHBondContact O-N 3.17Å
483	H	92.3	Very high	85.2	Confident	12 Å²	12	76.4 Å²	76.4	6%	0.056	36%	0.356	C	S	.	.	S	Bend	trans	-96.2	53.7	176.3	-72.2	-77.1	0	0	0	112.2	E400 K464 H478	E400-H483 IonicContact OE1-CE1 3.69Å; E400-H483 PolarHBondContact OE1-CE1 3.34Å; E400-H483 IonicContact OE1-CG 2.69Å; E400-H483 IonicContact OE1-ND1 3.15Å; E400-H483 PolarHBondContact OE1-ND1 2.71Å; E400-H483 IonicContact OE2-ND1 3.95Å; K464-H483 WeakPolarHBondContact CB-CE1 3.44Å; K464-H483 WeakPolarHBondContact CB-ND1 3.26Å; K464-H483 HydrophobicContact CD-CB 3.82Å; K464-H483 PolarHBondContact O-CE1 3.36Å; K464-H483 VanDerWaalsContact O-CE1 3.27Å; H478-H483 AromaticContact NE2-CD2 3.75Å; H478-H483 AromaticContact NE2-NE2 3.4Å; H478-H483 PolarHBondContact NE2-NE2 2.95Å
484	Q	89.6	Confident	83.5	Confident	112 Å²	112	73.5 Å²	73.5	52%	0.523	37%	0.365	S	S	.	.	S	Bend	trans	-122.3	161.1	170.3	-58.2	-169.2	10.1	0	0	109.4	E400 T480 C482 F486	E400-Q484 WeakPolarHBondContact CA-O 3.09Å; E400-Q484 WeakPolarHBondContact CB-O 3.43Å; T480-Q484 WeakPolarHBondContact O-CG 3.18Å; T480-Q484 PolarHBondContact O-NE2 2.8Å; C482-Q484 VanDerWaalsContact C-N 3.32Å; C482-Q484 PolarHBondContact O-N 3.17Å; Q484-F486 PolarHBondContact O-N 3.24Å
485	M	86.4	Confident	81.8	Confident	72 Å²	72	74.3 Å²	74.3	36%	0.355	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-62.4	106.3	169.2	176.2	176.3	-55	0	0	108.9	P398 K488	P398-M485 HydrophobicContact CB-CE 3.99Å; P398-M485 HydrophobicContact CG-CE 4.09Å; P398-M485 WeakPolarHBondContact O-CB 3.29Å; P398-M485 VanDerWaalsContact O-CG 3.27Å; P398-M485 WeakPolarHBondContact O-CG 3.48Å; M485-K488 HydrophobicContact SD-CB 4.16Å; M485-K488 HydrophobicContact SD-CG 4.1Å
486	F	84.9	Confident	79.9	Confident	77 Å²	77	76.1 Å²	76.1	34%	0.338	39%	0.387	S	S	.	.	S	Bend	trans	-81.3	-33.8	-179.4	180	-95.2	0	0	0	111.4	H293 G399 M401 Q484	H293-F486 HydrophobicContact CB-CD1 4.48Å; H293-F486 HydrophobicContact CB-CE1 3.85Å; H293-F486 AromaticContact CD2-CE1 3.67Å; H293-F486 AromaticContact CG-CE1 3.57Å; H293-F486 AromaticContact ND1-CE1 3.99Å; G399-F486 PolarHBondContact O-N 3.18Å; M401-F486 HydrophobicContact CB-CB 4.08Å; M401-F486 HydrophobicContact CB-CG 4.48Å; M401-F486 HydrophobicContact CE-CD1 4.35Å; M401-F486 HydrophobicContact CG-CB 4.24Å; M401-F486 HydrophobicContact SD-CB 4.14Å; M401-F486 HydrophobicContact SD-CD1 3.63Å; M401-F486 HydrophobicContact SD-CG 4.27Å; Q484-F486 PolarHBondContact O-N 3.24Å
487	K	80.9	Confident	77.9	Confident	132 Å²	132	78.4 Å²	78.4	57%	0.574	41%	0.406	S	S	*	.	S	Bend	trans	-143.2	132.2	173.2	-178.4	168.4	-177.7	169	0	109.7	P489	K487-P489 WeakPolarHBondContact O-CD 3.36Å
488	K	75.9	Confident	76.1	Confident	96 Å²	96	81.3 Å²	81.3	42%	0.417	42%	0.419	S	S	.	.			trans	-60.4	127.7	172.5	-157.9	-174.8	-160.5	-166.2	0	109.3	M485 K490 L492	M485-K488 HydrophobicContact SD-CB 4.16Å; M485-K488 HydrophobicContact SD-CG 4.1Å; K488-K490 PolarHBondContact O-N 2.99Å; K488-L492 HydrophobicContact CD-CB 4.31Å; K488-L492 WeakPolarHBondContact CE-O 3.2Å; K488-L492 HydrophobicContact CG-CB 4.14Å; K488-L492 PolarHBondContact NZ-O 2.88Å
489	P	73.9	Confident	74.6	Confident	10 Å²	10	81.4 Å²	81.4	7%	0.065	42%	0.421	C	S	.	.			trans	-55.8	138.1	171.2	-26.8	35.4	0	0	0	110.8	F288 P398 K487 Q491 L492	F288-P489 VanDerWaalsContact O-CG 3.23Å; F288-P489 WeakPolarHBondContact O-CG 3.42Å; P398-P489 HydrophobicContact CB-CG 3.87Å; K487-P489 WeakPolarHBondContact O-CD 3.36Å; P489-Q491 PolarHBondContact O-N 3.39Å; P489-Q491 VanDerWaalsContact O-N 3.11Å; P489-L492 HydrophobicContact CG-CD1 4.42Å; P489-L492 PolarHBondContact O-N 3.29Å
490	K	71	Confident	73.2	Confident	161 Å²	161	81.9 Å²	81.9	70%	0.7	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-54.1	-34.3	178.9	-68.1	-175.4	178.7	-177.7	0	112.3	K488 L492 E493	K488-K490 PolarHBondContact O-N 2.99Å; K490-L492 PolarHBondContact O-N 3.43Å; K490-E493 VanDerWaalsContact O-CB 3.22Å; K490-E493 WeakPolarHBondContact O-CB 3.38Å; K490-E493 PolarHBondContact O-N 2.9Å
491	Q	65.7	Low	72	Confident	96 Å²	96	78 Å²	78	45%	0.449	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-71.8	-3.6	179.7	-48.7	-64.5	8.9	0	0	113.7	V283 P489 L495	V283-Q491 HydrophobicContact CG1-CB 3.99Å; V283-Q491 HydrophobicContact CG1-CG 3.78Å; V283-Q491 HydrophobicContact CG2-CB 3.64Å; V283-Q491 HydrophobicContact CG2-CG 3.95Å; P489-Q491 PolarHBondContact O-N 3.39Å; P489-Q491 VanDerWaalsContact O-N 3.11Å; Q491-L495 WeakPolarHBondContact O-CD1 3.23Å
492	L	65.6	Low	71.3	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.026	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-110.8	2.6	168.6	-63.7	-177.8	0	0	0	112.3	F288 K488 P489 K490 L495 V501 T524	F288-L492 HydrophobicContact CE2-CD1 3.78Å; F288-L492 HydrophobicContact CE2-CD2 3.82Å; F288-L492 HydrophobicContact CE2-CG 3.82Å; F288-L492 HydrophobicContact CZ-CD1 3.92Å; F288-L492 HydrophobicContact CZ-CD2 4.4Å; F288-L492 HydrophobicContact CZ-CG 4.43Å; K488-L492 HydrophobicContact CD-CB 4.31Å; K488-L492 WeakPolarHBondContact CE-O 3.2Å; K488-L492 HydrophobicContact CG-CB 4.14Å; K488-L492 PolarHBondContact NZ-O 2.88Å; P489-L492 HydrophobicContact CG-CD1 4.42Å; P489-L492 PolarHBondContact O-N 3.29Å; K490-L492 PolarHBondContact O-N 3.43Å; L492-L495 HydrophobicContact CD2-CD1 4.27Å; L492-V501 HydrophobicContact CD2-CG2 3.8Å; L492-T524 HydrophobicContact CD1-CG2 4.3Å; L492-T524 HydrophobicContact CD2-CG2 3.83Å
493	E	64.7	Low	70.7	Confident	136 Å²	136	71.8 Å²	71.8	64%	0.636	37%	0.369	S	S	*	.	S	Bend	trans	-84.2	129.3	178	-158.8	163	-162.9	0	0	108.8	K490 L495	K490-E493 VanDerWaalsContact O-CB 3.22Å; K490-E493 WeakPolarHBondContact O-CB 3.38Å; K490-E493 PolarHBondContact O-N 2.9Å; E493-L495 PolarHBondContact O-N 2.79Å
494	G	57.7	Low	70.1	Confident	79 Å²	79	73.7 Å²	73.7	81%	0.814	38%	0.378	S	S	*	.	S	Bend	trans	76.6	-13.5	-174.8	0	0	0	0	0	116.9
495	L	60.6	Low	69.4	Low	53 Å²	53	70 Å²	70	28%	0.277	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-70	136.2	172.9	-64.5	-171.6	0	0	0	111.5	P281 Q491 L492 E493 T499 V501	P281-L495 HydrophobicContact CG-CD1 4.29Å; Q491-L495 WeakPolarHBondContact O-CD1 3.23Å; L492-L495 HydrophobicContact CD2-CD1 4.27Å; E493-L495 PolarHBondContact O-N 2.79Å; L495-T499 HydrophobicContact CB-CG2 4.4Å; L495-T499 HydrophobicContact CD1-CG2 3.87Å; L495-T499 HydrophobicContact CD2-CG2 4.28Å; L495-T499 HydrophobicContact CG-CG2 4.42Å; L495-V501 HydrophobicContact CD1-CG2 4.22Å
496	P	53.8	Low	68.6	Low	82 Å²	82	68.7 Å²	68.7	53%	0.532	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-67	159.9	174.4	25.6	-30.7	0	0	0	111.8	T499 T524	P496-T499 VanDerWaalsContact CD-OG1 3.28Å; P496-T499 WeakPolarHBondContact CD-OG1 3.16Å; P496-T499 WeakPolarHBondContact CG-OG1 2.83Å; P496-T499 WeakPolarHBondContact O-CB 3.49Å; P496-T499 PolarHBondContact O-N 3.44Å; P496-T499 PolarHBondContact O-OG1 2.9Å; P496-T524 PolarHBondContact O-OG1 3.37Å
497	P	53.4	Low	67.5	Low	102 Å²	102	71.9 Å²	71.9	66%	0.662	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	148.7	169.9	-27.3	36.1	0	0	0	112.2	T499 T524	P497-T499 PolarHBondContact O-N 2.86Å; P497-T499 VanDerWaalsContact O-N 3.16Å; P497-T524 WeakPolarHBondContact CA-OG1 3.17Å
498	E	57	Low	66	Low	138 Å²	138	73.1 Å²	73.1	65%	0.645	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	12.7	-179.2	-47	-174	158.2	0	0	115.9	K500 T524	E498-K500 PolarHBondContact O-N 3.46Å; E498-T524 PolarHBondContact N-OG1 2.91Å
499	T	64.8	Low	64.3	Low	17 Å²	17	74 Å²	74	10%	0.104	40%	0.404	C	S	.	.			trans	-67.1	109	172.7	-57.3	0	0	0	0	110.5	P281 L495 P496 P497 V501	P281-T499 HydrophobicContact CG-CG2 4.4Å; L495-T499 HydrophobicContact CB-CG2 4.4Å; L495-T499 HydrophobicContact CD1-CG2 3.87Å; L495-T499 HydrophobicContact CD2-CG2 4.28Å; L495-T499 HydrophobicContact CG-CG2 4.42Å; P496-T499 VanDerWaalsContact CD-OG1 3.28Å; P496-T499 WeakPolarHBondContact CD-OG1 3.16Å; P496-T499 WeakPolarHBondContact CG-OG1 2.83Å; P496-T499 WeakPolarHBondContact O-CB 3.49Å; P496-T499 PolarHBondContact O-N 3.44Å; P496-T499 PolarHBondContact O-OG1 2.9Å; P497-T499 PolarHBondContact O-N 2.86Å; P497-T499 VanDerWaalsContact O-N 3.16Å; T499-V501 PolarHBondContact O-N 2.71Å
500	K	61.8	Low	62.4	Low	111 Å²	111	80.1 Å²	80.1	48%	0.483	44%	0.436	S	S	.	.			trans	-65.4	118.8	174.5	-52.6	-166.7	171.4	-168.9	0	109.8	N280 P281 E498 T521	N280-K500 VanDerWaalsContact CB-O 3.22Å; N280-K500 WeakPolarHBondContact CB-O 3.45Å; N280-K500 WeakPolarHBondContact OD1-CB 3.48Å; P281-K500 WeakPolarHBondContact CD-O 3.41Å; E498-K500 PolarHBondContact O-N 3.46Å; K500-T521 HydrophobicContact CB-CG2 3.86Å; K500-T521 HydrophobicContact CD-CG2 3.8Å; K500-T521 HydrophobicContact CG-CG2 3.56Å
501	V	69	Low	60.5	Low	0 Å²	0	79.4 Å²	79.4	0%	0	44%	0.435	C	S	.	.			trans	-94.8	154.4	169.4	-175.3	0	0	0	0	109.1	P281 V283 F288 L492 L495 T499 I503 I520	P281-V501 HydrophobicContact CG-CG2 4.41Å; P281-V501 WeakPolarHBondContact O-CG1 3.22Å; V283-V501 HydrophobicContact CB-CG1 3.91Å; V283-V501 HydrophobicContact CG2-CG1 3.59Å; F288-V501 HydrophobicContact CE2-CG1 4.38Å; L492-V501 HydrophobicContact CD2-CG2 3.8Å; L495-V501 HydrophobicContact CD1-CG2 4.22Å; T499-V501 PolarHBondContact O-N 2.71Å; V501-I503 HydrophobicContact CG1-CG1 4.48Å; V501-I520 CarbonylContact O-C 3.44Å
502	T	75.5	Confident	59.1	Low	15 Å²	15	80.9 Å²	80.9	9%	0.092	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.7	166.9	-69.6	0	0	0	0	108.5	P281 I282 V283 V517	P281-T502 PolarHBondContact O-N 3.03Å; I282-T502 CarbonylContact C-O 3.56Å; I282-T502 WeakPolarHBondContact CA-O 3.37Å; I282-T502 HydrophobicContact CG1-CG2 4.16Å; I282-T502 HydrophobicContact CG2-CG2 4.41Å; V283-T502 PolarHBondContact N-O 2.72Å; T502-V517 HydrophobicContact CG2-CG1 4.45Å
503	I	79.9	Confident	57.7	Low	1 Å²	1	84.1 Å²	84.1	1%	0.005	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.7	179.8	-56.8	176.9	0	0	0	109.8	V283 L285 F288 Y289 L389 V501 V522	V283-I503 CarbonylContact O-C 3.46Å; V283-I503 VanDerWaalsContact O-CA 3.3Å; V283-I503 WeakPolarHBondContact O-CA 3.33Å; L285-I503 HydrophobicContact CB-CG2 3.89Å; F288-I503 HydrophobicContact CD1-CD1 3.6Å; F288-I503 HydrophobicContact CD2-CD1 4.43Å; F288-I503 HydrophobicContact CE1-CD1 3.6Å; F288-I503 HydrophobicContact CE2-CD1 4.44Å; F288-I503 HydrophobicContact CG-CD1 4.02Å; F288-I503 HydrophobicContact CZ-CD1 4.05Å; Y289-I503 HydrophobicContact CE2-CD1 4.05Å; L389-I503 HydrophobicContact CD2-CB 3.98Å; L389-I503 HydrophobicContact CD2-CG2 4.04Å; L389-I503 HydrophobicContact CG-CG2 4.39Å; V501-I503 HydrophobicContact CG1-CG1 4.48Å; I503-V522 HydrophobicContact CD1-CG2 4.03Å
504	Q	79.9	Confident	56.1	Low	52 Å²	52	81.9 Å²	81.9	24%	0.243	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.2	-179.5	-179.3	169.7	-11.6	0	0	110.9	I282 V283 L284 L285 S506	I282-Q504 HydrophobicContact CG2-CB 4.34Å; V283-Q504 PolarHBondContact O-N 3.25Å; L284-Q504 CarbonylContact C-O 3.47Å; L284-Q504 WeakPolarHBondContact CA-O 3.3Å; L285-Q504 PolarHBondContact N-O 3.02Å; Q504-S506 WeakPolarHBondContact CG-O 3.04Å; Q504-S506 PolarHBondContact NE2-O 3.01Å
505	V	75.1	Confident	55.4	Low	35 Å²	35	84.4 Å²	84.4	21%	0.212	49%	0.486	C	S	.	.	S	Bend	trans	-81.6	-44.1	-177.3	-175.8	0	0	0	0	112.6	L285 D385 L388 L389	L285-V505 HydrophobicContact CD1-CG2 4.19Å; D385-V505 HydrophobicContact CB-CB 4.25Å; D385-V505 HydrophobicContact CB-CG2 3.66Å; D385-V505 VanDerWaalsContact OD2-CB 3.25Å; D385-V505 WeakPolarHBondContact OD2-CB 3.26Å; D385-V505 WeakPolarHBondContact OD2-CG1 3.42Å; L388-V505 HydrophobicContact CD2-CG1 4.48Å; L389-V505 HydrophobicContact CD1-CG2 3.17Å
506	S	70.1	Confident	54.4	Low	45 Å²	45	87.9 Å²	87.9	32%	0.315	50%	0.501	S	S	.	.			trans	-133.7	148.8	-166.2	53.4	0	0	0	0	112.2	Q504 E508	Q504-S506 WeakPolarHBondContact CG-O 3.04Å; Q504-S506 PolarHBondContact NE2-O 3.01Å; S506-E508 PolarHBondContact O-N 3.12Å
507	L	60.4	Low	53.8	Low	143 Å²	143	88.1 Å²	88.1	75%	0.749	50%	0.501	S	S	*	.			trans	-92	48.9	179.3	-73.6	175.2	0	0	0	112.6	L284	L284-L507 HydrophobicContact CD1-CD1 3.98Å; L284-L507 HydrophobicContact CD1-CD2 4.17Å; L284-L507 HydrophobicContact CD1-CG 3.97Å; L284-L507 HydrophobicContact CD2-CD2 3.86Å; L284-L507 HydrophobicContact CD2-CG 3.93Å; L284-L507 HydrophobicContact CG-CD2 4.4Å
508	E	50.1	Low	53.6	Low	158 Å²	158	84.2 Å²	84.2	74%	0.738	48%	0.477	S	S	*	.			trans	-79	140.3	174	-71.8	-155.7	108.8	0	0	112.4	S506 L510	S506-E508 PolarHBondContact O-N 3.12Å; E508-L510 PolarHBondContact O-N 3.13Å
509	P	39.5	Very low	53.1	Low	114 Å²	114	81.3 Å²	81.3	74%	0.74	47%	0.472	S	S	*	.			trans	-64.9	128.7	175.4	-20.7	33	0	0	0	111.8	Q511	P509-Q511 PolarHBondContact O-N 3.48Å
510	L	35	Very low	52.5	Low	140 Å²	140	81.7 Å²	81.7	73%	0.733	47%	0.473	S	S	*	.			trans	-65	94.5	179.7	-174.2	74.7	0	0	0	111.7	E508	E508-L510 PolarHBondContact O-N 3.13Å
511	Q	31.8	Very low	51.9	Low	145 Å²	145	79.3 Å²	79.3	68%	0.678	47%	0.468	S	S	*	.			trans	-66.6	127.9	163	-71.1	-67.7	-6.4	0	0	108.9	P509 G513 S514	P509-Q511 PolarHBondContact O-N 3.48Å; Q511-G513 PolarHBondContact O-N 3.06Å; Q511-S514 PolarHBondContact O-N 3.06Å
512	P	34.7	Very low	50.9	Low	127 Å²	127	80.7 Å²	80.7	83%	0.825	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	87.6	-172.7	29.1	-35.2	0	0	0	111.2
513	G	36.8	Very low	49.4	Very low	73 Å²	73	83.4 Å²	83.4	75%	0.753	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	159.6	-23	-178.6	0	0	0	0	0	114.1	Q511 V515	Q511-G513 PolarHBondContact O-N 3.06Å; G513-V515 PolarHBondContact O-N 3.43Å
514	S	31.5	Very low	47.7	Very low	89 Å²	89	85.1 Å²	85.1	62%	0.622	51%	0.506	S	S	*	.			trans	-81.6	110.7	174.8	-167.2	0	0	0	0	110.9	Q511	Q511-S514 PolarHBondContact O-N 3.06Å
515	V	42.7	Very low	45.8	Very low	132 Å²	132	86.3 Å²	86.3	80%	0.8	52%	0.521	S	S	*	.			trans	-102.3	113	170.7	175.8	0	0	0	0	108.1	G513	G513-V515 PolarHBondContact O-N 3.43Å
516	E	39.8	Very low	44	Very low	127 Å²	127	91.6 Å²	91.6	59%	0.593	55%	0.548	S	S	*	.			trans	-167.8	54	143.5	-80	-138.7	141.9	0	0	110.7	Q386 A518	Q386-E516 PolarHBondContact NE2-OE1 3.25Å; Q386-E516 PolarHBondContact NE2-OE2 3.38Å; E516-A518 PolarHBondContact O-N 2.94Å; E516-A518 VanDerWaalsContact O-N 3.08Å
517	V	41.9	Very low	42.3	Very low	86 Å²	86	94.3 Å²	94.3	52%	0.521	57%	0.567	S	S	.	*			trans	-72.7	103.6	171.5	-179.1	0	0	0	0	109.4	T502 S519	T502-V517 HydrophobicContact CG2-CG1 4.45Å; V517-S519 VanDerWaalsContact C-N 3.27Å; V517-S519 PolarHBondContact O-N 2.98Å
518	A	49.1	Very low	40.9	Very low	21 Å²	21	96.4 Å²	96.4	17%	0.174	57%	0.573	C	S	.	*			trans	-73	62.5	-173.3	0	0	0	0	0	114.2	Q386 L389 E516 I520	Q386-A518 HydrophobicContact CG-CB 3.84Å; L389-A518 HydrophobicContact CD2-CB 3.9Å; L389-A518 WeakPolarHBondContact CD2-O 3.38Å; E516-A518 PolarHBondContact O-N 2.94Å; E516-A518 VanDerWaalsContact O-N 3.08Å; A518-I520 PolarHBondContact O-N 3.04Å
519	S	45.5	Very low	40.1	Very low	76 Å²	76	93.7 Å²	93.7	53%	0.531	57%	0.569	S	S	.	*			trans	-72.3	99.3	-172.4	65	0	0	0	0	114.4	V517	V517-S519 VanDerWaalsContact C-N 3.27Å; V517-S519 PolarHBondContact O-N 2.98Å
520	I	52.2	Low	39.5	Very low	25 Å²	25	94 Å²	94	13%	0.128	57%	0.574	C	S	.	*			trans	-92.4	112.2	170.5	-65.2	-177.2	0	0	0	111.4	L389 K393 V501 A518 V522	L389-I520 HydrophobicContact CB-CD1 3.74Å; L389-I520 HydrophobicContact CD2-CB 4.45Å; L389-I520 HydrophobicContact CD2-CD1 3.93Å; L389-I520 HydrophobicContact CD2-CG1 3.99Å; L389-I520 HydrophobicContact CG-CD1 4.24Å; K393-I520 HydrophobicContact CB-CD1 4.3Å; K393-I520 HydrophobicContact CD-CD1 4.28Å; K393-I520 HydrophobicContact CD-CG2 4.05Å; K393-I520 HydrophobicContact CG-CG2 4.34Å; V501-I520 CarbonylContact O-C 3.44Å; A518-I520 PolarHBondContact O-N 3.04Å; I520-V522 HydrophobicContact CG2-CG2 4.28Å; I520-V522 PolarHBondContact O-N 3.31Å
521	T	48.7	Very low	39.4	Very low	61 Å²	61	95 Å²	95	37%	0.374	58%	0.579	S	S	.	*			trans	-64.8	122.8	165.8	-70.4	0	0	0	0	110.8	K500	K500-T521 HydrophobicContact CB-CG2 3.86Å; K500-T521 HydrophobicContact CD-CG2 3.8Å; K500-T521 HydrophobicContact CG-CG2 3.56Å
522	V	49.1	Very low	39.3	Very low	29 Å²	29	93.9 Å²	93.9	18%	0.176	59%	0.585	C	S	.	*			trans	-109.7	115.7	170	-177.7	0	0	0	0	109.7	F288 I503 I520	F288-V522 HydrophobicContact CE1-CG2 4.03Å; F288-V522 HydrophobicContact CZ-CB 4.07Å; F288-V522 HydrophobicContact CZ-CG1 4.09Å; F288-V522 HydrophobicContact CZ-CG2 3.82Å; I503-V522 HydrophobicContact CD1-CG2 4.03Å; I520-V522 HydrophobicContact CG2-CG2 4.28Å; I520-V522 PolarHBondContact O-N 3.31Å
523	S	43.1	Very low	39	Very low	73 Å²	73	99.4 Å²	99.4	51%	0.51	59%	0.589	S	S	.	*			trans	-79	124.4	169.7	-61.4	0	0	0	0	110.1	S525	S523-S525 PolarHBondContact O-N 2.97Å
524	T	44.3	Very low	38.7	Very low	36 Å²	36	101 Å²	101	22%	0.221	59%	0.589	C	S	.	*			trans	-79.8	59	179.6	40	0	0	0	0	112.9	L492 P496 P497 E498	L492-T524 HydrophobicContact CD1-CG2 4.3Å; L492-T524 HydrophobicContact CD2-CG2 3.83Å; P496-T524 PolarHBondContact O-OG1 3.37Å; P497-T524 WeakPolarHBondContact CA-OG1 3.17Å; E498-T524 PolarHBondContact N-OG1 2.91Å
525	S	40.8	Very low	38.6	Very low	78 Å²	78	106.9 Å²	106.9	55%	0.545	60%	0.603	S	S	.	*			trans	-115.8	89.6	176.7	-51.4	0	0	0	0	109.8	S523	S523-S525 PolarHBondContact O-N 2.97Å
526	D	37.6	Very low	37.9	Very low	146 Å²	146	105.5 Å²	105.5	78%	0.781	60%	0.599	S	S	*	*				-179.9	159.9	113.9	-128.9	-63.1	0	0	0	114.5
527	S	34.5	Very low	37.6	Very low	101 Å²	101	109.5 Å²	109.5	71%	0.706	61%	0.614	S	S	*	*			trans	37.2	125.4	149.5	-67.6	0	0	0	0	121.8
528	E	30.2	Very low	37.1	Very low	187 Å²	187	112.6 Å²	112.6	87%	0.874	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-65.8	143.1	168.5	-69	-166	118.6	0	0	113.4	S530	E528-S530 PolarHBondContact O-N 3.37Å
529	P	33.1	Very low	36.3	Very low	101 Å²	101	116.9 Å²	116.9	66%	0.656	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-74.5	118.8	170.4	30.5	-32.8	0	0	0	111.1	L531	P529-L531 PolarHBondContact O-N 3.02Å
530	S	27.9	Very low	35.7	Very low	122 Å²	122	122.6 Å²	122.6	85%	0.853	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-73.7	117.3	175.9	44.6	0	0	0	0	111.6	E528	E528-S530 PolarHBondContact O-N 3.37Å
531	L	31.5	Very low	34.7	Very low	159 Å²	159	130.8 Å²	130.8	83%	0.832	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.2	178.8	-82.7	141.3	0	0	0	112.1	P529 R533	P529-L531 PolarHBondContact O-N 3.02Å; L531-R533 PolarHBondContact O-N 3.37Å
532	P	30.2	Very low	34	Very low	123 Å²	123	133.2 Å²	133.2	80%	0.799	73%	0.725	S	S	*	*			trans	-65.3	109	176.2	26.4	-33.5	0	0	0	110.5	S534	P532-S534 PolarHBondContact O-N 3.26Å; P532-S534 VanDerWaalsContact O-N 3.11Å
533	R	28.5	Very low	33.4	Very low	243 Å²	243	144.3 Å²	144.3	92%	0.917	77%	0.774	S	S	*	*			trans	-65.5	107.9	-171.3	-158.8	176.5	-169.2	177.8	4.2	111.6	L531 K535	L531-R533 PolarHBondContact O-N 3.37Å; R533-K535 PolarHBondContact O-N 2.97Å
534	S	30.1	Very low	32.9	Very low	107 Å²	107	147.9 Å²	147.9	75%	0.748	79%	0.787	S	S	*	*			trans	-61.9	123.3	178.1	52.1	0	0	0	0	111.3	P532 S536	P532-S534 PolarHBondContact O-N 3.26Å; P532-S534 VanDerWaalsContact O-N 3.11Å; S534-S536 PolarHBondContact O-N 3.49Å
535	K	29.7	Very low	32.3	Very low	211 Å²	211	153.7 Å²	153.7	92%	0.917	82%	0.817	S	S	*	*			trans	-76.8	87.9	-179.3	-69.3	-176.2	-179.8	178.3	0	111	R533	R533-K535 PolarHBondContact O-N 2.97Å
536	S	28.9	Very low	31.9	Very low	103 Å²	103	157.9 Å²	157.9	72%	0.72	83%	0.832	S	S	*	*			trans	-66.4	128.4	168	43.8	0	0	0	0	110.9	S534 I538	S534-S536 PolarHBondContact O-N 3.49Å; S536-I538 PolarHBondContact O-N 3.27Å
537	K	33.9	Very low	31.5	Very low	211 Å²	211	158.6 Å²	158.6	92%	0.917	84%	0.835	S	S	*	*			trans	-72.1	111.8	175.7	-76.9	-178.3	175	179.1	0	110	S539	K537-S539 PolarHBondContact O-N 3.35Å
538	I	30.1	Very low	31.4	Very low	151 Å²	151	162.3 Å²	162.3	77%	0.774	84%	0.843	S	S	*	*			trans	-78.9	112.5	164.4	-64.1	177.3	0	0	0	108.1	S536	S536-I538 PolarHBondContact O-N 3.27Å
539	S	32.8	Very low	31.4	Very low	112 Å²	112	160.6 Å²	160.6	78%	0.783	84%	0.841	S	S	*	*			trans	-81.6	114.1	169.8	-173.7	0	0	0	0	109.2	K537	K537-S539 PolarHBondContact O-N 3.35Å
540	K	33.1	Very low	31.3	Very low	195 Å²	195	164.9 Å²	164.9	85%	0.848	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-83.9	116.5	168	-76.5	-171.8	173.4	-174.6	0	108.9
541	K	30.9	Very low	31.6	Very low	198 Å²	198	168.2 Å²	168.2	86%	0.861	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-68.1	141.6	159.1	-83.5	-174.2	171.6	-176.2	0	109.2
542	S	33.3	Very low	31.6	Very low	111 Å²	111	168.9 Å²	168.9	78%	0.776	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-77.1	143.4	165.1	50.4	0	0	0	0	110.9
543	H	37.8	Very low	31.7	Very low	262 Å²	262	173.1 Å²	173.1	100%	1.213	86%	0.861	S	S	*	*			trans	-134.6	0	152.4	-98	-65.4	0	0	0	107.3

Retrieved 543 of 543 residues in 170.3 ms (Link to these results)

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