A0A096NPX2_PAPAN Loading...

Fibromodulin

Affects the rate of fibrils formation. May have a primary role in collagen fibrillogenesis.

AlphaFold DB , UniProt , Accession A0A096NPX2, Species PAPAN (Papio anubis, Olive baboon), Gene FMOD, Length 444 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	31.5	Very low	24.6	Very low	250 Å²	250	159.4 Å²	159.4	100%	1.232	81%	0.81	S	S	*	*				0	133.5	0	-161	160.9	167.4	0	0	107.6
2	V	21.8	Very low	24.5	Very low	127 Å²	127	152 Å²	152	77%	0.77	80%	0.803	S	S	*	*			trans	-57.1	129.3	-173	170.7	0	0	0	0	113.1
3	R	20.9	Very low	24.5	Very low	219 Å²	219	159.5 Å²	159.5	83%	0.826	81%	0.814	S	S	*	*				37.7	153.7	122.4	-136.5	-173	-166.2	166.8	4.4	121.1
4	L	20.7	Very low	24.6	Very low	132 Å²	132	166.2 Å²	166.2	69%	0.691	82%	0.824	S	S	*	*			trans	96.6	141.4	150.9	-65.6	159.6	0	0	0	116
5	D	23	Very low	24.8	Very low	121 Å²	121	167.9 Å²	167.9	65%	0.647	83%	0.829	S	S	*	*			cis	179.7	168.3	-15.4	-140.4	7.5	0	0	0	108.9
6	Q	23	Very low	24.9	Very low	144 Å²	144	169.7 Å²	169.7	67%	0.673	83%	0.834	S	S	*	*			trans	79.2	141.9	154.1	-52.9	-96.5	-26.1	0	0	118.1
7	V	25	Very low	24.9	Very low	130 Å²	130	174.1 Å²	174.1	79%	0.788	84%	0.839	S	S	*	*				-156.9	153.2	50.1	171.2	0	0	0	0	112.5
8	Q	24.2	Very low	25	Very low	160 Å²	160	171.1 Å²	171.1	75%	0.748	84%	0.839	S	S	*	*			trans	-56.2	155.8	-178.7	-59.5	170.8	-36.9	0	0	118.3
9	N	24.2	Very low	25.2	Very low	165 Å²	165	172.9 Å²	172.9	88%	0.882	84%	0.842	S	S	*	*				-163.9	122.6	128.3	-108.6	-15.5	0	0	0	112.9
10	Q	23.1	Very low	25.3	Very low	180 Å²	180	170.4 Å²	170.4	84%	0.841	84%	0.843	S	S	*	*			trans	-105.7	165.4	151.6	-80.8	-160.6	4.5	0	0	107
11	P	32.7	Very low	25.5	Very low	125 Å²	125	172.2 Å²	172.2	81%	0.812	85%	0.846	S	S	*	*			cis	-144.1	179.3	24.9	36.5	-13.7	0	0	0	116.4
12	G	23.3	Very low	25.4	Very low	71 Å²	71	164.8 Å²	164.8	73%	0.732	82%	0.824	S	S	*	*			trans	121.8	94	145.1	0	0	0	0	0	120.2
13	R	25.3	Very low	25.7	Very low	249 Å²	249	164.5 Å²	164.5	94%	0.94	83%	0.825	S	S	*	*			trans	29.1	122.1	145.9	-66.8	-179.5	179.8	-179.5	0.1	120.7
14	R	25.4	Very low	26.2	Very low	254 Å²	254	158.8 Å²	158.8	96%	0.958	83%	0.825	S	S	*	*				-168.4	140.5	124.4	-106.4	170.5	-169.2	-165.1	3.6	112.2
15	H	27.5	Very low	26.6	Very low	192 Å²	192	159.3 Å²	159.3	89%	0.889	83%	0.827	S	S	*	*			trans	-51.6	139.5	176.4	-75.5	-40.5	0	0	0	114.1
16	Q	26.5	Very low	27	Very low	196 Å²	196	165 Å²	165	92%	0.916	84%	0.839	S	S	*	*			trans	-137.1	118.1	156.6	-111.4	172.7	-2.2	0	0	111.3
17	R	25.5	Very low	27.3	Very low	244 Å²	244	160.8 Å²	160.8	92%	0.921	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-55.4	134.2	167.1	-78.9	170.3	162.6	172.6	-7.1	110.5
18	S	25.6	Very low	27.5	Very low	120 Å²	120	162 Å²	162	84%	0.839	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-72.3	137.2	165.7	57.8	0	0	0	0	110.3
19	K	28.8	Very low	27.9	Very low	207 Å²	207	159.9 Å²	159.9	90%	0.9	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-80.5	124.4	171.8	-74	177.1	175.6	177.8	0	109.2
20	S	27.1	Very low	28.1	Very low	121 Å²	121	160 Å²	160	85%	0.846	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-73.3	135.3	168.5	53.6	0	0	0	0	110.9
21	K	30.2	Very low	28.4	Very low	210 Å²	210	160.8 Å²	160.8	91%	0.913	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.8	135.5	168.8	-75.6	176.2	174.6	176.7	0	109.4
22	A	29.2	Very low	28.4	Very low	94 Å²	94	160.4 Å²	160.4	78%	0.777	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-75.8	150.9	177.3	0	0	0	0	0	112.3
23	P	28.6	Very low	28.8	Very low	120 Å²	120	161.9 Å²	161.9	78%	0.779	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.9	147.6	176.2	31.1	-31.5	0	0	0	112.1
24	A	30.8	Very low	28.9	Very low	100 Å²	100	157.8 Å²	157.8	83%	0.826	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-78.9	131	-179.9	0	0	0	0	0	112
25	L	29.9	Very low	29.3	Very low	142 Å²	142	155 Å²	155	74%	0.743	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-81.1	132	172.2	-124.1	85.4	0	0	0	110.3
26	R	30.6	Very low	29.3	Very low	240 Å²	240	151.2 Å²	151.2	91%	0.906	82%	0.82	S	S	*	*			trans	-122.9	121.2	162.6	-79.2	-172.9	174.8	-169.2	-0.2	108.7
27	C	30.1	Very low	29.8	Very low	57 Å²	57	147.3 Å²	147.3	39%	0.385	81%	0.814	S	S	.	*			trans	-113.3	139.8	170.9	-57.7	0	0	0	0	109.5	C45	C27-C45 WeakPolarHBondContact CB-SG 3.25Å; C27-C45 WeakPolarHBondContact SG-CB 3.35Å; C27-C45 CovalentContact SG-SG 2.09Å; C27-C45 PolarHBondContact SG-SG 3.03Å
28	L	29.6	Very low	30	Very low	155 Å²	155	144.8 Å²	144.8	81%	0.812	81%	0.81	S	S	*	*	B	Isolated β-bridge	trans	-103.8	130.4	177.6	-87.9	154.7	0	0	0	109.5
29	T	31.4	Very low	30.3	Very low	116 Å²	116	145 Å²	145	71%	0.712	81%	0.808	S	S	*	*			trans	-94	115	172	43	0	0	0	0	110.7	L43	T29-L43 HydrophobicContact CG2-CD1 4.41Å
30	L	30	Very low	30.5	Very low	166 Å²	166	145.2 Å²	145.2	87%	0.869	81%	0.809	S	S	*	*			trans	-89.4	119.5	168.6	-92.2	137.7	0	0	0	109.8
31	K	28.8	Very low	30.8	Very low	198 Å²	198	144.1 Å²	144.1	86%	0.861	81%	0.807	S	S	*	*			trans	-103.7	114.3	163.8	-82.2	-178.2	177.5	176.5	0	108
32	S	31.5	Very low	31	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	80%	0.795	S	S	*	*			trans	-85.8	129.8	166.5	57.3	0	0	0	0	109.6
33	A	32.1	Very low	31.3	Very low	103 Å²	103	140 Å²	140	85%	0.851	79%	0.788	S	S	*	*			trans	-93.3	101	172.7	0	0	0	0	0	108.6
34	L	27.8	Very low	31.6	Very low	162 Å²	162	140.5 Å²	140.5	85%	0.848	78%	0.784	S	S	*	*			trans	-146.9	135.7	163.4	-97.8	142.5	0	0	0	108.3	S36	L34-S36 PolarHBondContact O-N 2.73Å
35	H	33.6	Very low	31.7	Very low	195 Å²	195	138.7 Å²	138.7	90%	0.903	76%	0.764	S	S	*	*	S	Bend	trans	-42.8	112.6	-170.6	-86.4	41.6	0	0	0	114.7
36	S	27.9	Very low	32	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	76%	0.764	S	S	*	*	S	Bend	trans	169.2	155.2	133.5	60.1	0	0	0	0	110.2	L34 K38	L34-S36 PolarHBondContact O-N 2.73Å; S36-K38 PolarHBondContact O-N 3.39Å
37	S	37.1	Very low	32.2	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	75%	0.754	S	S	*	*	S	Bend	trans	-64.5	123.1	-168.2	54	0	0	0	0	114.4
38	K	30.3	Very low	32.3	Very low	191 Å²	191	133.7 Å²	133.7	83%	0.83	77%	0.767	S	S	*	*			trans	96.8	111	170.5	-59	-178.4	-179.1	-180	0	115.7	S36	S36-K38 PolarHBondContact O-N 3.39Å
39	P	31.2	Very low	32.3	Very low	124 Å²	124	131.5 Å²	131.5	81%	0.805	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-83.4	128.3	175.3	32.3	-29.6	0	0	0	111.2
40	K	32.8	Very low	32.5	Very low	212 Å²	212	132.9 Å²	132.9	92%	0.922	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-99.6	122.1	159.3	-71.5	-179.1	178.5	179.4	0	107.3
41	A	34.1	Very low	32.5	Very low	97 Å²	97	133 Å²	133	80%	0.802	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-91.7	130.9	-179.6	0	0	0	0	0	110.8
42	C	34	Very low	32.5	Very low	96 Å²	96	128.4 Å²	128.4	65%	0.649	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-99.4	132.8	166.3	-71	0	0	0	0	109.2	C65	C42-C65 VanDerWaalsContact SG-SG 3.64Å
43	L	35.7	Very low	32.8	Very low	121 Å²	121	132.5 Å²	132.5	63%	0.634	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-99.1	123.5	-179.5	-151.3	83.1	0	0	0	109.4	T29	T29-L43 HydrophobicContact CG2-CD1 4.41Å
44	L	33.7	Very low	32.7	Very low	132 Å²	132	131.4 Å²	131.4	69%	0.691	75%	0.753	S	S	*	*	B	Isolated β-bridge	trans	-106.1	126.7	167.6	-113.3	104.2	0	0	0	108.3
45	C	33.2	Very low	33	Very low	61 Å²	61	133.2 Å²	133.2	41%	0.412	75%	0.754	S	S	.	*			trans	-125.9	133.1	170	-59.2	0	0	0	0	108.9	C27	C27-C45 WeakPolarHBondContact CB-SG 3.25Å; C27-C45 WeakPolarHBondContact SG-CB 3.35Å; C27-C45 CovalentContact SG-SG 2.09Å; C27-C45 PolarHBondContact SG-SG 3.03Å
46	L	35.6	Very low	32.9	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	75%	0.752	S	S	*	*			trans	-104.2	136.3	175.9	-76.7	160.5	0	0	0	108.8	L57	L46-L57 HydrophobicContact CD2-CD2 4.01Å
47	T	34.9	Very low	33.1	Very low	113 Å²	113	136.2 Å²	136.2	69%	0.693	75%	0.751	S	S	*	*			trans	-113.6	125.4	171.6	57.5	0	0	0	0	109.6
48	A	32.6	Very low	33	Very low	80 Å²	80	134.3 Å²	134.3	66%	0.661	74%	0.742	S	S	*	*			trans	-110.4	126.2	167.6	0	0	0	0	0	108.5
49	S	30.2	Very low	33.1	Very low	109 Å²	109	133 Å²	133	76%	0.762	74%	0.743	S	S	*	*			trans	-109.5	122.7	173.9	-173.2	0	0	0	0	108.7	E51	S49-E51 PolarHBondContact O-N 3Å
50	V	34.7	Very low	33.1	Very low	144 Å²	144	136.9 Å²	136.9	87%	0.873	75%	0.748	S	S	*	*			trans	-92.2	76.1	178.2	-174.5	0	0	0	0	108.1
51	E	31.2	Very low	33.1	Very low	170 Å²	170	131 Å²	131	79%	0.794	73%	0.733	S	S	*	*	S	Bend	trans	-165.4	112.2	160.8	-110.1	167.2	-158.4	0	0	106.6	S49	S49-E51 PolarHBondContact O-N 3Å
52	S	29.1	Very low	33	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	73%	0.729	S	S	*	*	S	Bend	trans	82.1	124	-167.6	76.3	0	0	0	0	116	S54	S52-S54 PolarHBondContact O-N 3.46Å
53	H	36.7	Very low	33	Very low	202 Å²	202	133.5 Å²	133.5	94%	0.935	74%	0.743	S	S	*	*	S	Bend	trans	-67.1	75.7	175.5	-79.2	-84.4	0	0	0	111.3
54	S	31.3	Very low	33.1	Very low	80 Å²	80	133 Å²	133	56%	0.559	75%	0.75	S	S	*	*			trans	-154	111.4	170.4	-66.9	0	0	0	0	109.9	S52	S52-S54 PolarHBondContact O-N 3.46Å
55	F	34.1	Very low	33.2	Very low	200 Å²	200	131 Å²	131	88%	0.877	75%	0.746	S	S	*	*			trans	-81	118.5	174.2	-77.7	-88.1	0	0	0	110.1
56	W	31.1	Very low	33.5	Very low	223 Å²	223	139 Å²	139	85%	0.845	77%	0.768	S	S	*	*			trans	-106.6	123.1	168.7	-74.3	90.6	0	0	0	110
57	L	32.5	Very low	33.8	Very low	150 Å²	150	139.5 Å²	139.5	79%	0.785	77%	0.771	S	S	*	*			trans	-85.6	108.9	167.6	-83.2	158.5	0	0	0	108.7	L46	L46-L57 HydrophobicContact CD2-CD2 4.01Å
58	A	33.2	Very low	34.1	Very low	73 Å²	73	144.1 Å²	144.1	60%	0.603	78%	0.782	S	S	*	*			trans	-100.7	114	169	0	0	0	0	0	109.9
59	L	32.8	Very low	34.3	Very low	165 Å²	165	147.3 Å²	147.3	86%	0.864	78%	0.784	S	S	*	*			trans	-90.8	110.5	172.2	-79.5	162.3	0	0	0	109.5
60	F	32.1	Very low	34.9	Very low	204 Å²	204	149.4 Å²	149.4	90%	0.895	78%	0.782	S	S	*	*			trans	-94.7	118.9	163.9	-88.7	-86.8	0	0	0	109.5
61	S	33.3	Very low	35.3	Very low	88 Å²	88	152.8 Å²	152.8	62%	0.615	78%	0.779	S	S	*	*			trans	-121.3	124.5	170.7	-173.1	0	0	0	0	109.2
62	P	31.3	Very low	35.8	Very low	111 Å²	111	149 Å²	149	72%	0.721	77%	0.768	S	S	*	*			trans	-67.3	144.8	162.5	-6.1	22.1	0	0	0	108.7	S64	P62-S64 PolarHBondContact O-N 3.35Å
63	S	33.3	Very low	36.4	Very low	135 Å²	135	147.2 Å²	147.2	94%	0.944	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	35.2	-170	44.8	0	0	0	0	117.2
64	S	38.3	Very low	36.7	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	14.4	-179.8	-172.5	0	0	0	0	115.4	P62	P62-S64 PolarHBondContact O-N 3.35Å
65	C	35.8	Very low	37.2	Very low	89 Å²	89	144.7 Å²	144.7	60%	0.601	74%	0.742	S	S	*	*			trans	-122.1	39.4	174.5	-93.3	0	0	0	0	112.7	C42	C42-C65 VanDerWaalsContact SG-SG 3.64Å
66	R	38.9	Very low	37.5	Very low	229 Å²	229	140.6 Å²	140.6	86%	0.864	73%	0.728	S	S	*	*			trans	-111.2	87.5	171.5	-164.3	-178.3	-73.8	-146.9	0.2	106.2
67	D	43.3	Very low	37.9	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	72%	0.716	S	S	*	*	S	Bend	trans	166.1	123.2	149.7	-80.3	-19.9	0	0	0	109.8
68	K	40.9	Very low	38.3	Very low	211 Å²	211	131.2 Å²	131.2	92%	0.917	70%	0.703	S	S	*	*			trans	83.1	66.5	-174.4	-56	-176.7	178.3	-178.6	0	116.7
69	M	36.3	Very low	38.6	Very low	146 Å²	146	129 Å²	129	72%	0.719	69%	0.688	S	S	*	*			trans	-139	115.6	147.1	-105.3	164.3	75.8	0	0	108	W71 L74	M69-W71 PolarHBondContact O-N 2.87Å; M69-L74 HydrophobicContact CE-CD1 3.69Å
70	Q	43.6	Very low	38.8	Very low	153 Å²	153	126 Å²	126	72%	0.715	67%	0.672	S	S	*	*			trans	-67.3	124.4	175.4	-76.1	177.3	-25	0	0	108.5	T72 S73	Q70-T72 PolarHBondContact O-N 3.38Å; Q70-S73 PolarHBondContact O-N 3.24Å
71	W	41.5	Very low	38.7	Very low	216 Å²	216	123.7 Å²	123.7	82%	0.818	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-18.1	-178.2	-83.8	81.2	0	0	0	114.1	M69 S73 L74	M69-W71 PolarHBondContact O-N 2.87Å; W71-S73 VanDerWaalsContact C-N 3.32Å; W71-S73 PolarHBondContact O-N 2.97Å; W71-L74 PolarHBondContact O-N 3.43Å
72	T	41.5	Very low	38.7	Very low	90 Å²	90	123.5 Å²	123.5	55%	0.552	66%	0.66	S	S	*	*	H	α-helix	trans	-66.4	-30.3	175.1	50.3	0	0	0	0	113	Q70 L76	Q70-T72 PolarHBondContact O-N 3.38Å; T72-L76 PolarHBondContact O-N 3.22Å
73	S	42.3	Very low	38.6	Very low	63 Å²	63	124 Å²	124	44%	0.441	66%	0.656	S	S	.	*	H	α-helix	trans	-77	-22.6	178.1	-53	0	0	0	0	113.4	Q70 W71 L77	Q70-S73 PolarHBondContact O-N 3.24Å; W71-S73 VanDerWaalsContact C-N 3.32Å; W71-S73 PolarHBondContact O-N 2.97Å; S73-L77 PolarHBondContact O-N 2.65Å
74	L	43.8	Very low	38.5	Very low	96 Å²	96	121.3 Å²	121.3	50%	0.503	64%	0.637	S	S	.	*	H	α-helix	trans	-80.8	-30.2	178.4	-125.9	127.1	0	0	0	112.1	M69 W71 A78	M69-L74 HydrophobicContact CE-CD1 3.69Å; W71-L74 PolarHBondContact O-N 3.43Å; L74-A78 WeakPolarHBondContact O-CB 3.27Å; L74-A78 PolarHBondContact O-N 3.47Å
75	L	41.5	Very low	38.2	Very low	133 Å²	133	124.9 Å²	124.9	70%	0.696	64%	0.642	S	S	*	*	H	α-helix	trans	-74.4	-30.9	171.5	-76.2	165.2	0	0	0	112.5	G79	L75-G79 PolarHBondContact O-N 3.28Å
76	L	40.7	Very low	37.9	Very low	113 Å²	113	123.2 Å²	123.2	59%	0.592	63%	0.634	S	S	*	*	H	α-helix	trans	-69.3	-36.6	171.8	-89.4	156.6	0	0	0	112.3	T72 L80	T72-L76 PolarHBondContact O-N 3.22Å; L76-L80 VanDerWaalsContact O-CB 3.23Å; L76-L80 WeakPolarHBondContact O-CB 3.35Å; L76-L80 WeakPolarHBondContact O-CD1 3.42Å; L76-L80 WeakPolarHBondContact O-CG 3.36Å; L76-L80 PolarHBondContact O-N 3.23Å
77	L	40.1	Very low	37.3	Very low	115 Å²	115	121.3 Å²	121.3	60%	0.602	64%	0.635	S	S	*	*	H	α-helix	trans	-77.7	-31.3	175.3	-92.2	152.5	0	0	0	113.5	S73 F81	S73-L77 PolarHBondContact O-N 2.65Å; L77-F81 PolarHBondContact O-N 3.43Å; L77-F81 VanDerWaalsContact O-N 3.13Å
78	A	39.7	Very low	36.6	Very low	61 Å²	61	124 Å²	124	50%	0.504	64%	0.635	S	S	.	*	H	α-helix	trans	-72.3	-35.9	171.1	0	0	0	0	0	112.1	L74 S82	L74-A78 WeakPolarHBondContact O-CB 3.27Å; L74-A78 PolarHBondContact O-N 3.47Å; A78-S82 PolarHBondContact O-N 2.09Å; A78-S82 PolarHBondContact O-OG 2.82Å
79	G	39.5	Very low	36.1	Very low	27 Å²	27	121.3 Å²	121.3	28%	0.278	63%	0.631	S	S	.	*	H	α-helix	trans	-71.6	-30.8	173.1	0	0	0	0	0	113.9	L75 S82 L83	L75-G79 PolarHBondContact O-N 3.28Å; G79-S82 WeakPolarHBondContact CA-OG 3.29Å; G79-S82 PolarHBondContact O-OG 2.96Å; G79-S82 VanDerWaalsContact O-OG 3.1Å; G79-L83 WeakPolarHBondContact O-CB 3.37Å; G79-L83 WeakPolarHBondContact O-CD1 3.23Å; G79-L83 WeakPolarHBondContact O-CG 3.16Å; G79-L83 PolarHBondContact O-N 3.5Å
80	L	36.3	Very low	36.1	Very low	102 Å²	102	120.8 Å²	120.8	53%	0.534	63%	0.631	S	S	.	*	H	α-helix	trans	-83.6	-18.8	176.4	-73.1	167.4	0	0	0	113.6	L76 S84	L76-L80 VanDerWaalsContact O-CB 3.23Å; L76-L80 WeakPolarHBondContact O-CB 3.35Å; L76-L80 WeakPolarHBondContact O-CD1 3.42Å; L76-L80 WeakPolarHBondContact O-CG 3.36Å; L76-L80 PolarHBondContact O-N 3.23Å; L80-S84 PolarHBondContact O-N 3.22Å
81	F	31.4	Very low	35.8	Very low	156 Å²	156	118.6 Å²	118.6	68%	0.684	62%	0.624	S	S	*	*	H	α-helix	trans	-84.7	-23	168.8	-111	-88.6	0	0	0	113.3	L77 L83	L77-F81 PolarHBondContact O-N 3.43Å; L77-F81 VanDerWaalsContact O-N 3.13Å; F81-L83 VanDerWaalsContact C-N 3.3Å
82	S	32.4	Very low	35.6	Very low	83 Å²	83	112.5 Å²	112.5	58%	0.58	61%	0.613	S	S	*	*	S	Bend	trans	-80.8	-10.2	165.8	48.4	0	0	0	0	113.3	A78 G79	A78-S82 PolarHBondContact O-N 2.09Å; A78-S82 PolarHBondContact O-OG 2.82Å; G79-S82 WeakPolarHBondContact CA-OG 3.29Å; G79-S82 PolarHBondContact O-OG 2.96Å; G79-S82 VanDerWaalsContact O-OG 3.1Å
83	L	30.3	Very low	35.6	Very low	123 Å²	123	113.4 Å²	113.4	64%	0.644	61%	0.61	S	S	*	*	S	Bend	trans	-102.4	-1.2	172.9	-77.8	164.2	0	0	0	114.2	G79 F81	G79-L83 WeakPolarHBondContact O-CB 3.37Å; G79-L83 WeakPolarHBondContact O-CD1 3.23Å; G79-L83 WeakPolarHBondContact O-CG 3.16Å; G79-L83 PolarHBondContact O-N 3.5Å; F81-L83 VanDerWaalsContact C-N 3.3Å
84	S	30.5	Very low	35.9	Very low	77 Å²	77	118.9 Å²	118.9	54%	0.538	62%	0.621	S	S	.	*	S	Bend	trans	-102.7	9.3	175.5	84.2	0	0	0	0	114.4	L80	L80-S84 PolarHBondContact O-N 3.22Å
85	Q	31.6	Very low	35.6	Very low	188 Å²	188	120.1 Å²	120.1	88%	0.879	62%	0.619	S	S	*	*	S	Bend	trans	-126.2	18.8	166.1	-74.4	-165.8	-6.7	0	0	112.6
86	A	30.8	Very low	35.5	Very low	53 Å²	53	119 Å²	119	44%	0.438	61%	0.609	S	S	.	*			trans	-123.1	71.8	169.8	0	0	0	0	0	108.6
87	Q	26.2	Very low	35.6	Very low	190 Å²	190	120.7 Å²	120.7	89%	0.888	61%	0.614	S	S	*	*			trans	-97.5	80.2	162.4	-160.3	162.8	-8.7	0	0	103.4	D89	Q87-D89 VanDerWaalsContact C-N 3.33Å; Q87-D89 PolarHBondContact O-N 3.26Å
88	Y	28.4	Very low	35.7	Very low	207 Å²	207	122.7 Å²	122.7	81%	0.812	61%	0.614	S	S	*	*				39.2	62	91.6	-95.8	-74.3	0	0	0	112
89	D	30.1	Very low	35.5	Very low	156 Å²	156	124.8 Å²	124.8	83%	0.834	62%	0.617	S	S	*	*			trans	-86.3	118.5	136	-100.6	-32.1	0	0	0	105.9	Q87	Q87-D89 VanDerWaalsContact C-N 3.33Å; Q87-D89 PolarHBondContact O-N 3.26Å
90	D	35.7	Very low	35.4	Very low	134 Å²	134	133.6 Å²	133.6	72%	0.717	64%	0.641	S	S	*	*			trans	-159.8	119.1	152.7	-99.6	-27.3	0	0	0	110.1
91	D	37.8	Very low	35.3	Very low	107 Å²	107	132.6 Å²	132.6	57%	0.572	64%	0.643	S	S	*	*			trans	-50.5	120.5	170.2	-176.7	-3.7	0	0	0	111.4	H93	D91-H93 PolarHBondContact O-N 3.23Å; D91-H93 VanDerWaalsContact O-N 3.1Å; D91-H93 IonicContact OD1-CD2 3.98Å; D91-H93 PolarHBondContact OD1-N 3.1Å
92	P	37.3	Very low	35.5	Very low	89 Å²	89	132.2 Å²	132.2	58%	0.578	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	10.4	-175.4	30.6	-33.4	0	0	0	114.3	W95	P92-W95 VanDerWaalsContact O-CD1 3.26Å; P92-W95 PolarHBondContact O-NE1 2.94Å
93	H	42.3	Very low	35.4	Very low	108 Å²	108	136.5 Å²	136.5	50%	0.5	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.2	2.5	-172	-67.4	-66.1	0	0	0	116.7	D91 W95 F96	D91-H93 PolarHBondContact O-N 3.23Å; D91-H93 VanDerWaalsContact O-N 3.1Å; D91-H93 IonicContact OD1-CD2 3.98Å; D91-H93 PolarHBondContact OD1-N 3.1Å; H93-W95 VanDerWaalsContact C-N 3.26Å; H93-W95 PolarHBondContact O-N 3.45Å; H93-F96 AromaticContact ND1-CD2 3.83Å; H93-F96 PolarHBondContact O-N 2.87Å
94	W	46.7	Very low	35.3	Very low	178 Å²	178	135.8 Å²	135.8	67%	0.674	66%	0.66	S	S	*	*	H	α-helix	trans	-64.4	-26.4	-178.9	73.5	-92.8	0	0	0	114.2	H97 Y98	W94-H97 PolarHBondContact O-N 3.13Å; W94-Y98 PolarHBondContact O-N 3.25Å
95	W	39.5	Very low	35.2	Very low	122 Å²	122	138.8 Å²	138.8	46%	0.462	68%	0.675	S	S	.	*	H	α-helix	trans	-74.3	-24.6	179.3	65.1	-82.2	0	0	0	114	P92 H93 H97 Y98 L99	P92-W95 VanDerWaalsContact O-CD1 3.26Å; P92-W95 PolarHBondContact O-NE1 2.94Å; H93-W95 VanDerWaalsContact C-N 3.26Å; H93-W95 PolarHBondContact O-N 3.45Å; W95-H97 VanDerWaalsContact C-N 3.27Å; W95-H97 PolarHBondContact O-N 3.03Å; W95-Y98 PolarHBondContact O-N 2.92Å; W95-L99 HydrophobicContact CE3-CD1 3.62Å; W95-L99 HydrophobicContact CZ3-CD1 3.87Å; W95-L99 PolarHBondContact O-N 2.68Å; W95-L99 VanDerWaalsContact O-N 3.16Å
96	F	38	Very low	35	Very low	110 Å²	110	139.9 Å²	139.9	48%	0.482	67%	0.672	S	S	.	*	H	α-helix	trans	-68	-27.7	174.8	-83.3	-76.3	0	0	0	112.4	H93	H93-F96 AromaticContact ND1-CD2 3.83Å; H93-F96 PolarHBondContact O-N 2.87Å
97	H	43.5	Very low	35	Very low	149 Å²	149	147.5 Å²	147.5	69%	0.69	69%	0.691	S	S	*	*	H	α-helix	trans	-81.5	-32.3	176.1	-79.1	-87.4	0	0	0	112.7	W94 W95	W94-H97 PolarHBondContact O-N 3.13Å; W95-H97 VanDerWaalsContact C-N 3.27Å; W95-H97 PolarHBondContact O-N 3.03Å
98	Y	41.6	Very low	35.3	Very low	156 Å²	156	144 Å²	144	61%	0.612	68%	0.679	S	S	*	*	H	α-helix	trans	-63.9	-43.3	172.2	-174.8	-103.8	0	0	0	111.9	W94 W95 R100 S101	W94-Y98 PolarHBondContact O-N 3.25Å; W95-Y98 PolarHBondContact O-N 2.92Å; Y98-R100 VanDerWaalsContact C-N 3.33Å; Y98-R100 PolarHBondContact O-N 3.16Å; Y98-S101 PolarHBondContact O-N 3.14Å; Y98-S101 PolarHBondContact O-OG 2.85Å
99	L	34.8	Very low	35.5	Very low	106 Å²	106	138.9 Å²	138.9	56%	0.555	67%	0.671	S	S	*	*	H	α-helix	trans	-72.7	-18.9	-178.8	-72.1	173.3	0	0	0	114.6	W95 S101	W95-L99 HydrophobicContact CE3-CD1 3.62Å; W95-L99 HydrophobicContact CZ3-CD1 3.87Å; W95-L99 PolarHBondContact O-N 2.68Å; W95-L99 VanDerWaalsContact O-N 3.16Å; L99-S101 VanDerWaalsContact C-N 3.35Å
100	R	38.3	Very low	35.6	Very low	211 Å²	211	141.4 Å²	141.4	80%	0.796	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-83.8	-10.7	177.1	-147.4	174.3	-164.8	169.9	4	113.5	Y98	Y98-R100 VanDerWaalsContact C-N 3.33Å; Y98-R100 PolarHBondContact O-N 3.16Å
101	S	34.5	Very low	35.4	Very low	82 Å²	82	142.9 Å²	142.9	57%	0.573	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-85.8	-4.7	178.5	75.3	0	0	0	0	114.4	Y98 L99	Y98-S101 PolarHBondContact O-N 3.14Å; Y98-S101 PolarHBondContact O-OG 2.85Å; L99-S101 VanDerWaalsContact C-N 3.35Å
102	Q	36.1	Very low	35.3	Very low	148 Å²	148	142.8 Å²	142.8	69%	0.692	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-112.3	13.8	-174.3	-72	-68.7	-26.2	0	0	115	S104	Q102-S104 PolarHBondContact O-N 2.88Å
103	Q	29.1	Very low	35.2	Very low	173 Å²	173	149.1 Å²	149.1	81%	0.808	70%	0.697	S	S	*	*			trans	-92.7	79.4	173.3	-89.6	-176.5	-19.3	0	0	112.3
104	S	29.3	Very low	34.9	Very low	108 Å²	108	149.3 Å²	149.3	76%	0.755	71%	0.708	S	S	*	*	S	Bend	trans	-158.4	132.9	142	-102.9	0	0	0	0	111.5	Q102	Q102-S104 PolarHBondContact O-N 2.88Å
105	T	28.4	Very low	34.2	Very low	139 Å²	139	150.9 Å²	150.9	85%	0.853	72%	0.715	S	S	*	*			trans	90.2	79.8	177	70.1	0	0	0	0	116.4
106	Y	27.5	Very low	33.9	Very low	211 Å²	211	154.1 Å²	154.1	83%	0.827	74%	0.735	S	S	*	*			trans	-91.1	113.4	154.4	-171.3	-99.6	0	0	0	107.3
107	Y	29.7	Very low	33.5	Very low	214 Å²	214	155.2 Å²	155.2	84%	0.839	75%	0.751	S	S	*	*			trans	-99.1	125.4	168.7	-125.3	-88.3	0	0	0	107.7
108	D	33.4	Very low	33	Very low	117 Å²	117	159.3 Å²	159.3	63%	0.626	76%	0.763	S	S	*	*			trans	-78.6	125.3	-178.9	-175.2	-5.9	0	0	0	110.9	Y110	D108-Y110 PolarHBondContact OD1-N 2.03Å
109	P	31.7	Very low	32.7	Very low	98 Å²	98	160.5 Å²	160.5	64%	0.636	77%	0.774	S	S	*	*			trans	-114	63.7	177.6	38.6	-26	0	0	0	112.3
110	Y	31.6	Very low	32.7	Very low	209 Å²	209	161.1 Å²	161.1	82%	0.82	78%	0.784	S	S	*	*			trans	-148.6	99.8	159.5	-78.8	-78.4	0	0	0	111.7	D108	D108-Y110 PolarHBondContact OD1-N 2.03Å
111	D	31.6	Very low	32.6	Very low	166 Å²	166	161.3 Å²	161.3	89%	0.888	79%	0.786	S	S	*	*			trans	-157.6	140.1	135.7	-135.2	6.8	0	0	0	111.2
112	P	36.9	Very low	32.7	Very low	105 Å²	105	163.5 Å²	163.5	68%	0.682	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-94.7	153	-160.9	36.2	-31.8	0	0	0	114.3
113	Y	34.6	Very low	32.9	Very low	222 Å²	222	167.4 Å²	167.4	87%	0.871	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-55.7	139	168.5	-71.7	-89.1	0	0	0	113.2
114	P	36.1	Very low	33.2	Very low	111 Å²	111	162.9 Å²	162.9	72%	0.721	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.4	130.3	151.4	-1.1	20.1	0	0	0	110.3
115	Y	33.1	Very low	33.8	Very low	211 Å²	211	163.9 Å²	163.9	83%	0.827	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-61.7	134.4	163.9	48.1	-84.6	0	0	0	110
116	E	31.3	Very low	34.2	Very low	190 Å²	190	165.1 Å²	165.1	89%	0.888	81%	0.81	S	S	*	*			trans	-137.4	149.3	156.2	-81.9	-164.8	166	0	0	110.8
117	T	29.5	Very low	35	Very low	134 Å²	134	164.3 Å²	164.3	82%	0.822	81%	0.814	S	S	*	*			trans	-80.4	147.9	-153.8	34.3	0	0	0	0	114.3
118	Y	32.8	Very low	35.4	Very low	235 Å²	235	157.2 Å²	157.2	92%	0.922	81%	0.806	S	S	*	*			trans	-68.1	132.1	167.8	-89.7	-96	0	0	0	111.5
119	E	35.5	Very low	35.8	Very low	181 Å²	181	157.4 Å²	157.4	85%	0.846	81%	0.814	S	S	*	*			trans	-126.7	152.4	153.2	-78.9	-155.6	163.1	0	0	110.7
120	P	35.6	Very low	36	Very low	119 Å²	119	157.4 Å²	157.4	77%	0.773	82%	0.822	S	S	*	*			trans	-94.7	152.4	-164.1	15.7	3.2	0	0	0	114.5
121	Y	35.9	Very low	36.2	Very low	215 Å²	215	157.9 Å²	157.9	84%	0.843	82%	0.824	S	S	*	*			trans	-36.3	161	-179.8	-59.8	-85.4	0	0	0	118.8
122	P	37.1	Very low	36.5	Very low	127 Å²	127	156.5 Å²	156.5	83%	0.825	82%	0.821	S	S	*	*				-130.7	148.2	116.9	18.6	0.9	0	0	0	114.5
123	Y	40.1	Very low	36.7	Very low	231 Å²	231	162.3 Å²	162.3	91%	0.906	83%	0.831	S	S	*	*			trans	-55.1	136.2	177.2	-77.9	-101.7	0	0	0	113.6
124	G	35.2	Very low	36.9	Very low	77 Å²	77	155 Å²	155	79%	0.794	82%	0.823	S	S	*	*			trans	-142.7	114.1	162.2	0	0	0	0	0	108.9
125	V	42.8	Very low	37.2	Very low	129 Å²	129	155 Å²	155	78%	0.782	83%	0.826	S	S	*	*			trans	-80.2	122.4	174.8	178	0	0	0	0	107.2
126	D	35.4	Very low	38	Very low	165 Å²	165	150.7 Å²	150.7	88%	0.882	82%	0.824	S	S	*	*			trans	-151.2	123.6	157.7	-108.7	-23.5	0	0	0	110.7	G128	D126-G128 PolarHBondContact O-N 3.35Å
127	E	44.6	Very low	38.7	Very low	195 Å²	195	146.4 Å²	146.4	91%	0.911	82%	0.815	S	S	*	*			trans	-73.7	107.5	-180	-66.6	-178.1	152.8	0	0	110.1
128	G	37.9	Very low	39.7	Very low	64 Å²	64	145.5 Å²	145.5	66%	0.66	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-92.3	147.4	168.7	0	0	0	0	0	111.8	D126	D126-G128 PolarHBondContact O-N 3.35Å
129	P	42.1	Very low	40.9	Very low	122 Å²	122	140 Å²	140	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.8	149.5	-168.5	30.8	-33.3	0	0	0	112	Y131	P129-Y131 PolarHBondContact O-N 2.88Å
130	A	36.6	Very low	42.1	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-46.7	117.3	-177.2	0	0	0	0	0	113.6	T132	A130-T132 PolarHBondContact O-N 3.28Å; A130-T132 VanDerWaalsContact O-N 3.16Å
131	Y	35.5	Very low	43.5	Very low	219 Å²	219	135.4 Å²	135.4	86%	0.859	78%	0.784	S	S	*	*			trans	-67.9	108.5	159.4	-68.5	-80.3	0	0	0	108.2	P129 Y133	P129-Y131 PolarHBondContact O-N 2.88Å; Y131-Y133 PolarHBondContact O-N 2.74Å; Y131-Y133 VanDerWaalsContact O-N 3.15Å
132	T	36.9	Very low	45.4	Very low	137 Å²	137	133.1 Å²	133.1	84%	0.84	77%	0.774	S	S	*	*			trans	-57.8	112.4	162.5	26.3	0	0	0	0	108.3	A130 G134	A130-T132 PolarHBondContact O-N 3.28Å; A130-T132 VanDerWaalsContact O-N 3.16Å; T132-G134 PolarHBondContact O-N 2.93Å
133	Y	41.5	Very low	47.9	Very low	228 Å²	228	132.4 Å²	132.4	89%	0.894	76%	0.763	S	S	*	*			trans	-55	107.5	165.7	-86.9	-93.5	0	0	0	107.9	Y131 S135	Y131-Y133 PolarHBondContact O-N 2.74Å; Y131-Y133 VanDerWaalsContact O-N 3.15Å; Y133-S135 PolarHBondContact O-N 3Å
134	G	39.3	Very low	50.6	Low	68 Å²	68	123.2 Å²	123.2	70%	0.701	73%	0.732	S	S	*	*			trans	-54.8	124.7	165.9	0	0	0	0	0	108.1	T132	T132-G134 PolarHBondContact O-N 2.93Å
135	S	41.8	Very low	53.5	Low	111 Å²	111	120.4 Å²	120.4	78%	0.776	70%	0.7	S	S	*	*			trans	-44.4	136.1	172.8	-54.1	0	0	0	0	109.9	Y133 S137	Y133-S135 PolarHBondContact O-N 3Å; S135-S137 PolarHBondContact O-N 2.9Å
136	P	49.7	Very low	56.1	Low	120 Å²	120	123.9 Å²	123.9	78%	0.779	71%	0.708	S	S	*	*			trans	-54.7	130.1	174	-17.6	28	0	0	0	108.3
137	S	45.8	Very low	59	Low	101 Å²	101	118.8 Å²	118.8	71%	0.706	68%	0.679	S	S	*	*			trans	-43.5	133.9	161.1	46.9	0	0	0	0	108.2	S135	S135-S137 PolarHBondContact O-N 2.9Å
138	P	50.7	Low	61.6	Low	114 Å²	114	109.8 Å²	109.8	74%	0.74	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-51.2	137.7	-179	18.9	-29.4	0	0	0	109.3	D140	P138-D140 PolarHBondContact O-N 3.26Å; P138-D140 VanDerWaalsContact O-N 3.09Å
139	P	58.6	Low	64.5	Low	121 Å²	121	111.3 Å²	111.3	79%	0.786	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-54.3	123.1	-178.9	20.4	-30.2	0	0	0	108.6
140	D	61	Low	67.1	Low	112 Å²	112	106.9 Å²	106.9	60%	0.599	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-51.4	122.9	-178.5	-165.1	2.6	0	0	0	109	P138 R142	P138-D140 PolarHBondContact O-N 3.26Å; P138-D140 VanDerWaalsContact O-N 3.09Å; D140-R142 WeakPolarHBondContact O-CG 3.42Å; D140-R142 PolarHBondContact O-N 2.93Å
141	P	64.1	Low	70	Confident	90 Å²	90	103.6 Å²	103.6	58%	0.584	57%	0.573	S	S	*	*			trans	-59	105.2	-173.8	-23.7	33.4	0	0	0	110.7	D143 R174	P141-D143 PolarHBondContact O-N 2.8Å; P141-R174 PolarHBondContact O-NH1 2.72Å
142	R	76.3	Confident	72.7	Confident	168 Å²	168	97.7 Å²	97.7	63%	0.634	56%	0.561	S	S	*	*			trans	-88.4	30.7	175.7	-64.3	-147.9	177.7	-167.6	0.2	112.9	D140 C144	D140-R142 WeakPolarHBondContact O-CG 3.42Å; D140-R142 PolarHBondContact O-N 2.93Å; R142-C144 PolarHBondContact O-N 3.02Å
143	D	90.3	Very high	75.6	Confident	111 Å²	111	98 Å²	98	59%	0.594	56%	0.557	S	S	*	*			trans	-56.5	130.4	172.3	-171.5	-29.4	0	0	0	109.6	P141 R174	P141-D143 PolarHBondContact O-N 2.8Å; D143-R174 VanDerWaalsContact O-CZ 3.27Å; D143-R174 PolarHBondContact O-NH1 2.96Å; D143-R174 PolarHBondContact O-NH2 2.03Å
144	C	96.5	Very high	78.2	Confident	39 Å²	39	91.2 Å²	91.2	26%	0.264	53%	0.533	S	S	.	.			trans	-139.6	130.8	173.1	-168.5	0	0	0	0	108	R142 Q146 C150	R142-C144 PolarHBondContact O-N 3.02Å; C144-Q146 PolarHBondContact O-N 2.88Å; C144-C150 HydrophobicContact CB-CB 3.73Å; C144-C150 WeakPolarHBondContact CB-SG 3.02Å; C144-C150 WeakPolarHBondContact SG-CB 3.4Å; C144-C150 PolarHBondContact SG-N 2.95Å; C144-C150 VanDerWaalsContact SG-N 3.45Å; C144-C150 CovalentContact SG-SG 2.03Å; C144-C150 PolarHBondContact SG-SG 3.24Å
145	P	97.1	Very high	80.8	Confident	18 Å²	18	90.5 Å²	90.5	12%	0.117	52%	0.516	C	S	.	.			trans	-54.5	137.6	171.5	-24	33.8	0	0	0	111	E147 C148 M158 P169	P145-E147 HydrophobicContact CB-CG 4.3Å; P145-E147 WeakPolarHBondContact CB-OE2 3.02Å; P145-E147 PolarHBondContact O-N 3.35Å; P145-C148 HydrophobicContact CB-CB 4.32Å; P145-C148 PolarHBondContact O-N 3Å; P145-C148 VanDerWaalsContact O-O 3.06Å; P145-M158 HydrophobicContact CG-SD 4.04Å; P145-P169 HydrophobicContact CB-CB 3.79Å; P145-P169 HydrophobicContact CB-CG 4.12Å; P145-P169 HydrophobicContact CG-CB 3.8Å; P145-P169 HydrophobicContact CG-CG 4.12Å
146	Q	96.4	Very high	83.5	Confident	201 Å²	201	87 Å²	87	94%	0.939	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.4	-175.2	-69.7	-173.7	-24.3	0	0	112.9	C144 C148	C144-Q146 PolarHBondContact O-N 2.88Å; Q146-C148 PolarHBondContact O-N 3.47Å
147	E	97.1	Very high	85.8	Confident	58 Å²	58	81.2 Å²	81.2	27%	0.271	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.5	176.3	62.1	-96.6	-122.8	0	0	113.9	P145 R163 L165 Y167 P169	P145-E147 HydrophobicContact CB-CG 4.3Å; P145-E147 WeakPolarHBondContact CB-OE2 3.02Å; P145-E147 PolarHBondContact O-N 3.35Å; E147-R163 WeakPolarHBondContact O-CD 3.5Å; E147-L165 HydrophobicContact CB-CD2 3.93Å; E147-L165 HydrophobicContact CG-CD2 4.23Å; E147-Y167 WeakPolarHBondContact OE1-CE2 3.17Å; E147-Y167 PolarHBondContact OE1-OH 3.1Å; E147-P169 HydrophobicContact CG-CG 4.3Å
148	C	98.3	Very high	88.3	Confident	7 Å²	7	76.4 Å²	76.4	5%	0.047	42%	0.419	C	S	.	.	S	Bend	trans	-130.1	159.7	-176.6	-61.7	0	0	0	0	112.2	P145 Q146 M158 Y159 C160	P145-C148 HydrophobicContact CB-CB 4.32Å; P145-C148 PolarHBondContact O-N 3Å; P145-C148 VanDerWaalsContact O-O 3.06Å; Q146-C148 PolarHBondContact O-N 3.47Å; C148-M158 HydrophobicContact CB-CG 3.96Å; C148-M158 HydrophobicContact CB-SD 4.4Å; C148-Y159 WeakPolarHBondContact CA-O 3.32Å; C148-C160 HydrophobicContact CB-CB 4.17Å; C148-C160 WeakPolarHBondContact CB-SG 3.42Å; C148-C160 WeakPolarHBondContact SG-CB 3.34Å; C148-C160 CovalentContact SG-SG 2.03Å; C148-C160 PolarHBondContact SG-SG 3.28Å
149	D	98.2	Very high	90.6	Very high	95 Å²	95	74.8 Å²	74.8	51%	0.508	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-108.2	127.4	175.5	-68.2	-48.5	0	0	0	111	Y159 R163	D149-Y159 PolarHBondContact N-O 3.03Å; D149-Y159 PolarHBondContact O-N 3.33Å; D149-R163 IonicContact OD2-CZ 2.67Å; D149-R163 IonicContact OD2-NE 3.26Å; D149-R163 IonicContact OD2-NH2 2.93Å; D149-R163 PolarHBondContact OD2-NH2 3.15Å
150	C	97.9	Very high	92.5	Very high	30 Å²	30	69 Å²	69	20%	0.203	36%	0.361	C	S	.	.			trans	-116.8	96.8	176.4	-59.6	0	0	0	0	110.2	C144 M175	C144-C150 HydrophobicContact CB-CB 3.73Å; C144-C150 WeakPolarHBondContact CB-SG 3.02Å; C144-C150 WeakPolarHBondContact SG-CB 3.4Å; C144-C150 PolarHBondContact SG-N 2.95Å; C144-C150 VanDerWaalsContact SG-N 3.45Å; C144-C150 CovalentContact SG-SG 2.03Å; C144-C150 PolarHBondContact SG-SG 3.24Å; C150-M175 HydrophobicContact CB-CE 4.4Å; C150-M175 VanDerWaalsContact SG-CE 3.59Å
151	P	96.3	Very high	94.3	Very high	28 Å²	28	65.7 Å²	65.7	18%	0.182	34%	0.343	C	S	.	.			trans	-65.4	128.1	-173.7	21	-30	0	0	0	112.8	N153 F154 Y159	P151-N153 VanDerWaalsContact C-N 3.25Å; P151-N153 VanDerWaalsContact CB-OD1 3.29Å; P151-N153 WeakPolarHBondContact CB-OD1 3.31Å; P151-N153 PolarHBondContact O-N 3.09Å; P151-F154 HydrophobicContact CG-CB 4.2Å; P151-F154 CarbonylContact O-C 3.56Å; P151-F154 PolarHBondContact O-N 3.2Å; P151-F154 VanDerWaalsContact O-N 3.09Å; P151-Y159 HydrophobicContact CG-CD2 4.1Å; P151-Y159 HydrophobicContact CG-CE2 3.75Å
152	P	94.1	Very high	95.9	Very high	95 Å²	95	67.1 Å²	67.1	62%	0.617	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-29	179	-25.5	35.1	0	0	0	114.5	F154	P152-F154 VanDerWaalsContact C-N 3.34Å
153	N	95.8	Very high	97	Very high	142 Å²	142	63 Å²	63	76%	0.759	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.2	177.5	59.5	-49.9	0	0	0	113.1	P151	P151-N153 VanDerWaalsContact C-N 3.25Å; P151-N153 VanDerWaalsContact CB-OD1 3.29Å; P151-N153 WeakPolarHBondContact CB-OD1 3.31Å; P151-N153 PolarHBondContact O-N 3.09Å
154	F	96.3	Very high	97.4	Very high	87 Å²	87	62.7 Å²	62.7	38%	0.382	33%	0.329	S	S	.	.	S	Bend	trans	-138.2	69.6	175.9	-161.3	-119.3	0	0	0	110.2	P151 P152 T156 A157 Y177	P151-F154 HydrophobicContact CG-CB 4.2Å; P151-F154 CarbonylContact O-C 3.56Å; P151-F154 PolarHBondContact O-N 3.2Å; P151-F154 VanDerWaalsContact O-N 3.09Å; P152-F154 VanDerWaalsContact C-N 3.34Å; F154-T156 PolarHBondContact O-N 3.11Å; F154-A157 HydrophobicContact CD1-CB 3.36Å; F154-A157 HydrophobicContact CE1-CB 3.71Å; F154-A157 HydrophobicContact CG-CB 4.49Å; F154-A157 PolarHBondContact O-N 3.01Å; F154-A157 VanDerWaalsContact O-N 3.11Å; F154-Y177 AromaticContact CE1-CD2 3.73Å; F154-Y177 HydrophobicContact CE1-CD2 3.73Å; F154-Y177 HydrophobicContact CE1-CE2 4.01Å; F154-Y177 AromaticContact CZ-CD2 3.92Å; F154-Y177 HydrophobicContact CZ-CD2 3.92Å; F154-Y177 AromaticContact CZ-CE2 3.69Å; F154-Y177 HydrophobicContact CZ-CE2 3.69Å
155	P	95.6	Very high	97.5	Very high	53 Å²	53	61.9 Å²	61.9	34%	0.344	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-8.1	-162.8	28	-36.8	0	0	0	115	R174	P155-R174 WeakPolarHBondContact O-CD 3.25Å; P155-R174 PolarHBondContact O-NE 2.95Å
156	T	97.3	Very high	97.5	Very high	36 Å²	36	67 Å²	67	22%	0.221	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	3	178.4	55.8	0	0	0	0	113.2	F154 K176 Y177	F154-T156 PolarHBondContact O-N 3.11Å; T156-K176 HydrophobicContact CG2-CD 4.34Å; T156-K176 HydrophobicContact CG2-CG 4.35Å; T156-K176 PolarHBondContact O-N 3.03Å; T156-Y177 PolarHBondContact O-N 3.09Å; T156-Y177 VanDerWaalsContact O-N 3.13Å
157	A	98.4	Very high	97.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	149.3	172.9	0	0	0	0	0	112.8	F154 Y159 Y177 Y179	F154-A157 HydrophobicContact CD1-CB 3.36Å; F154-A157 HydrophobicContact CE1-CB 3.71Å; F154-A157 HydrophobicContact CG-CB 4.49Å; F154-A157 PolarHBondContact O-N 3.01Å; F154-A157 VanDerWaalsContact O-N 3.11Å; A157-Y159 HydrophobicContact CB-CD2 4.47Å; A157-Y159 HydrophobicContact CB-CE2 3.73Å; A157-Y177 VanDerWaalsContact CA-O 3.32Å; A157-Y177 WeakPolarHBondContact CA-O 3.26Å; A157-Y179 HydrophobicContact CB-CE2 4.48Å
158	M	98.5	Very high	97.7	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124	173.7	-170.1	174.2	70.2	0	0	110	P145 C148 V171 P172 M175 Y177 V178 Y179 F180	P145-M158 HydrophobicContact CG-SD 4.04Å; C148-M158 HydrophobicContact CB-CG 3.96Å; C148-M158 HydrophobicContact CB-SD 4.4Å; M158-V171 HydrophobicContact CE-CB 4.46Å; M158-V171 HydrophobicContact CE-CG1 4.19Å; M158-V171 HydrophobicContact CE-CG2 4.02Å; M158-P172 HydrophobicContact SD-CG 4.4Å; M158-M175 HydrophobicContact CB-CE 3.93Å; M158-M175 HydrophobicContact CB-CG 4.24Å; M158-M175 HydrophobicContact CB-SD 3.84Å; M158-M175 HydrophobicContact CG-CE 4.35Å; M158-M175 HydrophobicContact SD-CE 4.35Å; M158-Y177 PolarHBondContact N-O 3.29Å; M158-V178 HydrophobicContact CB-CG1 4.23Å; M158-V178 HydrophobicContact CE-CB 4.46Å; M158-V178 HydrophobicContact CE-CG1 3.99Å; M158-Y179 WeakPolarHBondContact O-CD2 3.41Å; M158-Y179 PolarHBondContact O-N 3.23Å; M158-F180 HydrophobicContact CE-CE1 3.84Å; M158-F180 HydrophobicContact CE-CE2 4.47Å; M158-F180 HydrophobicContact CE-CZ 3.44Å; M158-F180 VanDerWaalsContact CE-CZ 3.44Å
159	Y	98.8	Very high	97.7	Very high	79 Å²	79	61.2 Å²	61.2	31%	0.31	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	113.8	-177.7	-64.3	-90.1	0	0	0	110.3	C148 D149 P151 A157 Y179	C148-Y159 WeakPolarHBondContact CA-O 3.32Å; D149-Y159 PolarHBondContact N-O 3.03Å; D149-Y159 PolarHBondContact O-N 3.33Å; P151-Y159 HydrophobicContact CG-CD2 4.1Å; P151-Y159 HydrophobicContact CG-CE2 3.75Å; A157-Y159 HydrophobicContact CB-CD2 4.47Å; A157-Y159 HydrophobicContact CB-CE2 3.73Å; Y159-Y179 AromaticContact CD1-CD2 3.56Å; Y159-Y179 HydrophobicContact CD1-CD2 3.56Å; Y159-Y179 HydrophobicContact CD1-CE2 4.17Å; Y159-Y179 HydrophobicContact CD1-CG 4.08Å; Y159-Y179 AromaticContact CE1-CD2 3.48Å; Y159-Y179 HydrophobicContact CE1-CD2 3.48Å; Y159-Y179 VanDerWaalsContact CE1-CD2 3.48Å; Y159-Y179 AromaticContact CE1-CE2 3.59Å; Y159-Y179 HydrophobicContact CE1-CE2 3.59Å; Y159-Y179 HydrophobicContact CE1-CG 4.18Å; Y159-Y179 HydrophobicContact CG-CD2 4.19Å; Y159-Y179 AromaticContact CZ-CE2 3.82Å
160	C	98.8	Very high	97.7	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.313	C	S	.	.			trans	-129.8	13.5	-179.9	-50.7	0	0	0	0	111	C148 L165 Y179 F180 N183	C148-C160 HydrophobicContact CB-CB 4.17Å; C148-C160 WeakPolarHBondContact CB-SG 3.42Å; C148-C160 WeakPolarHBondContact SG-CB 3.34Å; C148-C160 CovalentContact SG-SG 2.03Å; C148-C160 PolarHBondContact SG-SG 3.28Å; C160-L165 HydrophobicContact CB-CD1 3.7Å; C160-L165 VanDerWaalsContact O-CD1 3.26Å; C160-L165 WeakPolarHBondContact O-CD1 3.42Å; C160-Y179 CarbonylContact C-O 3.07Å; C160-Y179 VanDerWaalsContact C-O 3.28Å; C160-Y179 VanDerWaalsContact CA-O 3.26Å; C160-Y179 WeakPolarHBondContact CA-O 3.26Å; C160-Y179 VanDerWaalsContact CB-O 3.3Å; C160-Y179 WeakPolarHBondContact CB-O 3.2Å; C160-Y179 PolarHBondContact N-O 2.79Å; C160-F180 HydrophobicContact CB-CD1 3.44Å; C160-F180 VanDerWaalsContact CB-CD1 3.44Å; C160-F180 HydrophobicContact CB-CE1 3.72Å; C160-F180 HydrophobicContact CB-CG 4.45Å; C160-F180 WeakPolarHBondContact SG-CE1 3.43Å; C160-N183 PolarHBondContact O-ND2 3.12Å
161	D	98.6	Very high	97.7	Very high	42 Å²	42	61.7 Å²	61.7	23%	0.225	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	150.5	-176.2	60.3	-59.6	0	0	0	113.1	R163 Y179 Q181	D161-R163 VanDerWaalsContact C-N 3.29Å; D161-R163 WeakPolarHBondContact O-CG 3.02Å; D161-R163 PolarHBondContact O-N 2.78Å; D161-R163 VanDerWaalsContact O-N 3.14Å; D161-R163 PolarHBondContact O-NH1 2.98Å; D161-R163 IonicContact OD1-NH1 3.3Å; D161-R163 PolarHBondContact OD1-NH1 3.32Å; D161-Y179 PolarHBondContact N-O 3Å; D161-Y179 VanDerWaalsContact N-O 3.16Å; D161-Q181 CarbonylContact C-O 3.58Å; D161-Q181 VanDerWaalsContact CA-O 3.25Å; D161-Q181 WeakPolarHBondContact CA-O 3.1Å; D161-Q181 VanDerWaalsContact CB-CD 3.45Å; D161-Q181 HydrophobicContact CB-CG 3.89Å
162	N	98.4	Very high	97.7	Very high	120 Å²	120	61.2 Å²	61.2	64%	0.642	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.8	172.5	-163.6	39.4	0	0	0	115.7	Q181 N182	N162-Q181 PolarHBondContact N-O 3.48Å; N162-N182 VanDerWaalsContact CA-O 3.31Å; N162-N182 WeakPolarHBondContact CA-O 3.32Å; N162-N182 HydrophobicContact CB-CB 4.48Å
163	R	98.4	Very high	97.9	Very high	82 Å²	82	60.4 Å²	60.4	31%	0.309	30%	0.298	S	S	.	.	S	Bend	trans	-118.1	10.9	-174.3	-79.6	168.1	-176.4	86.2	-7.1	113.5	E147 D149 D161 L165 N183	E147-R163 WeakPolarHBondContact O-CD 3.5Å; D149-R163 IonicContact OD2-CZ 2.67Å; D149-R163 IonicContact OD2-NE 3.26Å; D149-R163 IonicContact OD2-NH2 2.93Å; D149-R163 PolarHBondContact OD2-NH2 3.15Å; D161-R163 VanDerWaalsContact C-N 3.29Å; D161-R163 WeakPolarHBondContact O-CG 3.02Å; D161-R163 PolarHBondContact O-N 2.78Å; D161-R163 VanDerWaalsContact O-N 3.14Å; D161-R163 PolarHBondContact O-NH1 2.98Å; D161-R163 IonicContact OD1-NH1 3.3Å; D161-R163 PolarHBondContact OD1-NH1 3.32Å; R163-L165 HydrophobicContact CB-CD2 4.07Å; R163-L165 HydrophobicContact CB-CG 3.92Å; R163-L165 PolarHBondContact O-N 3.46Å; R163-N183 PolarHBondContact N-OD1 3.42Å
164	N	98.4	Very high	97.9	Very high	105 Å²	105	55.7 Å²	55.7	56%	0.561	27%	0.27	S	S	*	.			trans	57.5	29.3	-174.8	-57.7	-66.1	0	0	0	114	N183 Q184	N164-N183 PolarHBondContact N-OD1 2.9Å; N164-Q184 VanDerWaalsContact C-OE1 3.31Å; N164-Q184 VanDerWaalsContact CB-OE1 3.3Å; N164-Q184 PolarHBondContact O-OE1 3.02Å; N164-Q184 PolarHBondContact OD1-NE2 2.82Å; N164-Q184 PolarHBondContact OD1-OE1 3.11Å
165	L	98.5	Very high	98	Very high	21 Å²	21	51.5 Å²	51.5	11%	0.11	25%	0.252	C	S	.	.			trans	-63.6	140.7	179.3	-58.6	-175.4	0	0	0	110.5	E147 C160 R163 N183 Q184 I185	E147-L165 HydrophobicContact CB-CD2 3.93Å; E147-L165 HydrophobicContact CG-CD2 4.23Å; C160-L165 HydrophobicContact CB-CD1 3.7Å; C160-L165 VanDerWaalsContact O-CD1 3.26Å; C160-L165 WeakPolarHBondContact O-CD1 3.42Å; R163-L165 HydrophobicContact CB-CD2 4.07Å; R163-L165 HydrophobicContact CB-CG 3.92Å; R163-L165 PolarHBondContact O-N 3.46Å; L165-N183 HydrophobicContact CB-CB 4.13Å; L165-N183 PolarHBondContact N-OD1 3.08Å; L165-Q184 CarbonylContact O-C 3.56Å; L165-Q184 WeakPolarHBondContact O-CA 3.35Å; L165-Q184 PolarHBondContact O-N 3.22Å; L165-I185 HydrophobicContact CB-CG1 4.4Å; L165-I185 PolarHBondContact O-N 3.45Å
166	K	98.2	Very high	98.1	Very high	127 Å²	127	53.6 Å²	53.6	55%	0.552	26%	0.255	S	S	*	.	S	Bend	trans	-102.1	-18	179.2	-55.1	-53.2	-174.6	-171.7	0	113.1	Q184	K166-Q184 HydrophobicContact CD-CB 3.95Å
167	Y	98.3	Very high	98.2	Very high	132 Å²	132	54.3 Å²	54.3	52%	0.518	25%	0.254	S	S	.	.	S	Bend	trans	-144.9	163.6	-177.2	64.1	-94.6	0	0	0	109.7	E147	E147-Y167 WeakPolarHBondContact OE1-CE2 3.17Å; E147-Y167 PolarHBondContact OE1-OH 3.1Å
168	L	98.6	Very high	98.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-88.5	128.4	173.2	-69.1	171.4	0	0	0	110.4	F180 I185 I188 Q189 V192 F193 L204	L168-F180 HydrophobicContact CD2-CB 3.78Å; L168-F180 HydrophobicContact CD2-CD1 3.38Å; L168-F180 HydrophobicContact CD2-CD2 3.65Å; L168-F180 HydrophobicContact CD2-CE1 3.76Å; L168-F180 HydrophobicContact CD2-CE2 3.96Å; L168-F180 HydrophobicContact CD2-CG 3.33Å; L168-F180 HydrophobicContact CD2-CZ 4.02Å; L168-I185 HydrophobicContact CD2-CD1 3.61Å; L168-I185 HydrophobicContact CG-CD1 4.21Å; L168-I185 HydrophobicContact CG-CG2 4.09Å; L168-I188 HydrophobicContact CD1-CB 4.29Å; L168-I188 HydrophobicContact CD1-CG1 4.2Å; L168-I188 HydrophobicContact CD1-CG2 3.94Å; L168-Q189 PolarHBondContact O-NE2 3.21Å; L168-V192 HydrophobicContact CB-CG2 3.88Å; L168-F193 HydrophobicContact CD1-CZ 4.31Å; L168-L204 HydrophobicContact CD1-CD2 3.85Å; L168-L204 HydrophobicContact CD2-CD2 3.67Å; L168-L204 HydrophobicContact CG-CD2 4.3Å
169	P	98.1	Very high	98.3	Very high	10 Å²	10	56.3 Å²	56.3	7%	0.065	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-70	155.3	165.8	29.1	-33	0	0	0	110.7	P145 E147 V171 F180 V192	P145-P169 HydrophobicContact CB-CB 3.79Å; P145-P169 HydrophobicContact CB-CG 4.12Å; P145-P169 HydrophobicContact CG-CB 3.8Å; P145-P169 HydrophobicContact CG-CG 4.12Å; E147-P169 HydrophobicContact CG-CG 4.3Å; P169-V171 PolarHBondContact O-N 3.29Å; P169-F180 HydrophobicContact CG-CE1 4.08Å; P169-V192 WeakPolarHBondContact O-CG2 3.32Å
170	F	98.1	Very high	98.3	Very high	132 Å²	132	52.5 Å²	52.5	58%	0.579	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-63.6	133.2	172.5	-75.7	-82.6	0	0	0	110.4	P172	F170-P172 WeakPolarHBondContact O-CD 3.32Å
171	V	98.2	Very high	98.3	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.024	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-82.3	126.9	-174.2	-176.4	0	0	0	0	110.7	M158 P169 M175 V178 F180 V192 F193 A196	M158-V171 HydrophobicContact CE-CB 4.46Å; M158-V171 HydrophobicContact CE-CG1 4.19Å; M158-V171 HydrophobicContact CE-CG2 4.02Å; P169-V171 PolarHBondContact O-N 3.29Å; V171-M175 HydrophobicContact CG1-CB 3.61Å; V171-M175 HydrophobicContact CG1-CG 3.74Å; V171-V178 HydrophobicContact CG1-CG1 3.71Å; V171-V178 HydrophobicContact CG2-CG1 4.42Å; V171-F180 HydrophobicContact CG2-CE2 4.42Å; V171-F180 HydrophobicContact CG2-CZ 4.04Å; V171-V192 PolarHBondContact N-O 3.39Å; V171-V192 VanDerWaalsContact N-O 3.11Å; V171-F193 HydrophobicContact CB-CD1 4.44Å; V171-F193 HydrophobicContact CG2-CD1 3.65Å; V171-F193 HydrophobicContact CG2-CE1 3.9Å; V171-A196 HydrophobicContact CB-CB 4.03Å; V171-A196 HydrophobicContact CG1-CB 3.6Å
172	P	97.4	Very high	98.3	Very high	18 Å²	18	55.8 Å²	55.8	12%	0.117	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-59.4	146.6	173.8	-24.4	34.3	0	0	0	112.6	M158 F170 R174 M175 A196	M158-P172 HydrophobicContact SD-CG 4.4Å; F170-P172 WeakPolarHBondContact O-CD 3.32Å; P172-R174 PolarHBondContact O-N 3.02Å; P172-R174 VanDerWaalsContact O-N 3.12Å; P172-M175 HydrophobicContact CB-CE 4.12Å; P172-M175 HydrophobicContact CB-CG 4.23Å; P172-M175 HydrophobicContact CG-CE 3.99Å; P172-M175 HydrophobicContact CG-CG 4.46Å; P172-M175 WeakPolarHBondContact O-CG 3.49Å; P172-M175 PolarHBondContact O-N 2.89Å; P172-M175 VanDerWaalsContact O-N 3.15Å; P172-A196 WeakPolarHBondContact O-CB 3.46Å
173	S	97	Very high	98.3	Very high	78 Å²	78	50.4 Å²	50.4	55%	0.545	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.8	-172	53.4	0	0	0	0	115.3	M175 N195	S173-M175 VanDerWaalsContact C-N 3.27Å; S173-M175 PolarHBondContact O-N 3.46Å; S173-N195 VanDerWaalsContact CA-O 3.29Å; S173-N195 WeakPolarHBondContact CA-O 3.45Å; S173-N195 VanDerWaalsContact CB-O 3.29Å; S173-N195 WeakPolarHBondContact CB-O 3.42Å
174	R	96.4	Very high	98.3	Very high	42 Å²	42	48.4 Å²	48.4	16%	0.158	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.1	-178.8	71.9	178.9	-174	-80.6	-7.5	114.5	P141 D143 P155 P172	P141-R174 PolarHBondContact O-NH1 2.72Å; D143-R174 VanDerWaalsContact O-CZ 3.27Å; D143-R174 PolarHBondContact O-NH1 2.96Å; D143-R174 PolarHBondContact O-NH2 2.03Å; P155-R174 WeakPolarHBondContact O-CD 3.25Å; P155-R174 PolarHBondContact O-NE 2.95Å; P172-R174 PolarHBondContact O-N 3.02Å; P172-R174 VanDerWaalsContact O-N 3.12Å
175	M	98.2	Very high	98.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.202	C	C	.	.			trans	-73.8	135.5	-172	-61.2	-54.5	173.3	0	0	112.1	C150 M158 V171 P172 S173 V178 L199	C150-M175 HydrophobicContact CB-CE 4.4Å; C150-M175 VanDerWaalsContact SG-CE 3.59Å; M158-M175 HydrophobicContact CB-CE 3.93Å; M158-M175 HydrophobicContact CB-CG 4.24Å; M158-M175 HydrophobicContact CB-SD 3.84Å; M158-M175 HydrophobicContact CG-CE 4.35Å; M158-M175 HydrophobicContact SD-CE 4.35Å; V171-M175 HydrophobicContact CG1-CB 3.61Å; V171-M175 HydrophobicContact CG1-CG 3.74Å; P172-M175 HydrophobicContact CB-CE 4.12Å; P172-M175 HydrophobicContact CB-CG 4.23Å; P172-M175 HydrophobicContact CG-CE 3.99Å; P172-M175 HydrophobicContact CG-CG 4.46Å; P172-M175 WeakPolarHBondContact O-CG 3.49Å; P172-M175 PolarHBondContact O-N 2.89Å; P172-M175 VanDerWaalsContact O-N 3.15Å; S173-M175 VanDerWaalsContact C-N 3.27Å; S173-M175 PolarHBondContact O-N 3.46Å; M175-V178 HydrophobicContact CB-CG1 3.96Å; M175-V178 HydrophobicContact CG-CG1 4.42Å; M175-L199 HydrophobicContact CB-CD2 4.24Å
176	K	98.6	Very high	98.3	Very high	96 Å²	96	44.4 Å²	44.4	42%	0.417	21%	0.21	S	C	.	.	S	Bend	trans	-111.9	-28.2	170.9	-64.7	-171.6	178.7	-177.1	0	112.1	T156 L200 W201	T156-K176 HydrophobicContact CG2-CD 4.34Å; T156-K176 HydrophobicContact CG2-CG 4.35Å; T156-K176 PolarHBondContact O-N 3.03Å; K176-L200 HydrophobicContact CB-CD1 4.47Å; K176-L200 HydrophobicContact CB-CG 4.4Å; K176-L200 HydrophobicContact CD-CD1 4.39Å; K176-L200 PolarHBondContact O-N 3.06Å; K176-W201 PolarHBondContact O-N 3.43Å; K176-W201 VanDerWaalsContact O-N 3.14Å
177	Y	98.9	Very high	98.3	Very high	52 Å²	52	40 Å²	40	20%	0.204	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122.7	-176.7	-47.7	-83.8	0	0	0	109.5	F154 T156 A157 M158 L200 W201	F154-Y177 AromaticContact CE1-CD2 3.73Å; F154-Y177 HydrophobicContact CE1-CD2 3.73Å; F154-Y177 HydrophobicContact CE1-CE2 4.01Å; F154-Y177 AromaticContact CZ-CD2 3.92Å; F154-Y177 HydrophobicContact CZ-CD2 3.92Å; F154-Y177 AromaticContact CZ-CE2 3.69Å; F154-Y177 HydrophobicContact CZ-CE2 3.69Å; T156-Y177 PolarHBondContact O-N 3.09Å; T156-Y177 VanDerWaalsContact O-N 3.13Å; A157-Y177 VanDerWaalsContact CA-O 3.32Å; A157-Y177 WeakPolarHBondContact CA-O 3.26Å; M158-Y177 PolarHBondContact N-O 3.29Å; Y177-L200 HydrophobicContact CE1-CB 4.32Å; Y177-L200 HydrophobicContact CE1-CD1 4.25Å; Y177-W201 HydrophobicContact CD1-CB 3.94Å; Y177-W201 AromaticContact CD1-CD2 3.84Å; Y177-W201 HydrophobicContact CD1-CD2 3.84Å; Y177-W201 HydrophobicContact CD1-CE3 4.24Å; Y177-W201 AromaticContact CD1-CG 3.71Å; Y177-W201 HydrophobicContact CD1-CG 3.71Å; Y177-W201 HydrophobicContact CE1-CD2 4.14Å; Y177-W201 HydrophobicContact CE1-CG 4.11Å
178	V	98.9	Very high	98.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.6	179.2	-62.6	0	0	0	0	111.2	M158 V171 M175 F180 L199 W201 I202 A203	M158-V178 HydrophobicContact CB-CG1 4.23Å; M158-V178 HydrophobicContact CE-CB 4.46Å; M158-V178 HydrophobicContact CE-CG1 3.99Å; V171-V178 HydrophobicContact CG1-CG1 3.71Å; V171-V178 HydrophobicContact CG2-CG1 4.42Å; M175-V178 HydrophobicContact CB-CG1 3.96Å; M175-V178 HydrophobicContact CG-CG1 4.42Å; V178-F180 HydrophobicContact CB-CD2 4.25Å; V178-F180 HydrophobicContact CB-CE2 3.58Å; V178-F180 HydrophobicContact CB-CZ 4.11Å; V178-F180 HydrophobicContact CG1-CE2 4.46Å; V178-F180 HydrophobicContact CG2-CD2 4.14Å; V178-F180 HydrophobicContact CG2-CE2 3.56Å; V178-F180 HydrophobicContact CG2-CZ 4.47Å; V178-L199 HydrophobicContact CB-CD2 4.42Å; V178-L199 HydrophobicContact CG1-CD2 3.69Å; V178-L199 HydrophobicContact CG2-CD2 3.92Å; V178-W201 PolarHBondContact N-O 3.33Å; V178-W201 VanDerWaalsContact N-O 3.13Å; V178-I202 HydrophobicContact CG2-CB 4.2Å; V178-I202 HydrophobicContact CG2-CG1 3.8Å; V178-I202 HydrophobicContact CG2-CG2 4.23Å; V178-A203 PolarHBondContact O-N 3.43Å
179	Y	98.9	Very high	98.3	Very high	41 Å²	41	36.2 Å²	36.2	16%	0.161	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	109.4	-173	-58.3	-79.9	0	0	0	109.8	A157 M158 Y159 C160 D161 Q181 A203	A157-Y179 HydrophobicContact CB-CE2 4.48Å; M158-Y179 WeakPolarHBondContact O-CD2 3.41Å; M158-Y179 PolarHBondContact O-N 3.23Å; Y159-Y179 AromaticContact CD1-CD2 3.56Å; Y159-Y179 HydrophobicContact CD1-CD2 3.56Å; Y159-Y179 HydrophobicContact CD1-CE2 4.17Å; Y159-Y179 HydrophobicContact CD1-CG 4.08Å; Y159-Y179 AromaticContact CE1-CD2 3.48Å; Y159-Y179 HydrophobicContact CE1-CD2 3.48Å; Y159-Y179 VanDerWaalsContact CE1-CD2 3.48Å; Y159-Y179 AromaticContact CE1-CE2 3.59Å; Y159-Y179 HydrophobicContact CE1-CE2 3.59Å; Y159-Y179 HydrophobicContact CE1-CG 4.18Å; Y159-Y179 HydrophobicContact CG-CD2 4.19Å; Y159-Y179 AromaticContact CZ-CE2 3.82Å; C160-Y179 CarbonylContact C-O 3.07Å; C160-Y179 VanDerWaalsContact C-O 3.28Å; C160-Y179 VanDerWaalsContact CA-O 3.26Å; C160-Y179 WeakPolarHBondContact CA-O 3.26Å; C160-Y179 VanDerWaalsContact CB-O 3.3Å; C160-Y179 WeakPolarHBondContact CB-O 3.2Å; C160-Y179 PolarHBondContact N-O 2.79Å; D161-Y179 PolarHBondContact N-O 3Å; D161-Y179 VanDerWaalsContact N-O 3.16Å; Y179-Q181 VanDerWaalsContact CB-OE1 3.31Å; Y179-A203 HydrophobicContact CD1-CB 4.1Å
180	F	98.9	Very high	98.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.209	C	C	.	.			trans	-123.2	12.3	-179.6	-58.7	-74.8	0	0	0	112.3	M158 C160 L168 P169 V171 V178 N183 I185 F193 A203 L204 N207	M158-F180 HydrophobicContact CE-CE1 3.84Å; M158-F180 HydrophobicContact CE-CE2 4.47Å; M158-F180 HydrophobicContact CE-CZ 3.44Å; M158-F180 VanDerWaalsContact CE-CZ 3.44Å; C160-F180 HydrophobicContact CB-CD1 3.44Å; C160-F180 VanDerWaalsContact CB-CD1 3.44Å; C160-F180 HydrophobicContact CB-CE1 3.72Å; C160-F180 HydrophobicContact CB-CG 4.45Å; C160-F180 WeakPolarHBondContact SG-CE1 3.43Å; L168-F180 HydrophobicContact CD2-CB 3.78Å; L168-F180 HydrophobicContact CD2-CD1 3.38Å; L168-F180 HydrophobicContact CD2-CD2 3.65Å; L168-F180 HydrophobicContact CD2-CE1 3.76Å; L168-F180 HydrophobicContact CD2-CE2 3.96Å; L168-F180 HydrophobicContact CD2-CG 3.33Å; L168-F180 HydrophobicContact CD2-CZ 4.02Å; P169-F180 HydrophobicContact CG-CE1 4.08Å; V171-F180 HydrophobicContact CG2-CE2 4.42Å; V171-F180 HydrophobicContact CG2-CZ 4.04Å; V178-F180 HydrophobicContact CB-CD2 4.25Å; V178-F180 HydrophobicContact CB-CE2 3.58Å; V178-F180 HydrophobicContact CB-CZ 4.11Å; V178-F180 HydrophobicContact CG1-CE2 4.46Å; V178-F180 HydrophobicContact CG2-CD2 4.14Å; V178-F180 HydrophobicContact CG2-CE2 3.56Å; V178-F180 HydrophobicContact CG2-CZ 4.47Å; F180-N183 PolarHBondContact O-ND2 3.42Å; F180-I185 HydrophobicContact CB-CD1 4.03Å; F180-F193 HydrophobicContact CE2-CE1 4.33Å; F180-A203 CarbonylContact C-O 3.14Å; F180-A203 WeakPolarHBondContact CA-O 3.31Å; F180-A203 WeakPolarHBondContact CB-O 3.11Å; F180-A203 PolarHBondContact N-O 3.16Å; F180-L204 HydrophobicContact CB-CD2 3.79Å; F180-L204 HydrophobicContact CD2-CD2 4.02Å; F180-L204 HydrophobicContact CG-CD2 4.22Å; F180-N207 PolarHBondContact O-ND2 3.13Å
181	Q	98.8	Very high	98.2	Very high	27 Å²	27	36.8 Å²	36.8	13%	0.126	19%	0.19	C	C	.	.			trans	-65.1	157.8	-174.9	66.6	-84.1	9.4	0	0	113.7	D161 N162 Y179 N183 A203 H205	D161-Q181 CarbonylContact C-O 3.58Å; D161-Q181 VanDerWaalsContact CA-O 3.25Å; D161-Q181 WeakPolarHBondContact CA-O 3.1Å; D161-Q181 VanDerWaalsContact CB-CD 3.45Å; D161-Q181 HydrophobicContact CB-CG 3.89Å; N162-Q181 PolarHBondContact N-O 3.48Å; Y179-Q181 VanDerWaalsContact CB-OE1 3.31Å; Q181-N183 PolarHBondContact O-N 2.99Å; Q181-N183 PolarHBondContact O-ND2 3.31Å; Q181-A203 PolarHBondContact N-O 2.8Å; Q181-H205 CarbonylContact C-O 3.44Å; Q181-H205 WeakPolarHBondContact CA-O 3.41Å; Q181-H205 VanDerWaalsContact CB-CD2 3.41Å; Q181-H205 WeakPolarHBondContact CB-CD2 3.3Å; Q181-H205 WeakPolarHBondContact CB-NE2 3.31Å; Q181-H205 VanDerWaalsContact CB-O 3.31Å; Q181-H205 WeakPolarHBondContact CB-O 3.39Å; Q181-H205 WeakPolarHBondContact CG-NE2 3.5Å
182	N	98.8	Very high	98.2	Very high	84 Å²	84	36.6 Å²	36.6	45%	0.449	19%	0.189	S	C	.	.	S	Bend	trans	58.1	48.2	174.1	-57	-35.9	0	0	0	112.9	N162 H205 G206	N162-N182 VanDerWaalsContact CA-O 3.31Å; N162-N182 WeakPolarHBondContact CA-O 3.32Å; N162-N182 HydrophobicContact CB-CB 4.48Å; N182-H205 PolarHBondContact N-O 3.13Å; N182-G206 CarbonylContact C-O 3.46Å; N182-G206 WeakPolarHBondContact CA-O 3.45Å; N182-G206 PolarHBondContact N-O 3.15Å
183	N	98.8	Very high	98.3	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	18%	0.183	C	C	.	.	S	Bend	trans	-121.4	-164.6	176.2	-79.1	-64.4	0	0	0	109.8	C160 R163 N164 L165 F180 Q181 I185 G206 N207	C160-N183 PolarHBondContact O-ND2 3.12Å; R163-N183 PolarHBondContact N-OD1 3.42Å; N164-N183 PolarHBondContact N-OD1 2.9Å; L165-N183 HydrophobicContact CB-CB 4.13Å; L165-N183 PolarHBondContact N-OD1 3.08Å; F180-N183 PolarHBondContact O-ND2 3.42Å; Q181-N183 PolarHBondContact O-N 2.99Å; Q181-N183 PolarHBondContact O-ND2 3.31Å; N183-I185 HydrophobicContact CB-CD1 3.95Å; N183-I185 HydrophobicContact CB-CG1 4.05Å; N183-G206 PolarHBondContact N-O 3.48Å; N183-N207 VanDerWaalsContact CA-OD1 3.32Å; N183-N207 WeakPolarHBondContact CA-OD1 3.32Å; N183-N207 WeakPolarHBondContact CB-OD1 3.17Å; N183-N207 PolarHBondContact N-OD1 3.41Å; N183-N207 PolarHBondContact O-OD1 3.4Å
184	Q	98.7	Very high	98.3	Very high	39 Å²	39	34.6 Å²	34.6	18%	0.182	17%	0.171	C	C	.	.			trans	-121.8	41.4	173.6	-54.2	90.4	45	0	0	110.7	N164 L165 K166 N207	N164-Q184 VanDerWaalsContact C-OE1 3.31Å; N164-Q184 VanDerWaalsContact CB-OE1 3.3Å; N164-Q184 PolarHBondContact O-OE1 3.02Å; N164-Q184 PolarHBondContact OD1-NE2 2.82Å; N164-Q184 PolarHBondContact OD1-OE1 3.11Å; L165-Q184 CarbonylContact O-C 3.56Å; L165-Q184 WeakPolarHBondContact O-CA 3.35Å; L165-Q184 PolarHBondContact O-N 3.22Å; K166-Q184 HydrophobicContact CD-CB 3.95Å; Q184-N207 PolarHBondContact N-OD1 2.97Å
185	I	98.8	Very high	98.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.			trans	-71.9	132.7	177.9	-63.5	158.8	0	0	0	108.5	L165 L168 F180 N183 S187 N207 Q208 I209	L165-I185 HydrophobicContact CB-CG1 4.4Å; L165-I185 PolarHBondContact O-N 3.45Å; L168-I185 HydrophobicContact CD2-CD1 3.61Å; L168-I185 HydrophobicContact CG-CD1 4.21Å; L168-I185 HydrophobicContact CG-CG2 4.09Å; F180-I185 HydrophobicContact CB-CD1 4.03Å; N183-I185 HydrophobicContact CB-CD1 3.95Å; N183-I185 HydrophobicContact CB-CG1 4.05Å; I185-S187 WeakPolarHBondContact CG2-O 3.37Å; I185-N207 HydrophobicContact CB-CB 4.35Å; I185-N207 WeakPolarHBondContact CB-OD1 3.41Å; I185-N207 PolarHBondContact N-OD1 2.95Å; I185-Q208 CarbonylContact O-C 3.28Å; I185-Q208 VanDerWaalsContact O-C 3.24Å; I185-Q208 WeakPolarHBondContact O-CA 3.5Å; I185-Q208 PolarHBondContact O-N 2.74Å; I185-I209 HydrophobicContact CG2-CG1 4.22Å; I185-I209 PolarHBondContact O-N 3.34Å
186	T	98.5	Very high	98.2	Very high	43 Å²	43	38.1 Å²	38.1	26%	0.264	19%	0.193	S	C	.	.			trans	-111.7	-9.6	-179	66.9	0	0	0	0	114.3	Q208 K213	T186-Q208 WeakPolarHBondContact CA-O 3.18Å; T186-Q208 HydrophobicContact CG2-CB 4.14Å; T186-K213 WeakPolarHBondContact O-CB 3.4Å; T186-K213 WeakPolarHBondContact O-CD 3.38Å; T186-K213 PolarHBondContact OG1-NZ 2.82Å
187	S	98.4	Very high	98.1	Very high	34 Å²	34	37.2 Å²	37.2	24%	0.238	20%	0.195	C	C	.	.			trans	-148.3	148.7	-173.2	58.7	0	0	0	0	111.9	I185 K213	I185-S187 WeakPolarHBondContact CG2-O 3.37Å; S187-K213 WeakPolarHBondContact CA-O 3.43Å
188	I	98.6	Very high	98.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-111.7	98.5	167.3	-50.3	175.3	0	0	0	106.4	L168 V192 F193 L204 I209 K213 V214 G215 V218 F219 L230	L168-I188 HydrophobicContact CD1-CB 4.29Å; L168-I188 HydrophobicContact CD1-CG1 4.2Å; L168-I188 HydrophobicContact CD1-CG2 3.94Å; I188-V192 HydrophobicContact CG2-CG1 3.9Å; I188-F193 HydrophobicContact CG2-CE2 3.81Å; I188-F193 HydrophobicContact CG2-CZ 4.22Å; I188-L204 HydrophobicContact CD1-CD1 3.79Å; I188-L204 HydrophobicContact CG1-CD1 4.42Å; I188-I209 HydrophobicContact CD1-CD1 4.16Å; I188-I209 HydrophobicContact CD1-CG2 4.29Å; I188-I209 HydrophobicContact CG1-CD1 4.03Å; I188-I209 HydrophobicContact CG1-CG2 4.11Å; I188-K213 PolarHBondContact N-O 3.07Å; I188-V214 HydrophobicContact CD1-CG1 4.49Å; I188-V214 HydrophobicContact CD1-CG2 4.41Å; I188-G215 WeakPolarHBondContact O-CA 3.33Å; I188-G215 PolarHBondContact O-N 3.43Å; I188-V218 HydrophobicContact CG2-CG1 4.2Å; I188-V218 HydrophobicContact CG2-CG2 3.82Å; I188-F219 HydrophobicContact CD1-CZ 3.95Å; I188-L230 HydrophobicContact CD1-CD2 4.11Å
189	Q	97.9	Very high	98.1	Very high	54 Å²	54	36 Å²	36	25%	0.252	20%	0.198	S	C	.	.			trans	-69	153.4	-175	71.3	-82.6	15	0	0	112.6	L168 V192	L168-Q189 PolarHBondContact O-NE2 3.21Å; Q189-V192 HydrophobicContact CG-CB 4.1Å; Q189-V192 WeakPolarHBondContact O-CG1 3.37Å; Q189-V192 PolarHBondContact O-N 3.4Å
190	E	97	Very high	98.1	Very high	137 Å²	137	35.7 Å²	35.7	64%	0.64	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	137.5	177.5	-171.3	169.7	177.1	0	0	111.1	V192	E190-V192 VanDerWaalsContact C-N 3.29Å; E190-V192 PolarHBondContact O-N 3.19Å
191	G	96.6	Very high	98.1	Very high	16 Å²	16	39.3 Å²	39.3	17%	0.165	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	-0.1	177.3	0	0	0	0	0	116.3	F193 D194	G191-F193 PolarHBondContact O-N 3.4Å; G191-D194 WeakPolarHBondContact O-CB 3.2Å; G191-D194 PolarHBondContact O-N 3.48Å
192	V	98.4	Very high	98.1	Very high	1 Å²	1	38 Å²	38	1%	0.006	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.1	-176.8	68.2	0	0	0	0	113.9	L168 P169 V171 I188 Q189 E190 V218	L168-V192 HydrophobicContact CB-CG2 3.88Å; P169-V192 WeakPolarHBondContact O-CG2 3.32Å; V171-V192 PolarHBondContact N-O 3.39Å; V171-V192 VanDerWaalsContact N-O 3.11Å; I188-V192 HydrophobicContact CG2-CG1 3.9Å; Q189-V192 HydrophobicContact CG-CB 4.1Å; Q189-V192 WeakPolarHBondContact O-CG1 3.37Å; Q189-V192 PolarHBondContact O-N 3.4Å; E190-V192 VanDerWaalsContact C-N 3.29Å; E190-V192 PolarHBondContact O-N 3.19Å; V192-V218 HydrophobicContact CG1-CG2 3.92Å
193	F	98.3	Very high	98.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	4.4	179.9	-50.5	-56.4	0	0	0	114.1	L168 V171 F180 I188 G191 N195 A196 L199 I202 L204 V218 F219 L222	L168-F193 HydrophobicContact CD1-CZ 4.31Å; V171-F193 HydrophobicContact CB-CD1 4.44Å; V171-F193 HydrophobicContact CG2-CD1 3.65Å; V171-F193 HydrophobicContact CG2-CE1 3.9Å; F180-F193 HydrophobicContact CE2-CE1 4.33Å; I188-F193 HydrophobicContact CG2-CE2 3.81Å; I188-F193 HydrophobicContact CG2-CZ 4.22Å; G191-F193 PolarHBondContact O-N 3.4Å; F193-N195 VanDerWaalsContact C-N 3.28Å; F193-N195 PolarHBondContact O-N 3.11Å; F193-A196 PolarHBondContact O-N 3.24Å; F193-A196 VanDerWaalsContact O-N 3.08Å; F193-L199 HydrophobicContact CB-CD1 4Å; F193-L199 HydrophobicContact CD1-CD1 3.81Å; F193-L199 HydrophobicContact CG-CD1 4.13Å; F193-I202 HydrophobicContact CD1-CD1 4.44Å; F193-I202 HydrophobicContact CD2-CD1 4.32Å; F193-I202 HydrophobicContact CE1-CD1 4.34Å; F193-I202 HydrophobicContact CE2-CD1 4.22Å; F193-I202 HydrophobicContact CG-CD1 4.45Å; F193-I202 HydrophobicContact CZ-CD1 4.23Å; F193-I202 HydrophobicContact CZ-CG2 4.25Å; F193-L204 HydrophobicContact CZ-CD1 4.45Å; F193-V218 HydrophobicContact CD2-CG2 3.89Å; F193-V218 HydrophobicContact CE2-CG2 4.13Å; F193-F219 HydrophobicContact CD2-CD1 4.3Å; F193-F219 HydrophobicContact CD2-CE1 4.29Å; F193-F219 HydrophobicContact CE2-CD1 4.21Å; F193-F219 AromaticContact CE2-CE1 3.74Å; F193-F219 HydrophobicContact CE2-CE1 3.74Å; F193-L222 HydrophobicContact CB-CD1 4.02Å; F193-L222 HydrophobicContact CB-CD2 3.91Å; F193-L222 HydrophobicContact CB-CG 4.37Å; F193-L222 HydrophobicContact CD2-CD1 4.18Å; F193-L222 HydrophobicContact CG-CD1 4.22Å
194	D	97.2	Very high	98.1	Very high	53 Å²	53	33.9 Å²	33.9	28%	0.283	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.8	-168.2	-86.9	14	0	0	0	114	G191 T197 K221	G191-D194 WeakPolarHBondContact O-CB 3.2Å; G191-D194 PolarHBondContact O-N 3.48Å; D194-T197 WeakPolarHBondContact O-CG2 3.49Å; D194-K221 HydrophobicContact CB-CD 4.37Å; D194-K221 VanDerWaalsContact CG-NZ 3.32Å; D194-K221 IonicContact OD1-NZ 2.95Å; D194-K221 IonicContact OD2-NZ 2.92Å; D194-K221 PolarHBondContact OD2-NZ 2.93Å
195	N	96.1	Very high	98.1	Very high	116 Å²	116	34.2 Å²	34.2	62%	0.62	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-28.7	177.6	-72.8	-10.7	0	0	0	112.4	S173 F193 T197	S173-N195 VanDerWaalsContact CA-O 3.29Å; S173-N195 WeakPolarHBondContact CA-O 3.45Å; S173-N195 VanDerWaalsContact CB-O 3.29Å; S173-N195 WeakPolarHBondContact CB-O 3.42Å; F193-N195 VanDerWaalsContact C-N 3.28Å; F193-N195 PolarHBondContact O-N 3.11Å; N195-T197 PolarHBondContact O-N 2.95Å
196	A	97.4	Very high	98.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.			trans	-96.3	58.7	-174.2	0	0	0	0	0	111.1	V171 P172 F193 G198 L199 L222	V171-A196 HydrophobicContact CB-CB 4.03Å; V171-A196 HydrophobicContact CG1-CB 3.6Å; P172-A196 WeakPolarHBondContact O-CB 3.46Å; F193-A196 PolarHBondContact O-N 3.24Å; F193-A196 VanDerWaalsContact O-N 3.08Å; A196-G198 PolarHBondContact O-N 3.42Å; A196-G198 VanDerWaalsContact O-N 3.14Å; A196-L199 HydrophobicContact CB-CD1 3.8Å; A196-L199 HydrophobicContact CB-CD2 4.47Å; A196-L199 HydrophobicContact CB-CG 3.79Å; A196-L199 VanDerWaalsContact O-CG 3.24Å; A196-L199 WeakPolarHBondContact O-CG 3.29Å; A196-L199 PolarHBondContact O-N 3.38Å; A196-L199 VanDerWaalsContact O-N 3.16Å; A196-L222 WeakPolarHBondContact O-CD2 3.41Å
197	T	96.9	Very high	98.1	Very high	77 Å²	77	33.6 Å²	33.6	47%	0.472	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-18.2	-175.4	57.4	0	0	0	0	113.9	D194 N195	D194-T197 WeakPolarHBondContact O-CG2 3.49Å; N195-T197 PolarHBondContact O-N 2.95Å
198	G	97.9	Very high	98.1	Very high	26 Å²	26	36.6 Å²	36.6	27%	0.268	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	10.7	176.6	0	0	0	0	0	115.2	A196 L200	A196-G198 PolarHBondContact O-N 3.42Å; A196-G198 VanDerWaalsContact O-N 3.14Å; G198-L200 PolarHBondContact O-N 3.32Å
199	L	98.8	Very high	98.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.			trans	-58	130.5	176.4	-78.7	169.2	0	0	0	111.5	M175 V178 F193 A196 I202 L222 H224 L225	M175-L199 HydrophobicContact CB-CD2 4.24Å; V178-L199 HydrophobicContact CB-CD2 4.42Å; V178-L199 HydrophobicContact CG1-CD2 3.69Å; V178-L199 HydrophobicContact CG2-CD2 3.92Å; F193-L199 HydrophobicContact CB-CD1 4Å; F193-L199 HydrophobicContact CD1-CD1 3.81Å; F193-L199 HydrophobicContact CG-CD1 4.13Å; A196-L199 HydrophobicContact CB-CD1 3.8Å; A196-L199 HydrophobicContact CB-CD2 4.47Å; A196-L199 HydrophobicContact CB-CG 3.79Å; A196-L199 VanDerWaalsContact O-CG 3.24Å; A196-L199 WeakPolarHBondContact O-CG 3.29Å; A196-L199 PolarHBondContact O-N 3.38Å; A196-L199 VanDerWaalsContact O-N 3.16Å; L199-I202 HydrophobicContact CD1-CD1 4.07Å; L199-I202 HydrophobicContact CD1-CG1 4.26Å; L199-L222 HydrophobicContact CB-CD2 4.33Å; L199-L222 HydrophobicContact CD1-CD1 4.27Å; L199-L222 HydrophobicContact CD1-CD2 4.15Å; L199-H224 CarbonylContact O-C 3.53Å; L199-L225 HydrophobicContact CB-CD1 4.41Å; L199-L225 WeakPolarHBondContact O-CA 3.49Å; L199-L225 PolarHBondContact O-N 3.06Å
200	L	98.8	Very high	98.2	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.188	20%	0.198	C	C	.	.			trans	-104.7	-44.2	174.6	-58	-179.7	0	0	0	110.3	K176 Y177 G198 H224 L225 E226 R227	K176-L200 HydrophobicContact CB-CD1 4.47Å; K176-L200 HydrophobicContact CB-CG 4.4Å; K176-L200 HydrophobicContact CD-CD1 4.39Å; K176-L200 PolarHBondContact O-N 3.06Å; Y177-L200 HydrophobicContact CE1-CB 4.32Å; Y177-L200 HydrophobicContact CE1-CD1 4.25Å; G198-L200 PolarHBondContact O-N 3.32Å; L200-H224 HydrophobicContact CD2-CB 4.01Å; L200-H224 VanDerWaalsContact CD2-O 3.23Å; L200-H224 WeakPolarHBondContact CD2-O 3.18Å; L200-L225 WeakPolarHBondContact O-CD1 3.29Å; L200-E226 HydrophobicContact CD2-CG 4.47Å; L200-E226 PolarHBondContact O-N 2.69Å; L200-R227 PolarHBondContact O-N 2.94Å
201	W	98.9	Very high	98.2	Very high	75 Å²	75	30.3 Å²	30.3	28%	0.284	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.3	-175.4	-63.4	14	0	0	0	111	K176 Y177 V178 R227	K176-W201 PolarHBondContact O-N 3.43Å; K176-W201 VanDerWaalsContact O-N 3.14Å; Y177-W201 HydrophobicContact CD1-CB 3.94Å; Y177-W201 AromaticContact CD1-CD2 3.84Å; Y177-W201 HydrophobicContact CD1-CD2 3.84Å; Y177-W201 HydrophobicContact CD1-CE3 4.24Å; Y177-W201 AromaticContact CD1-CG 3.71Å; Y177-W201 HydrophobicContact CD1-CG 3.71Å; Y177-W201 HydrophobicContact CE1-CD2 4.14Å; Y177-W201 HydrophobicContact CE1-CG 4.11Å; V178-W201 PolarHBondContact N-O 3.33Å; V178-W201 VanDerWaalsContact N-O 3.13Å; W201-R227 WeakPolarHBondContact CA-O 3.42Å; W201-R227 HydrophobicContact CG-CB 4.18Å; W201-R227 VanDerWaalsContact CZ2-NH1 3.25Å
202	I	98.9	Very high	98.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	113.1	171.4	-62.1	172.7	0	0	0	108.4	V178 F193 L199 L204 F219 L222 L225 R227 L228 Y229	V178-I202 HydrophobicContact CG2-CB 4.2Å; V178-I202 HydrophobicContact CG2-CG1 3.8Å; V178-I202 HydrophobicContact CG2-CG2 4.23Å; F193-I202 HydrophobicContact CD1-CD1 4.44Å; F193-I202 HydrophobicContact CD2-CD1 4.32Å; F193-I202 HydrophobicContact CE1-CD1 4.34Å; F193-I202 HydrophobicContact CE2-CD1 4.22Å; F193-I202 HydrophobicContact CG-CD1 4.45Å; F193-I202 HydrophobicContact CZ-CD1 4.23Å; F193-I202 HydrophobicContact CZ-CG2 4.25Å; L199-I202 HydrophobicContact CD1-CD1 4.07Å; L199-I202 HydrophobicContact CD1-CG1 4.26Å; I202-L204 HydrophobicContact CG2-CD1 3.53Å; I202-L204 HydrophobicContact CG2-CG 3.78Å; I202-F219 HydrophobicContact CD1-CD1 4.45Å; I202-F219 HydrophobicContact CD1-CE1 4.43Å; I202-L222 HydrophobicContact CD1-CD1 3.52Å; I202-L225 HydrophobicContact CB-CD1 4.43Å; I202-L225 HydrophobicContact CD1-CD1 3.7Å; I202-L225 HydrophobicContact CD1-CD2 4.26Å; I202-L225 HydrophobicContact CG1-CD1 3.73Å; I202-R227 PolarHBondContact N-O 3.16Å; I202-R227 VanDerWaalsContact N-O 3.1Å; I202-L228 HydrophobicContact CB-CD1 3.97Å; I202-L228 HydrophobicContact CG2-CD1 4.07Å; I202-Y229 PolarHBondContact O-N 3.4Å
203	A	98.9	Very high	98.3	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.033	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	112.4	173.3	0	0	0	0	0	111.1	V178 Y179 F180 Q181 Y229	V178-A203 PolarHBondContact O-N 3.43Å; Y179-A203 HydrophobicContact CD1-CB 4.1Å; F180-A203 CarbonylContact C-O 3.14Å; F180-A203 WeakPolarHBondContact CA-O 3.31Å; F180-A203 WeakPolarHBondContact CB-O 3.11Å; F180-A203 PolarHBondContact N-O 3.16Å; Q181-A203 PolarHBondContact N-O 2.8Å; A203-Y229 HydrophobicContact CB-CD2 4.13Å
204	L	98.9	Very high	98.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.			trans	-124.8	10	-180	-75.6	162.6	0	0	0	112.5	L168 F180 I188 F193 I202 N207 I209 Y229 L230 N233	L168-L204 HydrophobicContact CD1-CD2 3.85Å; L168-L204 HydrophobicContact CD2-CD2 3.67Å; L168-L204 HydrophobicContact CG-CD2 4.3Å; F180-L204 HydrophobicContact CB-CD2 3.79Å; F180-L204 HydrophobicContact CD2-CD2 4.02Å; F180-L204 HydrophobicContact CG-CD2 4.22Å; I188-L204 HydrophobicContact CD1-CD1 3.79Å; I188-L204 HydrophobicContact CG1-CD1 4.42Å; F193-L204 HydrophobicContact CZ-CD1 4.45Å; I202-L204 HydrophobicContact CG2-CD1 3.53Å; I202-L204 HydrophobicContact CG2-CG 3.78Å; L204-N207 PolarHBondContact O-ND2 3.14Å; L204-I209 HydrophobicContact CB-CD1 4.15Å; L204-I209 HydrophobicContact CD2-CD1 4.26Å; L204-Y229 CarbonylContact C-O 3.55Å; L204-Y229 WeakPolarHBondContact CA-O 3.27Å; L204-Y229 WeakPolarHBondContact CB-O 3.47Å; L204-Y229 PolarHBondContact N-O 3.04Å; L204-L230 HydrophobicContact CB-CD2 3.8Å; L204-L230 HydrophobicContact CD1-CD2 3.92Å; L204-N233 PolarHBondContact O-ND2 3.31Å
205	H	98.8	Very high	98.3	Very high	47 Å²	47	40 Å²	40	22%	0.218	22%	0.221	C	C	.	.			trans	-67.4	158.1	-177.2	59.9	-100.8	0	0	0	113.5	Q181 N182 N207 Y229 D231	Q181-H205 CarbonylContact C-O 3.44Å; Q181-H205 WeakPolarHBondContact CA-O 3.41Å; Q181-H205 VanDerWaalsContact CB-CD2 3.41Å; Q181-H205 WeakPolarHBondContact CB-CD2 3.3Å; Q181-H205 WeakPolarHBondContact CB-NE2 3.31Å; Q181-H205 VanDerWaalsContact CB-O 3.31Å; Q181-H205 WeakPolarHBondContact CB-O 3.39Å; Q181-H205 WeakPolarHBondContact CG-NE2 3.5Å; N182-H205 PolarHBondContact N-O 3.13Å; H205-N207 PolarHBondContact O-ND2 3.26Å; H205-Y229 PolarHBondContact N-O 3.14Å; H205-D231 WeakPolarHBondContact CA-O 3.31Å; H205-D231 VanDerWaalsContact CB-CG 3.41Å; H205-D231 VanDerWaalsContact CB-O 3.31Å; H205-D231 WeakPolarHBondContact CB-O 3.13Å; H205-D231 VanDerWaalsContact CB-OD1 3.27Å; H205-D231 WeakPolarHBondContact CB-OD1 3.39Å; H205-D231 WeakPolarHBondContact CB-OD2 3.45Å; H205-D231 IonicContact CG-OD1 2.65Å; H205-D231 IonicContact CG-OD2 2.81Å
206	G	98.8	Very high	98.2	Very high	21 Å²	21	42.5 Å²	42.5	22%	0.216	23%	0.226	C	C	.	.	S	Bend	trans	65.7	47	179.9	0	0	0	0	0	112.1	N182 N183 D231 H232	N182-G206 CarbonylContact C-O 3.46Å; N182-G206 WeakPolarHBondContact CA-O 3.45Å; N182-G206 PolarHBondContact N-O 3.15Å; N183-G206 PolarHBondContact N-O 3.48Å; G206-D231 PolarHBondContact N-O 3.35Å; G206-H232 VanDerWaalsContact CA-O 3.32Å; G206-H232 WeakPolarHBondContact CA-O 3.26Å; G206-H232 PolarHBondContact N-O 3.03Å
207	N	98.9	Very high	98.1	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.048	26%	0.257	C	S	.	.	S	Bend	trans	-130.2	-169.3	178.5	-84.1	-72.7	0	0	0	109.9	F180 N183 Q184 I185 L204 H205 I209 H232 N233	F180-N207 PolarHBondContact O-ND2 3.13Å; N183-N207 VanDerWaalsContact CA-OD1 3.32Å; N183-N207 WeakPolarHBondContact CA-OD1 3.32Å; N183-N207 WeakPolarHBondContact CB-OD1 3.17Å; N183-N207 PolarHBondContact N-OD1 3.41Å; N183-N207 PolarHBondContact O-OD1 3.4Å; Q184-N207 PolarHBondContact N-OD1 2.97Å; I185-N207 HydrophobicContact CB-CB 4.35Å; I185-N207 WeakPolarHBondContact CB-OD1 3.41Å; I185-N207 PolarHBondContact N-OD1 2.95Å; L204-N207 PolarHBondContact O-ND2 3.14Å; H205-N207 PolarHBondContact O-ND2 3.26Å; N207-I209 HydrophobicContact CB-CD1 4.2Å; N207-I209 HydrophobicContact CB-CG1 4.1Å; N207-H232 PolarHBondContact N-O 2.97Å; N207-H232 VanDerWaalsContact N-O 3.1Å; N207-N233 WeakPolarHBondContact CA-OD1 3.23Å; N207-N233 WeakPolarHBondContact CB-OD1 3.35Å; N207-N233 PolarHBondContact O-OD1 3.25Å
208	Q	98.8	Very high	98.1	Very high	96 Å²	96	46.2 Å²	46.2	45%	0.449	24%	0.236	S	C	.	.			trans	-122.1	34.6	-177.5	-62.4	172.5	28.4	0	0	110.9	I185 T186 T210 N233 N234	I185-Q208 CarbonylContact O-C 3.28Å; I185-Q208 VanDerWaalsContact O-C 3.24Å; I185-Q208 WeakPolarHBondContact O-CA 3.5Å; I185-Q208 PolarHBondContact O-N 2.74Å; T186-Q208 WeakPolarHBondContact CA-O 3.18Å; T186-Q208 HydrophobicContact CG2-CB 4.14Å; Q208-T210 PolarHBondContact O-N 3.14Å; Q208-N233 PolarHBondContact N-OD1 3.21Å; Q208-N234 WeakPolarHBondContact CA-OD1 3.27Å
209	I	98.9	Very high	98.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.223	C	C	.	.			trans	-71.6	128.4	-174.4	-59.4	166	0	0	0	109.1	I185 I188 L204 N207 V214 L230 N233 N234 L235	I185-I209 HydrophobicContact CG2-CG1 4.22Å; I185-I209 PolarHBondContact O-N 3.34Å; I188-I209 HydrophobicContact CD1-CD1 4.16Å; I188-I209 HydrophobicContact CD1-CG2 4.29Å; I188-I209 HydrophobicContact CG1-CD1 4.03Å; I188-I209 HydrophobicContact CG1-CG2 4.11Å; L204-I209 HydrophobicContact CB-CD1 4.15Å; L204-I209 HydrophobicContact CD2-CD1 4.26Å; N207-I209 HydrophobicContact CB-CD1 4.2Å; N207-I209 HydrophobicContact CB-CG1 4.1Å; I209-V214 HydrophobicContact CG2-CG2 3.92Å; I209-L230 HydrophobicContact CD1-CD2 4.3Å; I209-N233 HydrophobicContact CB-CB 4.45Å; I209-N233 VanDerWaalsContact CB-OD1 3.23Å; I209-N233 WeakPolarHBondContact CB-OD1 3.13Å; I209-N233 VanDerWaalsContact CG1-OD1 3.26Å; I209-N233 WeakPolarHBondContact CG1-OD1 3.13Å; I209-N233 PolarHBondContact N-OD1 3.16Å; I209-N234 CarbonylContact O-C 3.21Å; I209-N234 VanDerWaalsContact O-CA 3.27Å; I209-N234 WeakPolarHBondContact O-CA 3.32Å; I209-N234 WeakPolarHBondContact O-CB 3.37Å; I209-N234 PolarHBondContact O-N 3.39Å; I209-L235 HydrophobicContact CG2-CD2 4.02Å; I209-L235 PolarHBondContact O-N 2.95Å
210	T	98.7	Very high	97.8	Very high	45 Å²	45	47.5 Å²	47.5	28%	0.276	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-105.3	147.5	174.9	64.4	0	0	0	0	111.4	Q208 D212 K213 N234	Q208-T210 PolarHBondContact O-N 3.14Å; T210-D212 PolarHBondContact O-N 3.47Å; T210-D212 VanDerWaalsContact O-N 3.14Å; T210-K213 PolarHBondContact O-N 3.45Å; T210-K213 WeakPolarHBondContact OG1-CG 3.34Å; T210-N234 HydrophobicContact CG2-CB 3.95Å
211	S	98.4	Very high	97.7	Very high	14 Å²	14	51 Å²	51	10%	0.098	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.1	-28.4	-176.8	-61.3	0	0	0	0	114.4	K213 L235 T236 R237	S211-K213 VanDerWaalsContact C-N 3.25Å; S211-K213 PolarHBondContact O-N 3.14Å; S211-L235 WeakPolarHBondContact OG-CA 3.21Å; S211-T236 PolarHBondContact OG-N 2.83Å; S211-R237 PolarHBondContact O-NH2 3.38Å; S211-R237 PolarHBondContact OG-N 3.1Å; S211-R237 PolarHBondContact OG-O 2.81Å
212	D	98.1	Very high	97.6	Very high	125 Å²	125	47.4 Å²	47.4	67%	0.668	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-73.6	-19.4	177.6	-61.2	-28.8	0	0	0	112.8	T210 R237	T210-D212 PolarHBondContact O-N 3.47Å; T210-D212 VanDerWaalsContact O-N 3.14Å; D212-R237 IonicContact OD1-CZ 3.73Å; D212-R237 VanDerWaalsContact OD1-CZ 3.26Å; D212-R237 IonicContact OD1-NH1 3.83Å; D212-R237 PolarHBondContact OD1-NH1 2.96Å; D212-R237 IonicContact OD1-NH2 3.95Å; D212-R237 PolarHBondContact OD1-NH2 2.95Å
213	K	98.3	Very high	97.6	Very high	106 Å²	106	56.8 Å²	56.8	46%	0.461	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-104.8	13.1	-177.9	-68.1	-177.8	173.4	-177.4	0	113	T186 S187 I188 T210 S211	T186-K213 WeakPolarHBondContact O-CB 3.4Å; T186-K213 WeakPolarHBondContact O-CD 3.38Å; T186-K213 PolarHBondContact OG1-NZ 2.82Å; S187-K213 WeakPolarHBondContact CA-O 3.43Å; I188-K213 PolarHBondContact N-O 3.07Å; T210-K213 PolarHBondContact O-N 3.45Å; T210-K213 WeakPolarHBondContact OG1-CG 3.34Å; S211-K213 VanDerWaalsContact C-N 3.25Å; S211-K213 PolarHBondContact O-N 3.14Å
214	V	98.5	Very high	97.5	Very high	29 Å²	29	62.2 Å²	62.2	18%	0.176	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-87.5	119.2	169.3	-179.8	0	0	0	0	108.4	I188 I209 V218 F219 L235	I188-V214 HydrophobicContact CD1-CG1 4.49Å; I188-V214 HydrophobicContact CD1-CG2 4.41Å; I209-V214 HydrophobicContact CG2-CG2 3.92Å; V214-V218 HydrophobicContact CG1-CG1 4.08Å; V214-F219 HydrophobicContact CG1-CE2 4.44Å; V214-L235 HydrophobicContact CG2-CD2 4.17Å
215	G	97.3	Very high	97.5	Very high	15 Å²	15	62.2 Å²	62.2	16%	0.155	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-57.4	144.4	-178.4	0	0	0	0	0	112.3	I188 K217 V218	I188-G215 WeakPolarHBondContact O-CA 3.33Å; I188-G215 PolarHBondContact O-N 3.43Å; G215-K217 PolarHBondContact O-N 3.38Å; G215-V218 WeakPolarHBondContact O-CB 3.34Å; G215-V218 WeakPolarHBondContact O-CG1 3.18Å; G215-V218 PolarHBondContact O-N 3.16Å
216	K	94.3	Very high	97.5	Very high	168 Å²	168	62.5 Å²	62.5	73%	0.73	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	131	-179.7	-68.1	178.6	-179.6	174.1	0	109.7	V218	K216-V218 PolarHBondContact O-N 3.14Å
217	K	94.3	Very high	97.5	Very high	151 Å²	151	64 Å²	64	66%	0.657	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	23.9	176	-62.9	-178.3	179.3	178.4	0	114.1	G215 F219 S220 P241	G215-K217 PolarHBondContact O-N 3.38Å; K217-F219 PolarHBondContact O-N 3.28Å; K217-F219 VanDerWaalsContact O-N 3.11Å; K217-S220 WeakPolarHBondContact CA-OG 3.38Å; K217-S220 WeakPolarHBondContact CB-OG 3.33Å; K217-S220 VanDerWaalsContact O-CB 3.3Å; K217-S220 WeakPolarHBondContact O-CB 3.47Å; K217-S220 PolarHBondContact O-N 3.44Å; K217-S220 PolarHBondContact O-OG 3.32Å; K217-P241 HydrophobicContact CG-CG 4.41Å
218	V	97.8	Very high	97.6	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.024	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.8	-172.3	69.2	0	0	0	0	113.6	I188 V192 F193 V214 G215 K216	I188-V218 HydrophobicContact CG2-CG1 4.2Å; I188-V218 HydrophobicContact CG2-CG2 3.82Å; V192-V218 HydrophobicContact CG1-CG2 3.92Å; F193-V218 HydrophobicContact CD2-CG2 3.89Å; F193-V218 HydrophobicContact CE2-CG2 4.13Å; V214-V218 HydrophobicContact CG1-CG1 4.08Å; G215-V218 WeakPolarHBondContact O-CB 3.34Å; G215-V218 WeakPolarHBondContact O-CG1 3.18Å; G215-V218 PolarHBondContact O-N 3.16Å; K216-V218 PolarHBondContact O-N 3.14Å
219	F	97.6	Very high	97.6	Very high	2 Å²	2	61 Å²	61	1%	0.009	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-3.6	176.6	-52.9	-64.3	0	0	0	114.1	I188 F193 I202 V214 K217 K221 L222 L228 L230 L242	I188-F219 HydrophobicContact CD1-CZ 3.95Å; F193-F219 HydrophobicContact CD2-CD1 4.3Å; F193-F219 HydrophobicContact CD2-CE1 4.29Å; F193-F219 HydrophobicContact CE2-CD1 4.21Å; F193-F219 AromaticContact CE2-CE1 3.74Å; F193-F219 HydrophobicContact CE2-CE1 3.74Å; I202-F219 HydrophobicContact CD1-CD1 4.45Å; I202-F219 HydrophobicContact CD1-CE1 4.43Å; V214-F219 HydrophobicContact CG1-CE2 4.44Å; K217-F219 PolarHBondContact O-N 3.28Å; K217-F219 VanDerWaalsContact O-N 3.11Å; F219-K221 VanDerWaalsContact C-N 3.32Å; F219-K221 PolarHBondContact O-N 3.25Å; F219-L222 HydrophobicContact CD1-CD1 4.21Å; F219-L222 PolarHBondContact O-N 3Å; F219-L228 HydrophobicContact CE1-CD1 4.08Å; F219-L228 HydrophobicContact CE1-CD2 4.45Å; F219-L228 HydrophobicContact CE2-CD2 4.42Å; F219-L228 HydrophobicContact CZ-CD1 4.32Å; F219-L228 HydrophobicContact CZ-CD2 4.32Å; F219-L230 HydrophobicContact CZ-CD1 4.39Å; F219-L242 HydrophobicContact CD2-CD2 4.2Å
220	S	93.2	Very high	97.6	Very high	50 Å²	50	61.1 Å²	61.1	35%	0.35	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.4	-168.3	-61	0	0	0	0	114.7	K217 P241	K217-S220 WeakPolarHBondContact CA-OG 3.38Å; K217-S220 WeakPolarHBondContact CB-OG 3.33Å; K217-S220 VanDerWaalsContact O-CB 3.3Å; K217-S220 WeakPolarHBondContact O-CB 3.47Å; K217-S220 PolarHBondContact O-N 3.44Å; K217-S220 PolarHBondContact O-OG 3.32Å; S220-P241 WeakPolarHBondContact OG-CG 3.45Å
221	K	95.6	Very high	97.6	Very high	109 Å²	109	59.7 Å²	59.7	47%	0.474	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-12.7	177.8	-67.6	-175.4	-177.5	173.2	0	113.3	D194 F219 R223	D194-K221 HydrophobicContact CB-CD 4.37Å; D194-K221 VanDerWaalsContact CG-NZ 3.32Å; D194-K221 IonicContact OD1-NZ 2.95Å; D194-K221 IonicContact OD2-NZ 2.92Å; D194-K221 PolarHBondContact OD2-NZ 2.93Å; F219-K221 VanDerWaalsContact C-N 3.32Å; F219-K221 PolarHBondContact O-N 3.25Å; K221-R223 VanDerWaalsContact C-N 3.27Å; K221-R223 PolarHBondContact O-N 3.28Å
222	L	98	Very high	97.6	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.291	C	S	.	.			trans	-85.2	66.9	-173.7	-51.8	-176.6	0	0	0	111.1	F193 A196 L199 I202 F219 H224 L225 P243	F193-L222 HydrophobicContact CB-CD1 4.02Å; F193-L222 HydrophobicContact CB-CD2 3.91Å; F193-L222 HydrophobicContact CB-CG 4.37Å; F193-L222 HydrophobicContact CD2-CD1 4.18Å; F193-L222 HydrophobicContact CG-CD1 4.22Å; A196-L222 WeakPolarHBondContact O-CD2 3.41Å; L199-L222 HydrophobicContact CB-CD2 4.33Å; L199-L222 HydrophobicContact CD1-CD1 4.27Å; L199-L222 HydrophobicContact CD1-CD2 4.15Å; I202-L222 HydrophobicContact CD1-CD1 3.52Å; F219-L222 HydrophobicContact CD1-CD1 4.21Å; F219-L222 PolarHBondContact O-N 3Å; L222-H224 PolarHBondContact O-N 3.3Å; L222-H224 VanDerWaalsContact O-N 3.09Å; L222-L225 HydrophobicContact CB-CB 3.98Å; L222-L225 HydrophobicContact CD1-CD2 4.36Å; L222-L225 WeakPolarHBondContact O-CB 3.3Å; L222-L225 PolarHBondContact O-N 3.29Å; L222-P243 WeakPolarHBondContact O-CB 3.42Å
223	R	97.3	Very high	97.6	Very high	197 Å²	197	57.6 Å²	57.6	74%	0.743	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.9	-172.7	-63.3	-174.7	-179.4	-169.4	1.4	114.2	K221 S245	K221-R223 VanDerWaalsContact C-N 3.27Å; K221-R223 PolarHBondContact O-N 3.28Å; R223-S245 WeakPolarHBondContact O-CB 3.12Å; R223-S245 PolarHBondContact O-OG 3.25Å
224	H	98.3	Very high	97.7	Very high	118 Å²	118	55.5 Å²	55.5	55%	0.546	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	6.1	179.4	-58.4	-67.1	0	0	0	113.5	L199 L200 L222 E226	L199-H224 CarbonylContact O-C 3.53Å; L200-H224 HydrophobicContact CD2-CB 4.01Å; L200-H224 VanDerWaalsContact CD2-O 3.23Å; L200-H224 WeakPolarHBondContact CD2-O 3.18Å; L222-H224 PolarHBondContact O-N 3.3Å; L222-H224 VanDerWaalsContact O-N 3.09Å; H224-E226 WeakPolarHBondContact O-CG 3.43Å; H224-E226 PolarHBondContact O-N 3.39Å
225	L	98.8	Very high	97.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.246	C	C	.	.			trans	-64.3	123.3	-178.4	-170.6	73.8	0	0	0	110.7	L199 L200 I202 L222 L228 P243 S245 L246	L199-L225 HydrophobicContact CB-CD1 4.41Å; L199-L225 WeakPolarHBondContact O-CA 3.49Å; L199-L225 PolarHBondContact O-N 3.06Å; L200-L225 WeakPolarHBondContact O-CD1 3.29Å; I202-L225 HydrophobicContact CB-CD1 4.43Å; I202-L225 HydrophobicContact CD1-CD1 3.7Å; I202-L225 HydrophobicContact CD1-CD2 4.26Å; I202-L225 HydrophobicContact CG1-CD1 3.73Å; L222-L225 HydrophobicContact CB-CB 3.98Å; L222-L225 HydrophobicContact CD1-CD2 4.36Å; L222-L225 WeakPolarHBondContact O-CB 3.3Å; L222-L225 PolarHBondContact O-N 3.29Å; L225-L228 HydrophobicContact CD2-CB 4.29Å; L225-P243 HydrophobicContact CB-CG 3.74Å; L225-P243 HydrophobicContact CD2-CG 3.73Å; L225-P243 HydrophobicContact CG-CG 4.32Å; L225-S245 PolarHBondContact N-OG 2.98Å; L225-S245 CarbonylContact O-C 3.56Å; L225-S245 WeakPolarHBondContact O-CB 3.35Å; L225-S245 PolarHBondContact O-OG 2.93Å; L225-L246 HydrophobicContact CD2-CD2 3.94Å; L225-L246 HydrophobicContact CG-CD2 3.96Å; L225-L246 WeakPolarHBondContact O-CA 3.46Å; L225-L246 PolarHBondContact O-N 3.22Å
226	E	98.8	Very high	97.7	Very high	53 Å²	53	56.1 Å²	56.1	25%	0.248	26%	0.255	C	S	.	.			trans	-104.3	-36.7	-178.6	-60	-165.2	137.5	0	0	112.1	L200 H224 R247 E248	L200-E226 HydrophobicContact CD2-CG 4.47Å; L200-E226 PolarHBondContact O-N 2.69Å; H224-E226 WeakPolarHBondContact O-CG 3.43Å; H224-E226 PolarHBondContact O-N 3.39Å; E226-R247 HydrophobicContact CB-CG 4.44Å; E226-R247 PolarHBondContact O-N 2.83Å; E226-R247 IonicContact OE1-CZ 3.9Å; E226-R247 IonicContact OE1-NE 2.69Å; E226-R247 PolarHBondContact OE1-NE 3.26Å; E226-R247 VanDerWaalsContact OE1-NE 3.16Å; E226-R247 IonicContact OE1-NH2 3.82Å; E226-E248 PolarHBondContact O-N 3.38Å; E226-E248 VanDerWaalsContact O-N 3.09Å
227	R	98.9	Very high	98	Very high	52 Å²	52	53.6 Å²	53.6	20%	0.196	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	127.2	-173.9	-58.3	-168	168.7	77.9	6.7	111.7	L200 W201 I202 Y229 E248	L200-R227 PolarHBondContact O-N 2.94Å; W201-R227 WeakPolarHBondContact CA-O 3.42Å; W201-R227 HydrophobicContact CG-CB 4.18Å; W201-R227 VanDerWaalsContact CZ2-NH1 3.25Å; I202-R227 PolarHBondContact N-O 3.16Å; I202-R227 VanDerWaalsContact N-O 3.1Å; R227-Y229 HydrophobicContact CB-CE2 3.86Å; R227-Y229 WeakPolarHBondContact CD-OH 3.24Å; R227-E248 WeakPolarHBondContact CD-OE2 3.45Å; R227-E248 HydrophobicContact CG-CB 4.21Å; R227-E248 IonicContact CZ-OE1 2.75Å; R227-E248 VanDerWaalsContact CZ-OE1 3.3Å; R227-E248 IonicContact CZ-OE2 3.96Å; R227-E248 IonicContact NE-OE1 3.91Å; R227-E248 PolarHBondContact NE-OE1 3.18Å; R227-E248 IonicContact NE-OE2 3.44Å; R227-E248 PolarHBondContact NE-OE2 3Å; R227-E248 IonicContact NH2-OE1 3.52Å; R227-E248 PolarHBondContact NH2-OE1 3.3Å
228	L	98.9	Very high	98.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	118.3	177.5	179.6	60.8	0	0	0	110	I202 F219 L225 L230 L242 L246 E248 L249 H250	I202-L228 HydrophobicContact CB-CD1 3.97Å; I202-L228 HydrophobicContact CG2-CD1 4.07Å; F219-L228 HydrophobicContact CE1-CD1 4.08Å; F219-L228 HydrophobicContact CE1-CD2 4.45Å; F219-L228 HydrophobicContact CE2-CD2 4.42Å; F219-L228 HydrophobicContact CZ-CD1 4.32Å; F219-L228 HydrophobicContact CZ-CD2 4.32Å; L225-L228 HydrophobicContact CD2-CB 4.29Å; L228-L230 HydrophobicContact CD1-CD1 4.21Å; L228-L230 HydrophobicContact CD1-CG 4.15Å; L228-L230 HydrophobicContact CD2-CD1 3.83Å; L228-L230 HydrophobicContact CG-CD1 3.97Å; L228-L230 HydrophobicContact CG-CG 4.15Å; L228-L242 HydrophobicContact CD2-CD2 3.85Å; L228-L246 HydrophobicContact CB-CD2 3.96Å; L228-E248 PolarHBondContact N-O 3.17Å; L228-L249 HydrophobicContact CB-CD1 4.08Å; L228-L249 HydrophobicContact CD2-CD1 3.98Å; L228-L249 HydrophobicContact CG-CD1 4.15Å; L228-H250 PolarHBondContact O-N 3.09Å
229	Y	98.9	Very high	98.1	Very high	43 Å²	43	48 Å²	48	17%	0.169	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.8	177.4	-51.3	-92.6	0	0	0	110.3	I202 A203 L204 H205 R227 H250	I202-Y229 PolarHBondContact O-N 3.4Å; A203-Y229 HydrophobicContact CB-CD2 4.13Å; L204-Y229 CarbonylContact C-O 3.55Å; L204-Y229 WeakPolarHBondContact CA-O 3.27Å; L204-Y229 WeakPolarHBondContact CB-O 3.47Å; L204-Y229 PolarHBondContact N-O 3.04Å; H205-Y229 PolarHBondContact N-O 3.14Å; R227-Y229 HydrophobicContact CB-CE2 3.86Å; R227-Y229 WeakPolarHBondContact CD-OH 3.24Å; Y229-H250 HydrophobicContact CD1-CB 4.09Å; Y229-H250 AromaticContact CD1-CD2 3.41Å; Y229-H250 VanDerWaalsContact CD1-CD2 3.41Å; Y229-H250 WeakPolarHBondContact CD1-CD2 3.4Å; Y229-H250 AromaticContact CD1-CG 3.66Å; Y229-H250 AromaticContact CD1-NE2 3.89Å; Y229-H250 AromaticContact CE1-CD2 3.42Å; Y229-H250 VanDerWaalsContact CE1-CD2 3.42Å; Y229-H250 WeakPolarHBondContact CE1-CD2 3.35Å; Y229-H250 AromaticContact CE1-NE2 3.45Å; Y229-H250 WeakPolarHBondContact CE1-NE2 3.37Å
230	L	98.9	Very high	97.9	Very high	2 Å²	2	50 Å²	50	1%	0.01	24%	0.239	C	C	.	.			trans	-128.8	14.3	178	-77.5	170.5	0	0	0	111.5	I188 L204 I209 F219 L228 N233 L235 P239 H250 L251 N254	I188-L230 HydrophobicContact CD1-CD2 4.11Å; L204-L230 HydrophobicContact CB-CD2 3.8Å; L204-L230 HydrophobicContact CD1-CD2 3.92Å; I209-L230 HydrophobicContact CD1-CD2 4.3Å; F219-L230 HydrophobicContact CZ-CD1 4.39Å; L228-L230 HydrophobicContact CD1-CD1 4.21Å; L228-L230 HydrophobicContact CD1-CG 4.15Å; L228-L230 HydrophobicContact CD2-CD1 3.83Å; L228-L230 HydrophobicContact CG-CD1 3.97Å; L228-L230 HydrophobicContact CG-CG 4.15Å; L230-N233 PolarHBondContact O-ND2 3.1Å; L230-L235 HydrophobicContact CB-CD1 4.07Å; L230-L235 HydrophobicContact CD1-CD1 4.47Å; L230-P239 HydrophobicContact CD1-CB 4.34Å; L230-P239 HydrophobicContact CD1-CG 3.89Å; L230-H250 CarbonylContact C-O 3.17Å; L230-H250 WeakPolarHBondContact CA-O 3.23Å; L230-H250 PolarHBondContact N-O 3.44Å; L230-L251 HydrophobicContact CB-CD2 3.76Å; L230-L251 HydrophobicContact CD1-CD2 4.2Å; L230-N254 PolarHBondContact O-ND2 2.96Å
231	D	98.9	Very high	98.1	Very high	15 Å²	15	51.1 Å²	51.1	8%	0.08	25%	0.246	C	C	.	.			trans	-64.2	162.2	174.7	58	-77.1	0	0	0	112.2	H205 G206 N233 H250 D252	H205-D231 WeakPolarHBondContact CA-O 3.31Å; H205-D231 VanDerWaalsContact CB-CG 3.41Å; H205-D231 VanDerWaalsContact CB-O 3.31Å; H205-D231 WeakPolarHBondContact CB-O 3.13Å; H205-D231 VanDerWaalsContact CB-OD1 3.27Å; H205-D231 WeakPolarHBondContact CB-OD1 3.39Å; H205-D231 WeakPolarHBondContact CB-OD2 3.45Å; H205-D231 IonicContact CG-OD1 2.65Å; H205-D231 IonicContact CG-OD2 2.81Å; G206-D231 PolarHBondContact N-O 3.35Å; D231-N233 PolarHBondContact O-N 2.67Å; D231-N233 PolarHBondContact O-ND2 2.9Å; D231-H250 HydrophobicContact CB-CB 4.17Å; D231-H250 PolarHBondContact N-O 3.45Å; D231-H250 WeakPolarHBondContact OD1-CB 3.35Å; D231-D252 CarbonylContact C-O 3.6Å; D231-D252 WeakPolarHBondContact CA-O 3.41Å; D231-D252 WeakPolarHBondContact CB-O 3.45Å; D231-D252 WeakPolarHBondContact CB-OD1 3.44Å; D231-D252 WeakPolarHBondContact CB-OD2 3.33Å
232	H	98.9	Very high	98.2	Very high	91 Å²	91	46.9 Å²	46.9	42%	0.421	23%	0.228	S	C	.	.	S	Bend	trans	52.4	56.4	-179.5	-61.2	84.5	0	0	0	112.8	G206 N207 D252 H253	G206-H232 VanDerWaalsContact CA-O 3.32Å; G206-H232 WeakPolarHBondContact CA-O 3.26Å; G206-H232 PolarHBondContact N-O 3.03Å; N207-H232 PolarHBondContact N-O 2.97Å; N207-H232 VanDerWaalsContact N-O 3.1Å; H232-D252 IonicContact CE1-OD2 3.62Å; H232-D252 PolarHBondContact N-O 3.5Å; H232-D252 VanDerWaalsContact N-O 3.11Å; H232-H253 VanDerWaalsContact CA-O 3.31Å; H232-H253 WeakPolarHBondContact CA-O 3.45Å; H232-H253 AromaticContact CD2-CG 3.88Å; H232-H253 AromaticContact CE1-CG 3.61Å; H232-H253 AromaticContact CE1-ND1 3.42Å; H232-H253 PolarHBondContact CE1-ND1 3.45Å; H232-H253 PolarHBondContact N-O 2.87Å; H232-H253 AromaticContact NE2-CD2 3.73Å; H232-H253 AromaticContact NE2-CG 3.41Å; H232-H253 AromaticContact NE2-ND1 3.62Å
233	N	98.9	Very high	98.2	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	23%	0.231	C	C	.	.	S	Bend	trans	-135.6	-170.5	178.5	-88.9	-81.8	0	0	0	110.6	L204 N207 Q208 I209 L230 D231 L235 H253 N254 Q255	L204-N233 PolarHBondContact O-ND2 3.31Å; N207-N233 WeakPolarHBondContact CA-OD1 3.23Å; N207-N233 WeakPolarHBondContact CB-OD1 3.35Å; N207-N233 PolarHBondContact O-OD1 3.25Å; Q208-N233 PolarHBondContact N-OD1 3.21Å; I209-N233 HydrophobicContact CB-CB 4.45Å; I209-N233 VanDerWaalsContact CB-OD1 3.23Å; I209-N233 WeakPolarHBondContact CB-OD1 3.13Å; I209-N233 VanDerWaalsContact CG1-OD1 3.26Å; I209-N233 WeakPolarHBondContact CG1-OD1 3.13Å; I209-N233 PolarHBondContact N-OD1 3.16Å; L230-N233 PolarHBondContact O-ND2 3.1Å; D231-N233 PolarHBondContact O-N 2.67Å; D231-N233 PolarHBondContact O-ND2 2.9Å; N233-L235 HydrophobicContact CB-CG 4.27Å; N233-H253 PolarHBondContact N-O 2.93Å; N233-N254 WeakPolarHBondContact CA-OD1 3.43Å; N233-N254 WeakPolarHBondContact CB-OD1 3.26Å; N233-N254 PolarHBondContact N-OD1 3.38Å; N233-N254 PolarHBondContact O-OD1 3.29Å; N233-N254 VanDerWaalsContact O-OD1 3.14Å; N233-Q255 PolarHBondContact O-NE2 3.24Å; N233-Q255 VanDerWaalsContact O-NE2 3.14Å
234	N	98.8	Very high	98.2	Very high	63 Å²	63	46.4 Å²	46.4	34%	0.337	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-110.6	36.3	179.2	-64.9	101.8	0	0	0	112.7	Q208 I209 T210 T236 N254 Q255	Q208-N234 WeakPolarHBondContact CA-OD1 3.27Å; I209-N234 CarbonylContact O-C 3.21Å; I209-N234 VanDerWaalsContact O-CA 3.27Å; I209-N234 WeakPolarHBondContact O-CA 3.32Å; I209-N234 WeakPolarHBondContact O-CB 3.37Å; I209-N234 PolarHBondContact O-N 3.39Å; T210-N234 HydrophobicContact CG2-CB 3.95Å; N234-T236 PolarHBondContact O-N 3.35Å; N234-N254 PolarHBondContact N-OD1 3.47Å; N234-Q255 PolarHBondContact ND2-OE1 3.41Å
235	L	98.9	Very high	98.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.209	C	C	.	.			trans	-74.7	127.6	179.5	-57.9	176.7	0	0	0	110	I209 S211 V214 L230 N233 L251 N254 Q255 I256	I209-L235 HydrophobicContact CG2-CD2 4.02Å; I209-L235 PolarHBondContact O-N 2.95Å; S211-L235 WeakPolarHBondContact OG-CA 3.21Å; V214-L235 HydrophobicContact CG2-CD2 4.17Å; L230-L235 HydrophobicContact CB-CD1 4.07Å; L230-L235 HydrophobicContact CD1-CD1 4.47Å; N233-L235 HydrophobicContact CB-CG 4.27Å; L235-L251 HydrophobicContact CD1-CD2 3.89Å; L235-N254 HydrophobicContact CB-CB 4.2Å; L235-N254 WeakPolarHBondContact CB-OD1 3.4Å; L235-N254 VanDerWaalsContact CG-OD1 3.3Å; L235-N254 WeakPolarHBondContact CG-OD1 3.25Å; L235-N254 PolarHBondContact N-OD1 3.28Å; L235-Q255 CarbonylContact O-C 3.53Å; L235-Q255 VanDerWaalsContact O-CA 3.32Å; L235-Q255 WeakPolarHBondContact O-CA 3.46Å; L235-Q255 PolarHBondContact O-N 3.4Å; L235-I256 HydrophobicContact CB-CG1 4.26Å; L235-I256 PolarHBondContact O-N 3.43Å; L235-I256 VanDerWaalsContact O-N 3.16Å
236	T	98.8	Very high	98.2	Very high	56 Å²	56	41.9 Å²	41.9	34%	0.344	21%	0.209	S	C	.	.			trans	-102.9	-11.4	176.8	55.3	0	0	0	0	113.2	S211 N234 Q255 S257	S211-T236 PolarHBondContact OG-N 2.83Å; N234-T236 PolarHBondContact O-N 3.35Å; T236-Q255 WeakPolarHBondContact CA-O 3.3Å; T236-Q255 HydrophobicContact CG2-CB 4.28Å; T236-S257 PolarHBondContact O-N 2.91Å; T236-S257 PolarHBondContact O-OG 3.33Å
237	R	98.7	Very high	98.2	Very high	115 Å²	115	44.5 Å²	44.5	43%	0.434	22%	0.217	S	C	.	.	S	Bend	trans	-142.4	152.2	-178.3	-57.5	-177.5	-58.3	-89.2	1.8	110.2	S211 D212	S211-R237 PolarHBondContact O-NH2 3.38Å; S211-R237 PolarHBondContact OG-N 3.1Å; S211-R237 PolarHBondContact OG-O 2.81Å; D212-R237 IonicContact OD1-CZ 3.73Å; D212-R237 VanDerWaalsContact OD1-CZ 3.26Å; D212-R237 IonicContact OD1-NH1 3.83Å; D212-R237 PolarHBondContact OD1-NH1 2.96Å; D212-R237 IonicContact OD1-NH2 3.95Å; D212-R237 PolarHBondContact OD1-NH2 2.95Å
238	M	98.4	Very high	98.2	Very high	25 Å²	25	44.1 Å²	44.1	12%	0.123	22%	0.217	C	C	.	.			trans	-53.9	128.6	172.1	-66.6	-62	-69.6	0	0	111.2	L251 I256 V259 A263 L264 L275	M238-L251 HydrophobicContact CE-CD1 3.55Å; M238-L251 HydrophobicContact SD-CD1 3.92Å; M238-I256 HydrophobicContact CG-CG2 4.31Å; M238-I256 HydrophobicContact SD-CD1 4.11Å; M238-I256 HydrophobicContact SD-CG2 4.09Å; M238-V259 HydrophobicContact CE-CG1 4.33Å; M238-V259 HydrophobicContact CG-CB 4.37Å; M238-V259 HydrophobicContact CG-CG1 4.17Å; M238-V259 HydrophobicContact CG-CG2 4.22Å; M238-V259 HydrophobicContact SD-CG1 4.38Å; M238-V259 HydrophobicContact SD-CG2 3.92Å; M238-A263 HydrophobicContact CB-CB 4.11Å; M238-A263 HydrophobicContact CG-CB 4.14Å; M238-L264 HydrophobicContact CE-CD2 3.82Å; M238-L264 HydrophobicContact CE-CG 4.4Å; M238-L275 HydrophobicContact CE-CD2 4.49Å; M238-L275 HydrophobicContact SD-CD2 4.04Å
239	P	97.1	Very high	98.2	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.071	22%	0.217	C	C	.	.			trans	-73	146.9	172.7	30.9	-33.6	0	0	0	110.4	L230 L251	L230-P239 HydrophobicContact CD1-CB 4.34Å; L230-P239 HydrophobicContact CD1-CG 3.89Å; P239-L251 HydrophobicContact CG-CD1 4.4Å; P239-L251 HydrophobicContact CG-CD2 3.78Å
240	G	93.1	Very high	98.2	Very high	44 Å²	44	43.7 Å²	43.7	45%	0.454	22%	0.217	S	C	.	.			trans	177.6	173.8	176.2	0	0	0	0	0	115
241	P	96.4	Very high	98.2	Very high	74 Å²	74	43.6 Å²	43.6	48%	0.481	22%	0.216	S	C	.	.	S	Bend	cis	-72.9	144	-1.3	30.3	-35	0	0	0	112.4	K217 S220	K217-P241 HydrophobicContact CG-CG 4.41Å; S220-P241 WeakPolarHBondContact OG-CG 3.45Å
242	L	97.9	Very high	98.2	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.105	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-92.8	151.8	-179.6	-64.6	174.5	0	0	0	111.5	F219 L228 L246 L249 L264 L267	F219-L242 HydrophobicContact CD2-CD2 4.2Å; L228-L242 HydrophobicContact CD2-CD2 3.85Å; L242-L246 HydrophobicContact CB-CD1 3.97Å; L242-L246 HydrophobicContact CD1-CD1 4.21Å; L242-L246 HydrophobicContact CD2-CD1 4.34Å; L242-L246 HydrophobicContact CG-CD1 4.41Å; L242-L249 HydrophobicContact CD1-CD2 3.62Å; L242-L264 HydrophobicContact CD1-CD2 4.42Å; L242-L267 HydrophobicContact CB-CD1 4.37Å; L242-L267 HydrophobicContact CB-CD2 4.25Å; L242-L267 HydrophobicContact CD1-CD1 4.13Å
243	P	97.7	Very high	98.2	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.058	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-74.2	138.4	178.3	27.1	-29.1	0	0	0	111.5	L222 L225 S245 L246 L267	L222-P243 WeakPolarHBondContact O-CB 3.42Å; L225-P243 HydrophobicContact CB-CG 3.74Å; L225-P243 HydrophobicContact CD2-CG 3.73Å; L225-P243 HydrophobicContact CG-CG 4.32Å; P243-S245 PolarHBondContact O-N 3.06Å; P243-S245 VanDerWaalsContact O-N 3.1Å; P243-L246 HydrophobicContact CG-CD1 4.46Å; P243-L246 HydrophobicContact CG-CG 4.11Å; P243-L246 PolarHBondContact O-N 2.8Å; P243-L267 VanDerWaalsContact O-CD2 3.23Å; P243-L267 WeakPolarHBondContact O-CD2 3.4Å
244	R	98.2	Very high	98.2	Very high	179 Å²	179	42 Å²	42	68%	0.675	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.5	-176.4	-62.2	-176.2	-177.3	168	-1.9	114.8	L246 G266	R244-L246 VanDerWaalsContact C-N 3.34Å; R244-G266 WeakPolarHBondContact CB-O 3.3Å; R244-G266 WeakPolarHBondContact CG-O 3.14Å
245	S	98.5	Very high	98.2	Very high	23 Å²	23	41.7 Å²	41.7	16%	0.161	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.2	178.1	34.2	0	0	0	0	114.2	R223 L225 P243 R247	R223-S245 WeakPolarHBondContact O-CB 3.12Å; R223-S245 PolarHBondContact O-OG 3.25Å; L225-S245 PolarHBondContact N-OG 2.98Å; L225-S245 CarbonylContact O-C 3.56Å; L225-S245 WeakPolarHBondContact O-CB 3.35Å; L225-S245 PolarHBondContact O-OG 2.93Å; P243-S245 PolarHBondContact O-N 3.06Å; P243-S245 VanDerWaalsContact O-N 3.1Å; S245-R247 PolarHBondContact O-N 2.86Å
246	L	98.8	Very high	98.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.			trans	-56.3	136.7	-178.8	-80.7	177.8	0	0	0	112.1	L225 L228 L242 P243 R244 N269 L270	L225-L246 HydrophobicContact CD2-CD2 3.94Å; L225-L246 HydrophobicContact CG-CD2 3.96Å; L225-L246 WeakPolarHBondContact O-CA 3.46Å; L225-L246 PolarHBondContact O-N 3.22Å; L228-L246 HydrophobicContact CB-CD2 3.96Å; L242-L246 HydrophobicContact CB-CD1 3.97Å; L242-L246 HydrophobicContact CD1-CD1 4.21Å; L242-L246 HydrophobicContact CD2-CD1 4.34Å; L242-L246 HydrophobicContact CG-CD1 4.41Å; P243-L246 HydrophobicContact CG-CD1 4.46Å; P243-L246 HydrophobicContact CG-CG 4.11Å; P243-L246 PolarHBondContact O-N 2.8Å; R244-L246 VanDerWaalsContact C-N 3.34Å; L246-N269 CarbonylContact O-C 3.11Å; L246-N269 VanDerWaalsContact O-C 3.22Å; L246-L270 HydrophobicContact CB-CD1 4.07Å; L246-L270 WeakPolarHBondContact O-CA 3.44Å; L246-L270 PolarHBondContact O-N 3.09Å; L246-L270 VanDerWaalsContact O-N 3.16Å
247	R	98.8	Very high	98.2	Very high	108 Å²	108	41.4 Å²	41.4	41%	0.408	21%	0.205	S	C	.	.	S	Bend	trans	-111	-39.2	174.4	-63.6	-180	-179.9	-95.7	2.6	111.2	E226 S245 L270 T271 A272	E226-R247 HydrophobicContact CB-CG 4.44Å; E226-R247 PolarHBondContact O-N 2.83Å; E226-R247 IonicContact OE1-CZ 3.9Å; E226-R247 IonicContact OE1-NE 2.69Å; E226-R247 PolarHBondContact OE1-NE 3.26Å; E226-R247 VanDerWaalsContact OE1-NE 3.16Å; E226-R247 IonicContact OE1-NH2 3.82Å; S245-R247 PolarHBondContact O-N 2.86Å; R247-L270 WeakPolarHBondContact O-CD1 3.42Å; R247-T271 PolarHBondContact O-N 3.49Å; R247-T271 PolarHBondContact O-OG1 2.99Å; R247-A272 PolarHBondContact O-N 2.87Å
248	E	98.9	Very high	98.2	Very high	44 Å²	44	42.6 Å²	42.6	21%	0.206	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.7	-179.1	-64.6	165.5	-145	0	0	110.4	E226 R227 L228 A272	E226-E248 PolarHBondContact O-N 3.38Å; E226-E248 VanDerWaalsContact O-N 3.09Å; R227-E248 WeakPolarHBondContact CD-OE2 3.45Å; R227-E248 HydrophobicContact CG-CB 4.21Å; R227-E248 IonicContact CZ-OE1 2.75Å; R227-E248 VanDerWaalsContact CZ-OE1 3.3Å; R227-E248 IonicContact CZ-OE2 3.96Å; R227-E248 IonicContact NE-OE1 3.91Å; R227-E248 PolarHBondContact NE-OE1 3.18Å; R227-E248 IonicContact NE-OE2 3.44Å; R227-E248 PolarHBondContact NE-OE2 3Å; R227-E248 IonicContact NH2-OE1 3.52Å; R227-E248 PolarHBondContact NH2-OE1 3.3Å; L228-E248 PolarHBondContact N-O 3.17Å; E248-A272 HydrophobicContact CG-CB 4.33Å
249	L	98.9	Very high	98.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	117.4	178.8	179.2	60.8	0	0	0	110.2	L228 L242 L251 L264 L270 A272 L273 Y274	L228-L249 HydrophobicContact CB-CD1 4.08Å; L228-L249 HydrophobicContact CD2-CD1 3.98Å; L228-L249 HydrophobicContact CG-CD1 4.15Å; L242-L249 HydrophobicContact CD1-CD2 3.62Å; L249-L251 HydrophobicContact CD1-CD1 4.22Å; L249-L251 HydrophobicContact CD1-CG 4.08Å; L249-L251 HydrophobicContact CD2-CD1 3.77Å; L249-L251 HydrophobicContact CD2-CG 4.44Å; L249-L251 HydrophobicContact CG-CD1 3.92Å; L249-L251 HydrophobicContact CG-CG 4.04Å; L249-L264 HydrophobicContact CD2-CD2 4.19Å; L249-L270 HydrophobicContact CB-CD1 3.96Å; L249-A272 PolarHBondContact N-O 3.39Å; L249-L273 HydrophobicContact CB-CD1 4.06Å; L249-L273 HydrophobicContact CD2-CD1 3.85Å; L249-L273 HydrophobicContact CG-CD1 4.05Å; L249-Y274 PolarHBondContact O-N 3.18Å
250	H	98.9	Very high	98.2	Very high	33 Å²	33	43.4 Å²	43.4	15%	0.153	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.6	175.9	-63.5	-110.1	0	0	0	109.9	L228 Y229 L230 D231 D252 Y274	L228-H250 PolarHBondContact O-N 3.09Å; Y229-H250 HydrophobicContact CD1-CB 4.09Å; Y229-H250 AromaticContact CD1-CD2 3.41Å; Y229-H250 VanDerWaalsContact CD1-CD2 3.41Å; Y229-H250 WeakPolarHBondContact CD1-CD2 3.4Å; Y229-H250 AromaticContact CD1-CG 3.66Å; Y229-H250 AromaticContact CD1-NE2 3.89Å; Y229-H250 AromaticContact CE1-CD2 3.42Å; Y229-H250 VanDerWaalsContact CE1-CD2 3.42Å; Y229-H250 WeakPolarHBondContact CE1-CD2 3.35Å; Y229-H250 AromaticContact CE1-NE2 3.45Å; Y229-H250 WeakPolarHBondContact CE1-NE2 3.37Å; L230-H250 CarbonylContact C-O 3.17Å; L230-H250 WeakPolarHBondContact CA-O 3.23Å; L230-H250 PolarHBondContact N-O 3.44Å; D231-H250 HydrophobicContact CB-CB 4.17Å; D231-H250 PolarHBondContact N-O 3.45Å; D231-H250 WeakPolarHBondContact OD1-CB 3.35Å; H250-D252 IonicContact ND1-OD1 3.99Å; H250-Y274 AromaticContact CD2-CD2 3.96Å; H250-Y274 AromaticContact CE1-CD2 3.32Å; H250-Y274 WeakPolarHBondContact CE1-CD2 3.32Å; H250-Y274 AromaticContact CE1-CE2 3.29Å; H250-Y274 WeakPolarHBondContact CE1-CE2 3.16Å; H250-Y274 AromaticContact CG-CD2 3.81Å; H250-Y274 AromaticContact ND1-CD2 3.42Å; H250-Y274 WeakPolarHBondContact ND1-CD2 3.29Å; H250-Y274 AromaticContact ND1-CE2 3.89Å; H250-Y274 AromaticContact ND1-CG 3.97Å; H250-Y274 AromaticContact NE2-CD2 3.67Å; H250-Y274 AromaticContact NE2-CE2 3.53Å
251	L	98.9	Very high	98.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.			trans	-134.1	10.7	178.3	-72.9	171.5	0	0	0	111.5	L230 L235 M238 P239 L249 N254 I256 Y274 L275 N278	L230-L251 HydrophobicContact CB-CD2 3.76Å; L230-L251 HydrophobicContact CD1-CD2 4.2Å; L235-L251 HydrophobicContact CD1-CD2 3.89Å; M238-L251 HydrophobicContact CE-CD1 3.55Å; M238-L251 HydrophobicContact SD-CD1 3.92Å; P239-L251 HydrophobicContact CG-CD1 4.4Å; P239-L251 HydrophobicContact CG-CD2 3.78Å; L249-L251 HydrophobicContact CD1-CD1 4.22Å; L249-L251 HydrophobicContact CD1-CG 4.08Å; L249-L251 HydrophobicContact CD2-CD1 3.77Å; L249-L251 HydrophobicContact CD2-CG 4.44Å; L249-L251 HydrophobicContact CG-CD1 3.92Å; L249-L251 HydrophobicContact CG-CG 4.04Å; L251-N254 PolarHBondContact O-ND2 3.2Å; L251-I256 HydrophobicContact CB-CD1 4.03Å; L251-I256 HydrophobicContact CD1-CD1 4.42Å; L251-I256 HydrophobicContact CD2-CD1 4.37Å; L251-Y274 CarbonylContact C-O 3.24Å; L251-Y274 PolarHBondContact N-O 3.27Å; L251-L275 HydrophobicContact CB-CD2 3.72Å; L251-L275 HydrophobicContact CD1-CD2 4.05Å; L251-N278 PolarHBondContact O-ND2 2.96Å
252	D	98.9	Very high	98.5	Very high	9 Å²	9	47.4 Å²	47.4	5%	0.048	22%	0.224	C	C	.	.			trans	-64.4	163.9	177.1	55.4	-81.2	0	0	0	112.7	D231 H232 H250 N254 Y274 H276	D231-D252 CarbonylContact C-O 3.6Å; D231-D252 WeakPolarHBondContact CA-O 3.41Å; D231-D252 WeakPolarHBondContact CB-O 3.45Å; D231-D252 WeakPolarHBondContact CB-OD1 3.44Å; D231-D252 WeakPolarHBondContact CB-OD2 3.33Å; H232-D252 IonicContact CE1-OD2 3.62Å; H232-D252 PolarHBondContact N-O 3.5Å; H232-D252 VanDerWaalsContact N-O 3.11Å; H250-D252 IonicContact ND1-OD1 3.99Å; D252-N254 VanDerWaalsContact C-N 3.31Å; D252-N254 PolarHBondContact O-N 2.67Å; D252-N254 PolarHBondContact O-ND2 2.75Å; D252-Y274 PolarHBondContact N-O 3.22Å; D252-Y274 WeakPolarHBondContact OD1-CB 3.39Å; D252-H276 CarbonylContact C-O 3.5Å; D252-H276 WeakPolarHBondContact CA-O 3.39Å; D252-H276 WeakPolarHBondContact CB-CD2 3.27Å; D252-H276 VanDerWaalsContact CB-NE2 3.3Å; D252-H276 WeakPolarHBondContact CB-NE2 3.25Å; D252-H276 VanDerWaalsContact CB-O 3.25Å; D252-H276 WeakPolarHBondContact CB-O 3.49Å; D252-H276 IonicContact OD2-CE1 2.96Å; D252-H276 IonicContact OD2-NE2 3.82Å; D252-H276 PolarHBondContact OD2-NE2 3.45Å
253	H	98.9	Very high	98.5	Very high	62 Å²	62	47.4 Å²	47.4	29%	0.287	23%	0.227	S	C	.	.	S	Bend	trans	53.6	47	179.8	-60.4	88.8	0	0	0	113.2	H232 N233 H276 H277	H232-H253 VanDerWaalsContact CA-O 3.31Å; H232-H253 WeakPolarHBondContact CA-O 3.45Å; H232-H253 AromaticContact CD2-CG 3.88Å; H232-H253 AromaticContact CE1-CG 3.61Å; H232-H253 AromaticContact CE1-ND1 3.42Å; H232-H253 PolarHBondContact CE1-ND1 3.45Å; H232-H253 PolarHBondContact N-O 2.87Å; H232-H253 AromaticContact NE2-CD2 3.73Å; H232-H253 AromaticContact NE2-CG 3.41Å; H232-H253 AromaticContact NE2-ND1 3.62Å; N233-H253 PolarHBondContact N-O 2.93Å; H253-H276 AromaticContact CE1-CD2 3.51Å; H253-H276 AromaticContact CE1-NE2 3.25Å; H253-H276 PolarHBondContact CE1-NE2 3.07Å; H253-H276 PolarHBondContact N-O 3.05Å; H253-H276 AromaticContact ND1-CD2 3.78Å; H253-H276 AromaticContact ND1-NE2 3.52Å; H253-H277 VanDerWaalsContact CA-O 3.26Å; H253-H277 WeakPolarHBondContact CA-O 3.4Å; H253-H277 AromaticContact CD2-CG 3.96Å; H253-H277 AromaticContact CE1-CD2 3.66Å; H253-H277 PolarHBondContact N-O 3.23Å; H253-H277 AromaticContact NE2-CD2 3.28Å; H253-H277 PolarHBondContact NE2-CD2 3.19Å; H253-H277 VanDerWaalsContact NE2-CD2 3.28Å; H253-H277 AromaticContact NE2-CG 3.66Å
254	N	98.9	Very high	98.5	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	23%	0.225	C	C	.	.	S	Bend	trans	-124.3	-166	174.6	-85.3	-84.5	0	0	0	109.4	L230 N233 N234 L235 L251 D252 I256 H277 N278	L230-N254 PolarHBondContact O-ND2 2.96Å; N233-N254 WeakPolarHBondContact CA-OD1 3.43Å; N233-N254 WeakPolarHBondContact CB-OD1 3.26Å; N233-N254 PolarHBondContact N-OD1 3.38Å; N233-N254 PolarHBondContact O-OD1 3.29Å; N233-N254 VanDerWaalsContact O-OD1 3.14Å; N234-N254 PolarHBondContact N-OD1 3.47Å; L235-N254 HydrophobicContact CB-CB 4.2Å; L235-N254 WeakPolarHBondContact CB-OD1 3.4Å; L235-N254 VanDerWaalsContact CG-OD1 3.3Å; L235-N254 WeakPolarHBondContact CG-OD1 3.25Å; L235-N254 PolarHBondContact N-OD1 3.28Å; L251-N254 PolarHBondContact O-ND2 3.2Å; D252-N254 VanDerWaalsContact C-N 3.31Å; D252-N254 PolarHBondContact O-N 2.67Å; D252-N254 PolarHBondContact O-ND2 2.75Å; N254-I256 HydrophobicContact CB-CD1 4.35Å; N254-I256 HydrophobicContact CB-CG1 4.13Å; N254-H277 PolarHBondContact N-O 3.33Å; N254-N278 WeakPolarHBondContact CA-OD1 3.13Å; N254-N278 WeakPolarHBondContact CB-OD1 3.38Å; N254-N278 PolarHBondContact O-OD1 3.19Å
255	Q	98.8	Very high	98.4	Very high	56 Å²	56	45.3 Å²	45.3	26%	0.262	22%	0.224	S	C	.	.			trans	-120.3	33.8	176.7	-58.8	88.4	64.2	0	0	111	N233 N234 L235 T236 S257 N278	N233-Q255 PolarHBondContact O-NE2 3.24Å; N233-Q255 VanDerWaalsContact O-NE2 3.14Å; N234-Q255 PolarHBondContact ND2-OE1 3.41Å; L235-Q255 CarbonylContact O-C 3.53Å; L235-Q255 VanDerWaalsContact O-CA 3.32Å; L235-Q255 WeakPolarHBondContact O-CA 3.46Å; L235-Q255 PolarHBondContact O-N 3.4Å; T236-Q255 WeakPolarHBondContact CA-O 3.3Å; T236-Q255 HydrophobicContact CG2-CB 4.28Å; Q255-S257 PolarHBondContact O-N 3.31Å; Q255-N278 PolarHBondContact N-OD1 2.95Å
256	I	98.9	Very high	98.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.			trans	-67.5	120.4	-176.9	-60.7	170.8	0	0	0	108.6	L235 M238 L251 N254 L275 N278 E279 I280	L235-I256 HydrophobicContact CB-CG1 4.26Å; L235-I256 PolarHBondContact O-N 3.43Å; L235-I256 VanDerWaalsContact O-N 3.16Å; M238-I256 HydrophobicContact CG-CG2 4.31Å; M238-I256 HydrophobicContact SD-CD1 4.11Å; M238-I256 HydrophobicContact SD-CG2 4.09Å; L251-I256 HydrophobicContact CB-CD1 4.03Å; L251-I256 HydrophobicContact CD1-CD1 4.42Å; L251-I256 HydrophobicContact CD2-CD1 4.37Å; N254-I256 HydrophobicContact CB-CD1 4.35Å; N254-I256 HydrophobicContact CB-CG1 4.13Å; I256-L275 HydrophobicContact CD1-CD2 4.36Å; I256-N278 HydrophobicContact CB-CB 4.38Å; I256-N278 VanDerWaalsContact CB-OD1 3.27Å; I256-N278 WeakPolarHBondContact CB-OD1 3.34Å; I256-N278 WeakPolarHBondContact CG1-OD1 3.43Å; I256-N278 PolarHBondContact N-OD1 3.06Å; I256-E279 CarbonylContact O-C 3.53Å; I256-E279 WeakPolarHBondContact O-CA 3.15Å; I256-E279 PolarHBondContact O-N 2.92Å; I256-I280 HydrophobicContact CB-CG1 4.42Å; I256-I280 HydrophobicContact CG2-CG1 4.21Å; I256-I280 VanDerWaalsContact O-CG1 3.25Å; I256-I280 WeakPolarHBondContact O-CG1 3.49Å; I256-I280 PolarHBondContact O-N 3.23Å; I256-I280 VanDerWaalsContact O-N 3.07Å
257	S	98.4	Very high	98.3	Very high	50 Å²	50	45.5 Å²	45.5	35%	0.35	23%	0.229	S	C	.	.			trans	-92	-20.3	-174.6	55.2	0	0	0	0	114.3	T236 Q255 E279 I280 Q281	T236-S257 PolarHBondContact O-N 2.91Å; T236-S257 PolarHBondContact O-OG 3.33Å; Q255-S257 PolarHBondContact O-N 3.31Å; S257-E279 WeakPolarHBondContact CA-O 3.37Å; S257-I280 WeakPolarHBondContact O-CA 3.19Å; S257-Q281 PolarHBondContact O-N 3.02Å
258	R	98.1	Very high	98.3	Very high	140 Å²	140	44.3 Å²	44.3	53%	0.528	23%	0.228	S	C	.	.			trans	-158.4	146.4	-176.4	-173	176.9	-176.1	-179.3	4.9	111.9	P260	R258-P260 WeakPolarHBondContact O-CD 3.33Å
259	V	98.6	Very high	98.3	Very high	1 Å²	1	46 Å²	46	1%	0.006	24%	0.238	C	C	.	.			trans	-106.8	107.6	166.2	-174	0	0	0	0	109.4	M238 A263 L264 L275 I280 E282 V283 M287	M238-V259 HydrophobicContact CE-CG1 4.33Å; M238-V259 HydrophobicContact CG-CB 4.37Å; M238-V259 HydrophobicContact CG-CG1 4.17Å; M238-V259 HydrophobicContact CG-CG2 4.22Å; M238-V259 HydrophobicContact SD-CG1 4.38Å; M238-V259 HydrophobicContact SD-CG2 3.92Å; V259-A263 HydrophobicContact CG1-CB 4.16Å; V259-L264 HydrophobicContact CG1-CD1 4.42Å; V259-L275 HydrophobicContact CG2-CD1 4.18Å; V259-I280 HydrophobicContact CG2-CD1 4.06Å; V259-I280 HydrophobicContact CG2-CG2 4.29Å; V259-E282 PolarHBondContact N-O 2.92Å; V259-V283 HydrophobicContact CB-CB 4.17Å; V259-V283 HydrophobicContact CB-CG1 4.02Å; V259-V283 HydrophobicContact CG2-CG1 3.91Å; V259-M287 HydrophobicContact CG1-CE 4.34Å
260	P	98	Very high	98.3	Very high	52 Å²	52	46 Å²	46	34%	0.338	24%	0.238	S	C	.	.			trans	-62.2	150.1	174	-22.6	31.7	0	0	0	112.9	R258 N262 A263 S286	R258-P260 WeakPolarHBondContact O-CD 3.33Å; P260-N262 PolarHBondContact O-N 3.19Å; P260-N262 VanDerWaalsContact O-N 3.09Å; P260-A263 HydrophobicContact CB-CB 4.27Å; P260-A263 HydrophobicContact CG-CB 4.41Å; P260-A263 VanDerWaalsContact O-CB 3.26Å; P260-A263 WeakPolarHBondContact O-CB 3.36Å; P260-A263 PolarHBondContact O-N 3.38Å; P260-S286 WeakPolarHBondContact O-CB 3.34Å
261	N	97.9	Very high	98.3	Very high	93 Å²	93	46.2 Å²	46.2	50%	0.497	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.5	-177.4	-68.3	-12.2	0	0	0	114.1	S285 S286	N261-S285 PolarHBondContact OD1-N 3.44Å; N261-S286 WeakPolarHBondContact O-CA 3.49Å
262	N	97.2	Very high	98.3	Very high	109 Å²	109	46.8 Å²	46.8	58%	0.583	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	5.7	-179.2	69.4	-36.8	0	0	0	113.8	P260 L264 E265	P260-N262 PolarHBondContact O-N 3.19Å; P260-N262 VanDerWaalsContact O-N 3.09Å; N262-L264 PolarHBondContact O-N 3.24Å; N262-E265 WeakPolarHBondContact O-CB 3.14Å; N262-E265 PolarHBondContact O-N 2.89Å
263	A	97.7	Very high	98.3	Very high	21 Å²	21	46.4 Å²	46.4	17%	0.174	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-29	-175.1	0	0	0	0	0	113.3	M238 V259 P260	M238-A263 HydrophobicContact CB-CB 4.11Å; M238-A263 HydrophobicContact CG-CB 4.14Å; V259-A263 HydrophobicContact CG1-CB 4.16Å; P260-A263 HydrophobicContact CB-CB 4.27Å; P260-A263 HydrophobicContact CG-CB 4.41Å; P260-A263 VanDerWaalsContact O-CB 3.26Å; P260-A263 WeakPolarHBondContact O-CB 3.36Å; P260-A263 PolarHBondContact O-N 3.38Å
264	L	98.1	Very high	98.3	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	23.1	-176.7	-55.3	171	0	0	0	111.9	M238 L242 L249 V259 N262 G266 L267 L273 M287 L290	M238-L264 HydrophobicContact CE-CD2 3.82Å; M238-L264 HydrophobicContact CE-CG 4.4Å; L242-L264 HydrophobicContact CD1-CD2 4.42Å; L249-L264 HydrophobicContact CD2-CD2 4.19Å; V259-L264 HydrophobicContact CG1-CD1 4.42Å; N262-L264 PolarHBondContact O-N 3.24Å; L264-G266 PolarHBondContact O-N 3.13Å; L264-L267 HydrophobicContact CB-CD1 4.18Å; L264-L267 HydrophobicContact CD2-CD1 3.84Å; L264-L267 PolarHBondContact O-N 3.44Å; L264-L273 HydrophobicContact CD1-CD2 3.62Å; L264-M287 HydrophobicContact CD1-CE 3.96Å; L264-M287 HydrophobicContact CD1-SD 3.79Å; L264-L290 HydrophobicContact CB-CD2 4.06Å; L264-L290 HydrophobicContact CD1-CD1 4Å
265	E	96.6	Very high	98.3	Very high	140 Å²	140	46 Å²	46	65%	0.654	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	126.4	-175.4	-172.9	-177.9	172.9	0	0	112.2	N262 L267	N262-E265 WeakPolarHBondContact O-CB 3.14Å; N262-E265 PolarHBondContact O-N 2.89Å; E265-L267 VanDerWaalsContact C-N 3.31Å; E265-L267 PolarHBondContact O-N 3.31Å
266	G	97.1	Very high	98.3	Very high	24 Å²	24	44.8 Å²	44.8	25%	0.247	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	7.6	175.2	0	0	0	0	0	115.4	R244 L264 E268	R244-G266 WeakPolarHBondContact CB-O 3.3Å; R244-G266 WeakPolarHBondContact CG-O 3.14Å; L264-G266 PolarHBondContact O-N 3.13Å; G266-E268 PolarHBondContact O-N 2.97Å
267	L	98.4	Very high	98.3	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	25%	0.252	C	S	.	.			trans	-78.2	56.1	173.4	-55.4	-170.8	0	0	0	111.4	L242 P243 L264 E265 N269 L270 L290	L242-L267 HydrophobicContact CB-CD1 4.37Å; L242-L267 HydrophobicContact CB-CD2 4.25Å; L242-L267 HydrophobicContact CD1-CD1 4.13Å; P243-L267 VanDerWaalsContact O-CD2 3.23Å; P243-L267 WeakPolarHBondContact O-CD2 3.4Å; L264-L267 HydrophobicContact CB-CD1 4.18Å; L264-L267 HydrophobicContact CD2-CD1 3.84Å; L264-L267 PolarHBondContact O-N 3.44Å; E265-L267 VanDerWaalsContact C-N 3.31Å; E265-L267 PolarHBondContact O-N 3.31Å; L267-N269 PolarHBondContact O-N 3.21Å; L267-L270 HydrophobicContact CB-CB 4.12Å; L267-L270 HydrophobicContact CD1-CD2 4.37Å; L267-L270 WeakPolarHBondContact O-CB 3.22Å; L267-L270 PolarHBondContact O-N 2.88Å; L267-L290 HydrophobicContact CB-CD2 3.87Å
268	E	98.3	Very high	98.3	Very high	83 Å²	83	46.4 Å²	46.4	39%	0.388	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.9	-174.7	-64.5	-170.7	-157.6	0	0	113.2	G266 R291 S292	G266-E268 PolarHBondContact O-N 2.97Å; E268-R291 IonicContact OE1-CZ 3.98Å; E268-R291 IonicContact OE1-NH1 3.54Å; E268-R291 IonicContact OE2-CZ 3.61Å; E268-R291 IonicContact OE2-NE 3.86Å; E268-R291 IonicContact OE2-NH1 2.81Å; E268-R291 PolarHBondContact OE2-NH1 3.11Å; E268-S292 WeakPolarHBondContact O-CB 3.2Å; E268-S292 PolarHBondContact O-N 2.94Å; E268-S292 PolarHBondContact O-OG 3.28Å
269	N	98.6	Very high	98.4	Very high	79 Å²	79	44 Å²	44	42%	0.422	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.3	179.5	-68.9	-5.7	0	0	0	113.8	L246 L267 T271	L246-N269 CarbonylContact O-C 3.11Å; L246-N269 VanDerWaalsContact O-C 3.22Å; L267-N269 PolarHBondContact O-N 3.21Å; N269-T271 PolarHBondContact O-N 3.07Å
270	L	98.9	Very high	98.4	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.			trans	-69.9	123	-177.4	-167	75.5	0	0	0	109.7	L246 R247 L249 L267 L273 L290 S292 L293	L246-L270 HydrophobicContact CB-CD1 4.07Å; L246-L270 WeakPolarHBondContact O-CA 3.44Å; L246-L270 PolarHBondContact O-N 3.09Å; L246-L270 VanDerWaalsContact O-N 3.16Å; R247-L270 WeakPolarHBondContact O-CD1 3.42Å; L249-L270 HydrophobicContact CB-CD1 3.96Å; L267-L270 HydrophobicContact CB-CB 4.12Å; L267-L270 HydrophobicContact CD1-CD2 4.37Å; L267-L270 WeakPolarHBondContact O-CB 3.22Å; L267-L270 PolarHBondContact O-N 2.88Å; L270-L273 HydrophobicContact CD2-CB 4.12Å; L270-L273 HydrophobicContact CD2-CD1 4.46Å; L270-L273 HydrophobicContact CD2-CD2 4.44Å; L270-L290 HydrophobicContact CD2-CD1 4.42Å; L270-L290 HydrophobicContact CD2-CD2 4.36Å; L270-S292 CarbonylContact O-C 3.28Å; L270-L293 HydrophobicContact CD2-CD1 4.19Å; L270-L293 HydrophobicContact CG-CD1 4.21Å; L270-L293 WeakPolarHBondContact O-CA 3.25Å; L270-L293 PolarHBondContact O-N 3.36Å; L270-L293 VanDerWaalsContact O-N 3.08Å
271	T	98.9	Very high	98.4	Very high	39 Å²	39	46.1 Å²	46.1	24%	0.239	24%	0.237	C	C	.	.			trans	-105.7	-30.7	-177.6	55.4	0	0	0	0	112.9	R247 N269 S292 I294 L295	R247-T271 PolarHBondContact O-N 3.49Å; R247-T271 PolarHBondContact O-OG1 2.99Å; N269-T271 PolarHBondContact O-N 3.07Å; T271-S292 WeakPolarHBondContact CA-O 3.46Å; T271-I294 PolarHBondContact O-N 3.07Å; T271-L295 PolarHBondContact O-N 3.31Å; T271-L295 VanDerWaalsContact O-N 3.14Å
272	A	98.9	Very high	98.3	Very high	12 Å²	12	45.4 Å²	45.4	10%	0.099	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.7	178.4	0	0	0	0	0	111.4	R247 E248 L249 Y274 L295	R247-A272 PolarHBondContact O-N 2.87Å; E248-A272 HydrophobicContact CG-CB 4.33Å; L249-A272 PolarHBondContact N-O 3.39Å; A272-Y274 HydrophobicContact CB-CE2 3.82Å; A272-L295 HydrophobicContact CB-CB 4.48Å
273	L	98.9	Very high	98.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	115.6	177.6	178.3	57.4	0	0	0	110.3	L249 L264 L270 L275 M287 L290 L293 L295 L296 D297	L249-L273 HydrophobicContact CB-CD1 4.06Å; L249-L273 HydrophobicContact CD2-CD1 3.85Å; L249-L273 HydrophobicContact CG-CD1 4.05Å; L264-L273 HydrophobicContact CD1-CD2 3.62Å; L270-L273 HydrophobicContact CD2-CB 4.12Å; L270-L273 HydrophobicContact CD2-CD1 4.46Å; L270-L273 HydrophobicContact CD2-CD2 4.44Å; L273-L275 HydrophobicContact CD1-CD1 4.18Å; L273-L275 HydrophobicContact CD1-CG 4.11Å; L273-L275 HydrophobicContact CD2-CD1 3.87Å; L273-L275 HydrophobicContact CG-CD1 3.92Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L273-M287 HydrophobicContact CD2-CE 4.06Å; L273-M287 HydrophobicContact CD2-SD 3.93Å; L273-L290 HydrophobicContact CD2-CD1 4.4Å; L273-L293 HydrophobicContact CB-CD1 3.97Å; L273-L295 PolarHBondContact N-O 3.29Å; L273-L295 VanDerWaalsContact N-O 3.1Å; L273-L296 HydrophobicContact CB-CD1 4.18Å; L273-L296 HydrophobicContact CD2-CD1 3.89Å; L273-L296 HydrophobicContact CG-CD1 4.09Å; L273-D297 PolarHBondContact O-N 3.07Å
274	Y	98.9	Very high	98.4	Very high	60 Å²	60	39.9 Å²	39.9	24%	0.235	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.8	178.2	-55.5	-85.2	0	0	0	110.2	L249 H250 L251 D252 A272 L295 D297	L249-Y274 PolarHBondContact O-N 3.18Å; H250-Y274 AromaticContact CD2-CD2 3.96Å; H250-Y274 AromaticContact CE1-CD2 3.32Å; H250-Y274 WeakPolarHBondContact CE1-CD2 3.32Å; H250-Y274 AromaticContact CE1-CE2 3.29Å; H250-Y274 WeakPolarHBondContact CE1-CE2 3.16Å; H250-Y274 AromaticContact CG-CD2 3.81Å; H250-Y274 AromaticContact ND1-CD2 3.42Å; H250-Y274 WeakPolarHBondContact ND1-CD2 3.29Å; H250-Y274 AromaticContact ND1-CE2 3.89Å; H250-Y274 AromaticContact ND1-CG 3.97Å; H250-Y274 AromaticContact NE2-CD2 3.67Å; H250-Y274 AromaticContact NE2-CE2 3.53Å; L251-Y274 CarbonylContact C-O 3.24Å; L251-Y274 PolarHBondContact N-O 3.27Å; D252-Y274 PolarHBondContact N-O 3.22Å; D252-Y274 WeakPolarHBondContact OD1-CB 3.39Å; A272-Y274 HydrophobicContact CB-CE2 3.82Å; Y274-L295 HydrophobicContact CD1-CD2 4.03Å; Y274-L295 HydrophobicContact CE1-CD1 4.31Å; Y274-L295 HydrophobicContact CE1-CD2 3.59Å; Y274-D297 HydrophobicContact CD1-CB 4.26Å
275	L	98.9	Very high	98.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.			trans	-131.6	11.7	179.4	-75.9	167.5	0	0	0	111.8	M238 L251 I256 V259 L273 N278 I280 M287 D297 L298 N301	M238-L275 HydrophobicContact CE-CD2 4.49Å; M238-L275 HydrophobicContact SD-CD2 4.04Å; L251-L275 HydrophobicContact CB-CD2 3.72Å; L251-L275 HydrophobicContact CD1-CD2 4.05Å; I256-L275 HydrophobicContact CD1-CD2 4.36Å; V259-L275 HydrophobicContact CG2-CD1 4.18Å; L273-L275 HydrophobicContact CD1-CD1 4.18Å; L273-L275 HydrophobicContact CD1-CG 4.11Å; L273-L275 HydrophobicContact CD2-CD1 3.87Å; L273-L275 HydrophobicContact CG-CD1 3.92Å; L273-L275 HydrophobicContact CG-CG 4.15Å; L275-N278 PolarHBondContact O-ND2 3.16Å; L275-N278 VanDerWaalsContact O-ND2 3.13Å; L275-I280 HydrophobicContact CB-CD1 3.87Å; L275-I280 HydrophobicContact CD1-CD1 4.29Å; L275-I280 HydrophobicContact CD2-CD1 4.06Å; L275-I280 HydrophobicContact CG-CD1 4.31Å; L275-M287 HydrophobicContact CD1-CE 4.23Å; L275-D297 CarbonylContact C-O 3.6Å; L275-D297 WeakPolarHBondContact CA-O 3.39Å; L275-D297 WeakPolarHBondContact CB-O 3.29Å; L275-D297 PolarHBondContact N-O 3.04Å; L275-L298 HydrophobicContact CB-CD2 3.86Å; L275-L298 HydrophobicContact CD1-CD2 3.88Å; L275-N301 PolarHBondContact O-ND2 3.07Å
276	H	98.9	Very high	98.4	Very high	31 Å²	31	35.1 Å²	35.1	14%	0.144	18%	0.184	C	C	.	.			trans	-64.6	160.6	179.9	62.8	-111.6	0	0	0	112.7	D252 H253 N278 D297 S299	D252-H276 CarbonylContact C-O 3.5Å; D252-H276 WeakPolarHBondContact CA-O 3.39Å; D252-H276 WeakPolarHBondContact CB-CD2 3.27Å; D252-H276 VanDerWaalsContact CB-NE2 3.3Å; D252-H276 WeakPolarHBondContact CB-NE2 3.25Å; D252-H276 VanDerWaalsContact CB-O 3.25Å; D252-H276 WeakPolarHBondContact CB-O 3.49Å; D252-H276 IonicContact OD2-CE1 2.96Å; D252-H276 IonicContact OD2-NE2 3.82Å; D252-H276 PolarHBondContact OD2-NE2 3.45Å; H253-H276 AromaticContact CE1-CD2 3.51Å; H253-H276 AromaticContact CE1-NE2 3.25Å; H253-H276 PolarHBondContact CE1-NE2 3.07Å; H253-H276 PolarHBondContact N-O 3.05Å; H253-H276 AromaticContact ND1-CD2 3.78Å; H253-H276 AromaticContact ND1-NE2 3.52Å; H276-N278 PolarHBondContact O-N 3.26Å; H276-N278 PolarHBondContact O-ND2 2.71Å; H276-D297 IonicContact CE1-OD2 3.53Å; H276-D297 IonicContact CG-OD2 3.07Å; H276-D297 PolarHBondContact N-O 3.46Å; H276-D297 IonicContact ND1-OD2 3.81Å; H276-D297 PolarHBondContact ND1-OD2 3.06Å; H276-S299 WeakPolarHBondContact CA-O 3.43Å; H276-S299 WeakPolarHBondContact CB-O 3.38Å; H276-S299 WeakPolarHBondContact CB-OG 3.28Å
277	H	98.9	Very high	98.5	Very high	77 Å²	77	34 Å²	34	36%	0.356	17%	0.172	S	C	.	.	S	Bend	trans	52.3	55.4	-178.3	-71.6	-68.6	0	0	0	112.3	H253 N254 S299 Y300	H253-H277 VanDerWaalsContact CA-O 3.26Å; H253-H277 WeakPolarHBondContact CA-O 3.4Å; H253-H277 AromaticContact CD2-CG 3.96Å; H253-H277 AromaticContact CE1-CD2 3.66Å; H253-H277 PolarHBondContact N-O 3.23Å; H253-H277 AromaticContact NE2-CD2 3.28Å; H253-H277 PolarHBondContact NE2-CD2 3.19Å; H253-H277 VanDerWaalsContact NE2-CD2 3.28Å; H253-H277 AromaticContact NE2-CG 3.66Å; N254-H277 PolarHBondContact N-O 3.33Å; H277-S299 PolarHBondContact N-O 2.9Å; H277-Y300 WeakPolarHBondContact CA-O 3.41Å; H277-Y300 AromaticContact CE1-CD1 3.45Å; H277-Y300 VanDerWaalsContact CE1-CD1 3.45Å; H277-Y300 WeakPolarHBondContact CE1-CD1 3.44Å; H277-Y300 AromaticContact CE1-CD2 3.75Å; H277-Y300 AromaticContact CE1-CE1 3.99Å; H277-Y300 AromaticContact CE1-CG 3.3Å; H277-Y300 PolarHBondContact N-O 2.88Å; H277-Y300 WeakPolarHBondContact ND1-CB 3.42Å; H277-Y300 AromaticContact ND1-CG 3.72Å; H277-Y300 AromaticContact NE2-CD2 3.65Å; H277-Y300 AromaticContact NE2-CG 3.71Å
278	N	98.9	Very high	98.4	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	20%	0.2	C	C	.	.	S	Bend	trans	-130.1	-171.6	172.5	-87.3	-82.8	0	0	0	109.7	L251 N254 Q255 I256 L275 H276 I280 Y300 N301	L251-N278 PolarHBondContact O-ND2 2.96Å; N254-N278 WeakPolarHBondContact CA-OD1 3.13Å; N254-N278 WeakPolarHBondContact CB-OD1 3.38Å; N254-N278 PolarHBondContact O-OD1 3.19Å; Q255-N278 PolarHBondContact N-OD1 2.95Å; I256-N278 HydrophobicContact CB-CB 4.38Å; I256-N278 VanDerWaalsContact CB-OD1 3.27Å; I256-N278 WeakPolarHBondContact CB-OD1 3.34Å; I256-N278 WeakPolarHBondContact CG1-OD1 3.43Å; I256-N278 PolarHBondContact N-OD1 3.06Å; L275-N278 PolarHBondContact O-ND2 3.16Å; L275-N278 VanDerWaalsContact O-ND2 3.13Å; H276-N278 PolarHBondContact O-N 3.26Å; H276-N278 PolarHBondContact O-ND2 2.71Å; N278-I280 HydrophobicContact CB-CD1 4.09Å; N278-I280 HydrophobicContact CB-CG1 3.95Å; N278-Y300 PolarHBondContact N-O 3.33Å; N278-N301 WeakPolarHBondContact CA-OD1 3.23Å; N278-N301 WeakPolarHBondContact CB-OD1 3.42Å; N278-N301 PolarHBondContact O-OD1 3.07Å
279	E	98.8	Very high	98.3	Very high	91 Å²	91	39.6 Å²	39.6	43%	0.425	20%	0.203	S	C	.	.			trans	-110.3	27.1	-179.8	-61	-178.9	-171	0	0	111.8	I256 S257 Q281 N301	I256-E279 CarbonylContact O-C 3.53Å; I256-E279 WeakPolarHBondContact O-CA 3.15Å; I256-E279 PolarHBondContact O-N 2.92Å; S257-E279 WeakPolarHBondContact CA-O 3.37Å; E279-Q281 PolarHBondContact O-N 3.1Å; E279-N301 PolarHBondContact N-OD1 3.24Å
280	I	98.9	Very high	98.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.			trans	-69.1	120.6	-168.4	-59.1	167	0	0	0	110.1	I256 S257 V259 L275 N278 V283 L298 N301 H302 L303	I256-I280 HydrophobicContact CB-CG1 4.42Å; I256-I280 HydrophobicContact CG2-CG1 4.21Å; I256-I280 VanDerWaalsContact O-CG1 3.25Å; I256-I280 WeakPolarHBondContact O-CG1 3.49Å; I256-I280 PolarHBondContact O-N 3.23Å; I256-I280 VanDerWaalsContact O-N 3.07Å; S257-I280 WeakPolarHBondContact O-CA 3.19Å; V259-I280 HydrophobicContact CG2-CD1 4.06Å; V259-I280 HydrophobicContact CG2-CG2 4.29Å; L275-I280 HydrophobicContact CB-CD1 3.87Å; L275-I280 HydrophobicContact CD1-CD1 4.29Å; L275-I280 HydrophobicContact CD2-CD1 4.06Å; L275-I280 HydrophobicContact CG-CD1 4.31Å; N278-I280 HydrophobicContact CB-CD1 4.09Å; N278-I280 HydrophobicContact CB-CG1 3.95Å; I280-V283 HydrophobicContact CG2-CG1 3.77Å; I280-L298 HydrophobicContact CD1-CD2 4.21Å; I280-N301 HydrophobicContact CB-CB 4.31Å; I280-N301 WeakPolarHBondContact CB-OD1 3.4Å; I280-N301 VanDerWaalsContact CG1-OD1 3.22Å; I280-N301 WeakPolarHBondContact CG1-OD1 3.18Å; I280-N301 PolarHBondContact N-OD1 3.06Å; I280-H302 CarbonylContact O-C 3.5Å; I280-H302 WeakPolarHBondContact O-CA 3.28Å; I280-H302 PolarHBondContact O-N 3.16Å; I280-L303 HydrophobicContact CG2-CD2 3.89Å; I280-L303 PolarHBondContact O-N 3.16Å; I280-L303 VanDerWaalsContact O-N 3.07Å
281	Q	98.4	Very high	98.2	Very high	96 Å²	96	43.4 Å²	43.4	45%	0.449	21%	0.211	S	C	.	.			trans	-92.9	-29.4	177.9	-62.8	177.7	38	0	0	113.3	S257 E279 H302 R304	S257-Q281 PolarHBondContact O-N 3.02Å; E279-Q281 PolarHBondContact O-N 3.1Å; Q281-H302 WeakPolarHBondContact CA-O 3.16Å; Q281-H302 HydrophobicContact CG-CB 4.07Å; Q281-R304 PolarHBondContact O-N 3.32Å
282	E	96.8	Very high	98.2	Very high	79 Å²	79	43.8 Å²	43.8	37%	0.369	22%	0.215	S	C	.	.			trans	-157.8	142.4	-176.8	-178.3	176.5	-164.6	0	0	110.9	V259	V259-E282 PolarHBondContact N-O 2.92Å
283	V	98.2	Very high	98.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	21%	0.211	C	C	.	.			trans	-113.3	-10.9	172.2	-57	0	0	0	0	114.1	V259 I280 S285 S286 M287 L298 L303 P307	V259-V283 HydrophobicContact CB-CB 4.17Å; V259-V283 HydrophobicContact CB-CG1 4.02Å; V259-V283 HydrophobicContact CG2-CG1 3.91Å; I280-V283 HydrophobicContact CG2-CG1 3.77Å; V283-S285 PolarHBondContact O-N 2.79Å; V283-S286 WeakPolarHBondContact O-CB 3.21Å; V283-S286 PolarHBondContact O-N 3.34Å; V283-S286 PolarHBondContact O-OG 3.16Å; V283-M287 HydrophobicContact CB-CE 4.07Å; V283-M287 HydrophobicContact CG1-CE 4.14Å; V283-L298 HydrophobicContact CG1-CD1 4.41Å; V283-L298 HydrophobicContact CG1-CD2 4.02Å; V283-L303 HydrophobicContact CG1-CD2 4.23Å; V283-P307 HydrophobicContact CG2-CB 3.67Å; V283-P307 HydrophobicContact CG2-CG 3.74Å
284	G	97.3	Very high	98.2	Very high	11 Å²	11	46.3 Å²	46.3	11%	0.113	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	-133.9	-179	0	0	0	0	0	112.2	D308	G284-D308 PolarHBondContact O-N 3Å
285	S	97.6	Very high	98.2	Very high	37 Å²	37	44.5 Å²	44.5	26%	0.259	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	12.4	-178.2	59.1	0	0	0	0	114.1	N261 V283 M287 R288	N261-S285 PolarHBondContact OD1-N 3.44Å; V283-S285 PolarHBondContact O-N 2.79Å; S285-M287 PolarHBondContact O-N 2.68Å; S285-M287 VanDerWaalsContact O-N 3.09Å; S285-R288 PolarHBondContact O-N 2.78Å
286	S	98	Very high	98.2	Very high	7 Å²	7	44.5 Å²	44.5	5%	0.049	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.6	-173.8	56.4	0	0	0	0	114.7	P260 N261 V283	P260-S286 WeakPolarHBondContact O-CB 3.34Å; N261-S286 WeakPolarHBondContact O-CA 3.49Å; V283-S286 WeakPolarHBondContact O-CB 3.21Å; V283-S286 PolarHBondContact O-N 3.34Å; V283-S286 PolarHBondContact O-OG 3.16Å
287	M	98.1	Very high	98.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-15.2	-175.7	-52.9	-55.1	166.7	0	0	113.8	V259 L264 L273 L275 V283 S285 G289 L290 L296 P307	V259-M287 HydrophobicContact CG1-CE 4.34Å; L264-M287 HydrophobicContact CD1-CE 3.96Å; L264-M287 HydrophobicContact CD1-SD 3.79Å; L273-M287 HydrophobicContact CD2-CE 4.06Å; L273-M287 HydrophobicContact CD2-SD 3.93Å; L275-M287 HydrophobicContact CD1-CE 4.23Å; V283-M287 HydrophobicContact CB-CE 4.07Å; V283-M287 HydrophobicContact CG1-CE 4.14Å; S285-M287 PolarHBondContact O-N 2.68Å; S285-M287 VanDerWaalsContact O-N 3.09Å; M287-G289 VanDerWaalsContact C-N 3.25Å; M287-G289 PolarHBondContact O-N 2.67Å; M287-L290 HydrophobicContact CB-CD1 4.43Å; M287-L290 PolarHBondContact O-N 3.39Å; M287-L290 HydrophobicContact SD-CD1 3.7Å; M287-L296 HydrophobicContact CE-CD1 4.38Å; M287-L296 HydrophobicContact CG-CD2 4.06Å; M287-L296 HydrophobicContact SD-CD1 4.3Å; M287-L296 HydrophobicContact SD-CD2 4.32Å; M287-P307 HydrophobicContact CG-CB 4.48Å
288	R	96.4	Very high	98.2	Very high	161 Å²	161	40.2 Å²	40.2	61%	0.608	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-31.2	-171.7	-65.7	-178.6	81.3	169.7	3	113.7	S285 D308	S285-R288 PolarHBondContact O-N 2.78Å; R288-D308 VanDerWaalsContact CD-O 3.26Å; R288-D308 WeakPolarHBondContact CD-O 3.16Å; R288-D308 VanDerWaalsContact CG-O 3.29Å; R288-D308 WeakPolarHBondContact CG-O 3.39Å
289	G	96.8	Very high	98.2	Very high	43 Å²	43	40 Å²	40	44%	0.443	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.8	-176.9	0	0	0	0	0	115	M287 R291	M287-G289 VanDerWaalsContact C-N 3.25Å; M287-G289 PolarHBondContact O-N 2.67Å; G289-R291 VanDerWaalsContact C-N 3.31Å; G289-R291 PolarHBondContact O-N 2.85Å
290	L	98.5	Very high	98.2	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.199	C	C	.	.			trans	-85.5	70.2	-171	-53.9	177	0	0	0	111.2	L264 L267 L270 L273 M287 S292 L293 P311	L264-L290 HydrophobicContact CB-CD2 4.06Å; L264-L290 HydrophobicContact CD1-CD1 4Å; L267-L290 HydrophobicContact CB-CD2 3.87Å; L270-L290 HydrophobicContact CD2-CD1 4.42Å; L270-L290 HydrophobicContact CD2-CD2 4.36Å; L273-L290 HydrophobicContact CD2-CD1 4.4Å; M287-L290 HydrophobicContact CB-CD1 4.43Å; M287-L290 PolarHBondContact O-N 3.39Å; M287-L290 HydrophobicContact SD-CD1 3.7Å; L290-S292 PolarHBondContact O-N 3.02Å; L290-S292 VanDerWaalsContact O-N 3.14Å; L290-L293 HydrophobicContact CB-CB 3.83Å; L290-L293 HydrophobicContact CB-CD2 4.21Å; L290-L293 HydrophobicContact CB-CG 4.5Å; L290-L293 HydrophobicContact CD1-CD2 3.85Å; L290-L293 VanDerWaalsContact O-CB 3.31Å; L290-L293 WeakPolarHBondContact O-CB 3.29Å; L290-L293 PolarHBondContact O-N 2.9Å; L290-P311 WeakPolarHBondContact O-CB 3.36Å
291	R	97.6	Very high	98.2	Very high	157 Å²	157	40.4 Å²	40.4	59%	0.592	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.6	-168.5	-66.7	177.4	177.9	167.6	-5	115.2	E268 G289 A313	E268-R291 IonicContact OE1-CZ 3.98Å; E268-R291 IonicContact OE1-NH1 3.54Å; E268-R291 IonicContact OE2-CZ 3.61Å; E268-R291 IonicContact OE2-NE 3.86Å; E268-R291 IonicContact OE2-NH1 2.81Å; E268-R291 PolarHBondContact OE2-NH1 3.11Å; G289-R291 VanDerWaalsContact C-N 3.31Å; G289-R291 PolarHBondContact O-N 2.85Å; R291-A313 WeakPolarHBondContact O-CB 3.21Å
292	S	98.7	Very high	98.2	Very high	47 Å²	47	39.9 Å²	39.9	33%	0.329	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	6.3	-180	-52.3	0	0	0	0	113.4	E268 L270 T271 L290 I294	E268-S292 WeakPolarHBondContact O-CB 3.2Å; E268-S292 PolarHBondContact O-N 2.94Å; E268-S292 PolarHBondContact O-OG 3.28Å; L270-S292 CarbonylContact O-C 3.28Å; T271-S292 WeakPolarHBondContact CA-O 3.46Å; L290-S292 PolarHBondContact O-N 3.02Å; L290-S292 VanDerWaalsContact O-N 3.14Å; S292-I294 PolarHBondContact O-N 3.24Å
293	L	98.9	Very high	98.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.179	C	C	.	.			trans	-70.5	122	-174.1	-164.4	72.9	0	0	0	110.5	L270 L273 L290 L296 P311 A313 L314	L270-L293 HydrophobicContact CD2-CD1 4.19Å; L270-L293 HydrophobicContact CG-CD1 4.21Å; L270-L293 WeakPolarHBondContact O-CA 3.25Å; L270-L293 PolarHBondContact O-N 3.36Å; L270-L293 VanDerWaalsContact O-N 3.08Å; L273-L293 HydrophobicContact CB-CD1 3.97Å; L290-L293 HydrophobicContact CB-CB 3.83Å; L290-L293 HydrophobicContact CB-CD2 4.21Å; L290-L293 HydrophobicContact CB-CG 4.5Å; L290-L293 HydrophobicContact CD1-CD2 3.85Å; L290-L293 VanDerWaalsContact O-CB 3.31Å; L290-L293 WeakPolarHBondContact O-CB 3.29Å; L290-L293 PolarHBondContact O-N 2.9Å; L293-L296 HydrophobicContact CD2-CB 4.03Å; L293-P311 HydrophobicContact CB-CG 3.93Å; L293-P311 HydrophobicContact CD2-CG 3.96Å; L293-A313 CarbonylContact O-C 3.19Å; L293-L314 HydrophobicContact CB-CD1 4.49Å; L293-L314 HydrophobicContact CD2-CD1 4Å; L293-L314 HydrophobicContact CG-CD1 4.04Å; L293-L314 VanDerWaalsContact O-CA 3.23Å; L293-L314 WeakPolarHBondContact O-CA 3.32Å; L293-L314 PolarHBondContact O-N 3.38Å
294	I	98.9	Very high	98.2	Very high	65 Å²	65	43.1 Å²	43.1	33%	0.333	21%	0.206	S	C	.	.			trans	-101.7	-42.4	179.4	-64.3	170.7	0	0	0	109.7	T271 S292 E315 Q316	T271-I294 PolarHBondContact O-N 3.07Å; S292-I294 PolarHBondContact O-N 3.24Å; I294-E315 HydrophobicContact CG2-CB 4.06Å; I294-E315 HydrophobicContact CG2-CG 4.15Å; I294-E315 PolarHBondContact O-N 3.1Å; I294-Q316 PolarHBondContact O-N 3.36Å
295	L	98.9	Very high	98.1	Very high	23 Å²	23	49.5 Å²	49.5	12%	0.12	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.7	-176.9	-176.7	157.7	0	0	0	111.1	T271 A272 L273 Y274 D297 Q316 Y318	T271-L295 PolarHBondContact O-N 3.31Å; T271-L295 VanDerWaalsContact O-N 3.14Å; A272-L295 HydrophobicContact CB-CB 4.48Å; L273-L295 PolarHBondContact N-O 3.29Å; L273-L295 VanDerWaalsContact N-O 3.1Å; Y274-L295 HydrophobicContact CD1-CD2 4.03Å; Y274-L295 HydrophobicContact CE1-CD1 4.31Å; Y274-L295 HydrophobicContact CE1-CD2 3.59Å; L295-D297 HydrophobicContact CD2-CB 4.12Å; L295-Q316 HydrophobicContact CB-CB 4.42Å; L295-Q316 HydrophobicContact CG-CB 4.3Å; L295-Y318 HydrophobicContact CD1-CE2 4.49Å
296	L	98.9	Very high	98.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.2	169.9	177.7	57.7	0	0	0	110.1	L273 M287 L293 L298 L314 Q316 L317 Y318	L273-L296 HydrophobicContact CB-CD1 4.18Å; L273-L296 HydrophobicContact CD2-CD1 3.89Å; L273-L296 HydrophobicContact CG-CD1 4.09Å; M287-L296 HydrophobicContact CE-CD1 4.38Å; M287-L296 HydrophobicContact CG-CD2 4.06Å; M287-L296 HydrophobicContact SD-CD1 4.3Å; M287-L296 HydrophobicContact SD-CD2 4.32Å; L293-L296 HydrophobicContact CD2-CB 4.03Å; L296-L298 HydrophobicContact CD1-CD1 4.18Å; L296-L298 HydrophobicContact CD1-CG 4.02Å; L296-L298 HydrophobicContact CD2-CD1 3.84Å; L296-L298 HydrophobicContact CG-CD1 3.97Å; L296-L298 HydrophobicContact CG-CG 4.11Å; L296-L314 HydrophobicContact CB-CD1 3.92Å; L296-Q316 PolarHBondContact N-O 2.81Å; L296-L317 HydrophobicContact CB-CD1 4.13Å; L296-L317 HydrophobicContact CD2-CD1 3.89Å; L296-L317 HydrophobicContact CG-CD1 4.05Å; L296-Y318 PolarHBondContact O-N 2.88Å
297	D	98.9	Very high	98.2	Very high	17 Å²	17	48.2 Å²	48.2	9%	0.091	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.3	176.4	-169.3	-4.6	0	0	0	111.5	L273 Y274 L275 H276 L295 S299 Y318	L273-D297 PolarHBondContact O-N 3.07Å; Y274-D297 HydrophobicContact CD1-CB 4.26Å; L275-D297 CarbonylContact C-O 3.6Å; L275-D297 WeakPolarHBondContact CA-O 3.39Å; L275-D297 WeakPolarHBondContact CB-O 3.29Å; L275-D297 PolarHBondContact N-O 3.04Å; H276-D297 IonicContact CE1-OD2 3.53Å; H276-D297 IonicContact CG-OD2 3.07Å; H276-D297 PolarHBondContact N-O 3.46Å; H276-D297 IonicContact ND1-OD2 3.81Å; H276-D297 PolarHBondContact ND1-OD2 3.06Å; L295-D297 HydrophobicContact CD2-CB 4.12Å; D297-S299 VanDerWaalsContact OD1-CB 3.28Å; D297-S299 WeakPolarHBondContact OD1-CB 3.49Å; D297-S299 PolarHBondContact OD1-N 3.27Å; D297-S299 PolarHBondContact OD1-OG 2.9Å; D297-Y318 HydrophobicContact CB-CD2 4.21Å
298	L	98.9	Very high	98.2	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.242	C	C	.	.			trans	-120.9	17.5	177.7	-71.7	166.3	0	0	0	111.3	L275 I280 V283 L296 N301 L303 P307 Y318 M319 N322	L275-L298 HydrophobicContact CB-CD2 3.86Å; L275-L298 HydrophobicContact CD1-CD2 3.88Å; I280-L298 HydrophobicContact CD1-CD2 4.21Å; V283-L298 HydrophobicContact CG1-CD1 4.41Å; V283-L298 HydrophobicContact CG1-CD2 4.02Å; L296-L298 HydrophobicContact CD1-CD1 4.18Å; L296-L298 HydrophobicContact CD1-CG 4.02Å; L296-L298 HydrophobicContact CD2-CD1 3.84Å; L296-L298 HydrophobicContact CG-CD1 3.97Å; L296-L298 HydrophobicContact CG-CG 4.11Å; L298-N301 PolarHBondContact O-ND2 2.94Å; L298-L303 HydrophobicContact CB-CD1 3.88Å; L298-L303 HydrophobicContact CD1-CD1 4.13Å; L298-L303 HydrophobicContact CG-CD1 4.45Å; L298-P307 HydrophobicContact CD1-CG 4.02Å; L298-Y318 CarbonylContact C-O 3.49Å; L298-Y318 WeakPolarHBondContact CA-O 3.26Å; L298-Y318 PolarHBondContact N-O 3.04Å; L298-M319 HydrophobicContact CB-CG 4.25Å; L298-N322 PolarHBondContact O-ND2 3.08Å
299	S	98.9	Very high	98.2	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.028	22%	0.224	C	C	.	.			trans	-61.8	158	179.1	63	0	0	0	0	112	H276 H277 D297 N301 Y318 E320	H276-S299 WeakPolarHBondContact CA-O 3.43Å; H276-S299 WeakPolarHBondContact CB-O 3.38Å; H276-S299 WeakPolarHBondContact CB-OG 3.28Å; H277-S299 PolarHBondContact N-O 2.9Å; D297-S299 VanDerWaalsContact OD1-CB 3.28Å; D297-S299 WeakPolarHBondContact OD1-CB 3.49Å; D297-S299 PolarHBondContact OD1-N 3.27Å; D297-S299 PolarHBondContact OD1-OG 2.9Å; S299-N301 PolarHBondContact O-N 3.14Å; S299-N301 PolarHBondContact O-ND2 3.22Å; S299-Y318 PolarHBondContact N-O 2.97Å; S299-E320 CarbonylContact C-O 3.45Å; S299-E320 VanDerWaalsContact CA-O 3.28Å; S299-E320 WeakPolarHBondContact CA-O 3.48Å; S299-E320 VanDerWaalsContact CB-OE1 3.29Å; S299-E320 WeakPolarHBondContact CB-OE1 3.48Å
300	Y	98.9	Very high	98.2	Very high	94 Å²	94	45.1 Å²	45.1	37%	0.369	21%	0.207	S	C	.	.	S	Bend	trans	52	56	177.5	-61.8	-90.6	0	0	0	113.5	H277 N278 E320 H321	H277-Y300 WeakPolarHBondContact CA-O 3.41Å; H277-Y300 AromaticContact CE1-CD1 3.45Å; H277-Y300 VanDerWaalsContact CE1-CD1 3.45Å; H277-Y300 WeakPolarHBondContact CE1-CD1 3.44Å; H277-Y300 AromaticContact CE1-CD2 3.75Å; H277-Y300 AromaticContact CE1-CE1 3.99Å; H277-Y300 AromaticContact CE1-CG 3.3Å; H277-Y300 PolarHBondContact N-O 2.88Å; H277-Y300 WeakPolarHBondContact ND1-CB 3.42Å; H277-Y300 AromaticContact ND1-CG 3.72Å; H277-Y300 AromaticContact NE2-CD2 3.65Å; H277-Y300 AromaticContact NE2-CG 3.71Å; N278-Y300 PolarHBondContact N-O 3.33Å; Y300-E320 HydrophobicContact CE2-CG 4.45Å; Y300-E320 PolarHBondContact N-O 3.44Å; Y300-H321 WeakPolarHBondContact CA-O 3.45Å; Y300-H321 HydrophobicContact CD1-CB 3.58Å; Y300-H321 AromaticContact CD1-CG 3.77Å; Y300-H321 HydrophobicContact CD2-CB 4.39Å; Y300-H321 HydrophobicContact CE1-CB 3.81Å; Y300-H321 AromaticContact CE1-CD2 3.49Å; Y300-H321 VanDerWaalsContact CE1-CD2 3.49Å; Y300-H321 WeakPolarHBondContact CE1-CD2 3.36Å; Y300-H321 AromaticContact CE1-CG 3.44Å; Y300-H321 VanDerWaalsContact CE1-CG 3.44Å; Y300-H321 AromaticContact CE1-ND1 3.86Å; Y300-H321 AromaticContact CE1-NE2 3.94Å; Y300-H321 AromaticContact CE2-CD2 3.91Å; Y300-H321 HydrophobicContact CG-CB 3.9Å; Y300-H321 AromaticContact CZ-CD2 3.34Å; Y300-H321 AromaticContact CZ-CG 3.8Å; Y300-H321 AromaticContact CZ-NE2 3.81Å; Y300-H321 PolarHBondContact OH-CD2 3.3Å; Y300-H321 PolarHBondContact OH-NE2 2.87Å
301	N	98.9	Very high	98.2	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	21%	0.208	C	C	.	.	S	Bend	trans	-130.9	-165.3	178.4	-89.3	-80.9	0	0	0	110.3	L275 N278 E279 I280 L298 S299 L303 H321 N322	L275-N301 PolarHBondContact O-ND2 3.07Å; N278-N301 WeakPolarHBondContact CA-OD1 3.23Å; N278-N301 WeakPolarHBondContact CB-OD1 3.42Å; N278-N301 PolarHBondContact O-OD1 3.07Å; E279-N301 PolarHBondContact N-OD1 3.24Å; I280-N301 HydrophobicContact CB-CB 4.31Å; I280-N301 WeakPolarHBondContact CB-OD1 3.4Å; I280-N301 VanDerWaalsContact CG1-OD1 3.22Å; I280-N301 WeakPolarHBondContact CG1-OD1 3.18Å; I280-N301 PolarHBondContact N-OD1 3.06Å; L298-N301 PolarHBondContact O-ND2 2.94Å; S299-N301 PolarHBondContact O-N 3.14Å; S299-N301 PolarHBondContact O-ND2 3.22Å; N301-L303 HydrophobicContact CB-CG 4.42Å; N301-H321 PolarHBondContact N-O 2.99Å; N301-N322 WeakPolarHBondContact CA-OD1 3.41Å; N301-N322 WeakPolarHBondContact CB-OD1 3.34Å; N301-N322 PolarHBondContact O-OD1 3.35Å
302	H	98.8	Very high	98.2	Very high	85 Å²	85	41.1 Å²	41.1	39%	0.394	20%	0.203	S	C	.	.			trans	-117.4	29	179.3	-60.4	-32	0	0	0	112.1	I280 Q281 R304 N322	I280-H302 CarbonylContact O-C 3.5Å; I280-H302 WeakPolarHBondContact O-CA 3.28Å; I280-H302 PolarHBondContact O-N 3.16Å; Q281-H302 WeakPolarHBondContact CA-O 3.16Å; Q281-H302 HydrophobicContact CG-CB 4.07Å; H302-R304 PolarHBondContact O-N 2.88Å; H302-N322 PolarHBondContact N-OD1 3.06Å
303	L	98.8	Very high	98.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.			trans	-61.9	125.1	-176.3	-68.6	175.6	0	0	0	110	I280 V283 L298 N301 N322 N323 V324	I280-L303 HydrophobicContact CG2-CD2 3.89Å; I280-L303 PolarHBondContact O-N 3.16Å; I280-L303 VanDerWaalsContact O-N 3.07Å; V283-L303 HydrophobicContact CG1-CD2 4.23Å; L298-L303 HydrophobicContact CB-CD1 3.88Å; L298-L303 HydrophobicContact CD1-CD1 4.13Å; L298-L303 HydrophobicContact CG-CD1 4.45Å; N301-L303 HydrophobicContact CB-CG 4.42Å; L303-N322 HydrophobicContact CB-CB 4.14Å; L303-N322 WeakPolarHBondContact CB-OD1 3.47Å; L303-N322 WeakPolarHBondContact CG-OD1 3.46Å; L303-N322 PolarHBondContact N-OD1 3.22Å; L303-N323 CarbonylContact O-C 3.21Å; L303-N323 WeakPolarHBondContact O-CA 3.43Å; L303-N323 WeakPolarHBondContact O-CB 3.44Å; L303-N323 PolarHBondContact O-N 3.23Å; L303-V324 HydrophobicContact CB-CG2 4.15Å; L303-V324 PolarHBondContact O-N 2.82Å; L303-V324 VanDerWaalsContact O-N 3.07Å
304	R	96.5	Very high	98.2	Very high	150 Å²	150	39.8 Å²	39.8	57%	0.566	20%	0.195	S	C	*	.	S	Bend	trans	-93.6	-21.1	173	-63.7	-176.5	-176.7	173.7	2.3	112.5	Q281 H302 Y325	Q281-R304 PolarHBondContact O-N 3.32Å; H302-R304 PolarHBondContact O-N 2.88Å; R304-Y325 HydrophobicContact CB-CE1 4.19Å; R304-Y325 VanDerWaalsContact O-CD1 3.22Å; R304-Y325 WeakPolarHBondContact O-CD1 3.21Å; R304-Y325 WeakPolarHBondContact O-CE1 3.44Å
305	R	94.8	Very high	98.2	Very high	144 Å²	144	39.9 Å²	39.9	54%	0.543	19%	0.194	S	C	.	.	S	Bend	trans	-138.1	149.3	-178	-61.4	-179.6	-171.8	143	-0.3	109.2
306	V	98.4	Very high	98.2	Very high	16 Å²	16	41.2 Å²	41.2	10%	0.097	20%	0.199	C	C	.	.			trans	-65.5	157	169.3	-61.8	0	0	0	0	111	M319 V324 V327 P328 Y331	V306-M319 HydrophobicContact CG1-CE 4.12Å; V306-M319 HydrophobicContact CG1-SD 4.31Å; V306-V324 HydrophobicContact CG1-CG1 3.86Å; V306-V327 HydrophobicContact CG1-CG2 4.03Å; V306-P328 HydrophobicContact CG2-CG 4.39Å; V306-Y331 HydrophobicContact CB-CE1 4.1Å; V306-Y331 HydrophobicContact CB-CE2 4.29Å; V306-Y331 HydrophobicContact CG2-CD2 4.07Å; V306-Y331 HydrophobicContact CG2-CE1 4.05Å; V306-Y331 HydrophobicContact CG2-CE2 3.56Å
307	P	98.3	Very high	98.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	20%	0.199	C	C	.	.			trans	-53.3	139.4	175.1	-24.4	31.4	0	0	0	112.8	V283 M287 L298 G309 L310 M319 Y331	V283-P307 HydrophobicContact CG2-CB 3.67Å; V283-P307 HydrophobicContact CG2-CG 3.74Å; M287-P307 HydrophobicContact CG-CB 4.48Å; L298-P307 HydrophobicContact CD1-CG 4.02Å; P307-G309 VanDerWaalsContact C-N 3.33Å; P307-G309 PolarHBondContact O-N 3.12Å; P307-L310 HydrophobicContact CB-CD2 4.24Å; P307-L310 HydrophobicContact CG-CD2 4.29Å; P307-M319 HydrophobicContact CG-SD 4.45Å; P307-Y331 WeakPolarHBondContact CD-OH 3.27Å; P307-Y331 WeakPolarHBondContact O-CE2 3.12Å; P307-Y331 PolarHBondContact O-OH 3.35Å
308	D	97.7	Very high	98.2	Very high	102 Å²	102	41.8 Å²	41.8	55%	0.545	20%	0.201	S	C	.	.	S	Bend	trans	-79.1	83.5	176.2	179.5	28.5	0	0	0	110.4	G284 R288	G284-D308 PolarHBondContact O-N 3Å; R288-D308 VanDerWaalsContact CD-O 3.26Å; R288-D308 WeakPolarHBondContact CD-O 3.16Å; R288-D308 VanDerWaalsContact CG-O 3.29Å; R288-D308 WeakPolarHBondContact CG-O 3.39Å
309	G	96.4	Very high	98.2	Very high	21 Å²	21	41.8 Å²	41.8	22%	0.216	20%	0.201	C	C	.	.	S	Bend	trans	93.3	126.2	-178.3	0	0	0	0	0	112.8	P307	P307-G309 VanDerWaalsContact C-N 3.33Å; P307-G309 PolarHBondContact O-N 3.12Å
310	L	98.1	Very high	98.1	Very high	17 Å²	17	42.6 Å²	42.6	9%	0.089	20%	0.204	C	C	.	.			trans	-95	150.5	174.8	-61.7	176	0	0	0	110.5	P307 L314 L317 Y331 F332 A335 L338	P307-L310 HydrophobicContact CB-CD2 4.24Å; P307-L310 HydrophobicContact CG-CD2 4.29Å; L310-L314 HydrophobicContact CB-CD2 4.43Å; L310-L314 HydrophobicContact CD1-CD2 4.4Å; L310-L314 HydrophobicContact CD2-CD2 4.08Å; L310-L317 HydrophobicContact CD1-CD2 3.86Å; L310-L317 HydrophobicContact CD2-CD2 3.98Å; L310-Y331 HydrophobicContact CD1-CD1 4.45Å; L310-Y331 HydrophobicContact CD1-CE1 3.72Å; L310-Y331 WeakPolarHBondContact CD2-OH 3.33Å; L310-Y331 HydrophobicContact CG-CE1 4.11Å; L310-F332 HydrophobicContact CD1-CD1 4.13Å; L310-F332 HydrophobicContact CD1-CE1 4.43Å; L310-A335 HydrophobicContact CB-CB 4.07Å; L310-A335 HydrophobicContact CD1-CB 4.07Å; L310-L338 HydrophobicContact CD1-CD2 4.46Å
311	P	97.7	Very high	98.1	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.019	20%	0.201	C	C	.	.			trans	-69.8	149.4	170.1	26.3	-28.4	0	0	0	111.2	L290 L293 A313 L314	L290-P311 WeakPolarHBondContact O-CB 3.36Å; L293-P311 HydrophobicContact CB-CG 3.93Å; L293-P311 HydrophobicContact CD2-CG 3.96Å; P311-A313 VanDerWaalsContact C-N 3.31Å; P311-A313 PolarHBondContact O-N 2.98Å; P311-L314 HydrophobicContact CG-CB 4.23Å; P311-L314 HydrophobicContact CG-CD1 4.4Å; P311-L314 WeakPolarHBondContact O-CB 3.47Å; P311-L314 PolarHBondContact O-N 2.76Å
312	S	97.3	Very high	98.1	Very high	71 Å²	71	41.3 Å²	41.3	50%	0.497	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-19.7	-172.1	54.7	0	0	0	0	114.8
313	A	98.4	Very high	98.1	Very high	19 Å²	19	40.9 Å²	40.9	16%	0.157	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.5	179.3	0	0	0	0	0	113.9	R291 L293 P311 E315	R291-A313 WeakPolarHBondContact O-CB 3.21Å; L293-A313 CarbonylContact O-C 3.19Å; P311-A313 VanDerWaalsContact C-N 3.31Å; P311-A313 PolarHBondContact O-N 2.98Å; A313-E315 PolarHBondContact O-N 2.82Å
314	L	98.9	Very high	98.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.			trans	-64.9	131.9	-172.8	-162.1	70.2	0	0	0	111.6	L293 L296 L310 P311 L317 K337 L338	L293-L314 HydrophobicContact CB-CD1 4.49Å; L293-L314 HydrophobicContact CD2-CD1 4Å; L293-L314 HydrophobicContact CG-CD1 4.04Å; L293-L314 VanDerWaalsContact O-CA 3.23Å; L293-L314 WeakPolarHBondContact O-CA 3.32Å; L293-L314 PolarHBondContact O-N 3.38Å; L296-L314 HydrophobicContact CB-CD1 3.92Å; L310-L314 HydrophobicContact CB-CD2 4.43Å; L310-L314 HydrophobicContact CD1-CD2 4.4Å; L310-L314 HydrophobicContact CD2-CD2 4.08Å; P311-L314 HydrophobicContact CG-CB 4.23Å; P311-L314 HydrophobicContact CG-CD1 4.4Å; P311-L314 WeakPolarHBondContact O-CB 3.47Å; P311-L314 PolarHBondContact O-N 2.76Å; L314-L317 HydrophobicContact CD2-CB 4.06Å; L314-L317 HydrophobicContact CD2-CD1 4.3Å; L314-L317 HydrophobicContact CD2-CD2 4.43Å; L314-K337 CarbonylContact O-C 3.23Å; L314-K337 VanDerWaalsContact O-C 3.23Å; L314-L338 HydrophobicContact CB-CD1 4.36Å; L314-L338 HydrophobicContact CD2-CD1 4.03Å; L314-L338 HydrophobicContact CG-CD1 4Å; L314-L338 VanDerWaalsContact O-CA 3.26Å; L314-L338 WeakPolarHBondContact O-CA 3.09Å; L314-L338 PolarHBondContact O-N 2.83Å; L314-L338 VanDerWaalsContact O-N 3.16Å
315	E	98.9	Very high	98.2	Very high	66 Å²	66	38.6 Å²	38.6	31%	0.308	19%	0.194	S	C	.	.			trans	-114.8	-32.3	178.8	-61.5	-174.7	-176.7	0	0	111.8	I294 A313 K337 L339 Y340	I294-E315 HydrophobicContact CG2-CB 4.06Å; I294-E315 HydrophobicContact CG2-CG 4.15Å; I294-E315 PolarHBondContact O-N 3.1Å; A313-E315 PolarHBondContact O-N 2.82Å; E315-K337 HydrophobicContact CG-CB 4.39Å; E315-L339 PolarHBondContact O-N 3.02Å; E315-Y340 PolarHBondContact O-N 2.92Å; E315-Y340 VanDerWaalsContact O-N 3.08Å
316	Q	98.9	Very high	98.4	Very high	51 Å²	51	34.1 Å²	34.1	24%	0.238	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.5	-176.1	-67.7	167.9	60.4	0	0	110.8	I294 L295 L296 Y318 Y340	I294-Q316 PolarHBondContact O-N 3.36Å; L295-Q316 HydrophobicContact CB-CB 4.42Å; L295-Q316 HydrophobicContact CG-CB 4.3Å; L296-Q316 PolarHBondContact N-O 2.81Å; Q316-Y318 HydrophobicContact CB-CE1 4.46Å; Q316-Y318 HydrophobicContact CB-CE2 4.45Å; Q316-Y318 PolarHBondContact OE1-OH 3.25Å; Q316-Y340 HydrophobicContact CG-CD2 3.75Å; Q316-Y340 HydrophobicContact CG-CG 4.45Å
317	L	98.9	Very high	98.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	114.6	178.3	178.7	60.2	0	0	0	111.1	L296 L310 L314 M319 F332 L338 Y340 V341 R342	L296-L317 HydrophobicContact CB-CD1 4.13Å; L296-L317 HydrophobicContact CD2-CD1 3.89Å; L296-L317 HydrophobicContact CG-CD1 4.05Å; L310-L317 HydrophobicContact CD1-CD2 3.86Å; L310-L317 HydrophobicContact CD2-CD2 3.98Å; L314-L317 HydrophobicContact CD2-CB 4.06Å; L314-L317 HydrophobicContact CD2-CD1 4.3Å; L314-L317 HydrophobicContact CD2-CD2 4.43Å; L317-M319 HydrophobicContact CD1-CE 4.3Å; L317-M319 HydrophobicContact CD1-CG 4.04Å; L317-M319 HydrophobicContact CD1-SD 4.14Å; L317-M319 HydrophobicContact CD2-CE 3.52Å; L317-M319 HydrophobicContact CD2-SD 4.3Å; L317-M319 HydrophobicContact CG-CE 3.8Å; L317-M319 HydrophobicContact CG-CG 4.26Å; L317-M319 HydrophobicContact CG-SD 4.3Å; L317-F332 HydrophobicContact CD2-CE1 4.19Å; L317-L338 HydrophobicContact CB-CD1 3.96Å; L317-Y340 PolarHBondContact N-O 3.33Å; L317-V341 WeakPolarHBondContact O-CA 3.43Å; L317-R342 PolarHBondContact O-N 3.39Å
318	Y	98.9	Very high	98.3	Very high	30 Å²	30	36.8 Å²	36.8	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.1	-179	-52.7	-38.1	0	0	0	110.2	L295 L296 D297 L298 S299 Q316 E320 R342	L295-Y318 HydrophobicContact CD1-CE2 4.49Å; L296-Y318 PolarHBondContact O-N 2.88Å; D297-Y318 HydrophobicContact CB-CD2 4.21Å; L298-Y318 CarbonylContact C-O 3.49Å; L298-Y318 WeakPolarHBondContact CA-O 3.26Å; L298-Y318 PolarHBondContact N-O 3.04Å; S299-Y318 PolarHBondContact N-O 2.97Å; Q316-Y318 HydrophobicContact CB-CE1 4.46Å; Q316-Y318 HydrophobicContact CB-CE2 4.45Å; Q316-Y318 PolarHBondContact OE1-OH 3.25Å; Y318-E320 WeakPolarHBondContact CB-OE2 3.36Å; Y318-R342 HydrophobicContact CD1-CB 4Å; Y318-R342 HydrophobicContact CD1-CG 3.81Å; Y318-R342 HydrophobicContact CE1-CG 4.15Å
319	M	98.8	Very high	98.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.			trans	-143.1	20.3	-177.1	-65.8	-175.4	-65.3	0	0	111.2	L298 V306 P307 L317 N322 R342 L343 N346	L298-M319 HydrophobicContact CB-CG 4.25Å; V306-M319 HydrophobicContact CG1-CE 4.12Å; V306-M319 HydrophobicContact CG1-SD 4.31Å; P307-M319 HydrophobicContact CG-SD 4.45Å; L317-M319 HydrophobicContact CD1-CE 4.3Å; L317-M319 HydrophobicContact CD1-CG 4.04Å; L317-M319 HydrophobicContact CD1-SD 4.14Å; L317-M319 HydrophobicContact CD2-CE 3.52Å; L317-M319 HydrophobicContact CD2-SD 4.3Å; L317-M319 HydrophobicContact CG-CE 3.8Å; L317-M319 HydrophobicContact CG-CG 4.26Å; L317-M319 HydrophobicContact CG-SD 4.3Å; M319-N322 PolarHBondContact O-ND2 3.09Å; M319-N322 VanDerWaalsContact O-ND2 3.14Å; M319-R342 CarbonylContact C-O 3.49Å; M319-R342 WeakPolarHBondContact CA-O 3.49Å; M319-R342 PolarHBondContact N-O 2.9Å; M319-L343 HydrophobicContact CB-CD2 3.96Å; M319-L343 HydrophobicContact CE-CD1 4.32Å; M319-L343 HydrophobicContact CE-CD2 3.84Å; M319-L343 HydrophobicContact CE-CG 4.05Å; M319-N346 PolarHBondContact O-ND2 3Å
320	E	98.8	Very high	98.3	Very high	20 Å²	20	37.1 Å²	37.1	9%	0.093	20%	0.199	C	C	.	.			trans	-62.8	158.3	174.4	67.9	-83.9	-161.5	0	0	111.9	S299 Y300 Y318 N322 R342 S344	S299-E320 CarbonylContact C-O 3.45Å; S299-E320 VanDerWaalsContact CA-O 3.28Å; S299-E320 WeakPolarHBondContact CA-O 3.48Å; S299-E320 VanDerWaalsContact CB-OE1 3.29Å; S299-E320 WeakPolarHBondContact CB-OE1 3.48Å; Y300-E320 HydrophobicContact CE2-CG 4.45Å; Y300-E320 PolarHBondContact N-O 3.44Å; Y318-E320 WeakPolarHBondContact CB-OE2 3.36Å; E320-N322 PolarHBondContact O-N 2.86Å; E320-N322 PolarHBondContact O-ND2 3.04Å; E320-R342 HydrophobicContact CB-CB 4.46Å; E320-R342 PolarHBondContact N-O 3.05Å; E320-R342 VanDerWaalsContact OE2-CB 3.29Å; E320-R342 WeakPolarHBondContact OE2-CB 3.45Å; E320-S344 CarbonylContact C-O 3.58Å; E320-S344 WeakPolarHBondContact CA-O 3.41Å; E320-S344 WeakPolarHBondContact CB-O 3.47Å; E320-S344 WeakPolarHBondContact CB-OG 3.43Å
321	H	98.9	Very high	98.3	Very high	66 Å²	66	37.5 Å²	37.5	31%	0.306	20%	0.2	S	C	.	.	S	Bend	trans	54	54.3	-179.2	-68	-86.7	0	0	0	112.9	Y300 N301 S344 H345	Y300-H321 WeakPolarHBondContact CA-O 3.45Å; Y300-H321 HydrophobicContact CD1-CB 3.58Å; Y300-H321 AromaticContact CD1-CG 3.77Å; Y300-H321 HydrophobicContact CD2-CB 4.39Å; Y300-H321 HydrophobicContact CE1-CB 3.81Å; Y300-H321 AromaticContact CE1-CD2 3.49Å; Y300-H321 VanDerWaalsContact CE1-CD2 3.49Å; Y300-H321 WeakPolarHBondContact CE1-CD2 3.36Å; Y300-H321 AromaticContact CE1-CG 3.44Å; Y300-H321 VanDerWaalsContact CE1-CG 3.44Å; Y300-H321 AromaticContact CE1-ND1 3.86Å; Y300-H321 AromaticContact CE1-NE2 3.94Å; Y300-H321 AromaticContact CE2-CD2 3.91Å; Y300-H321 HydrophobicContact CG-CB 3.9Å; Y300-H321 AromaticContact CZ-CD2 3.34Å; Y300-H321 AromaticContact CZ-CG 3.8Å; Y300-H321 AromaticContact CZ-NE2 3.81Å; Y300-H321 PolarHBondContact OH-CD2 3.3Å; Y300-H321 PolarHBondContact OH-NE2 2.87Å; N301-H321 PolarHBondContact N-O 2.99Å; H321-S344 PolarHBondContact N-O 2.94Å; H321-H345 WeakPolarHBondContact CA-O 3.47Å; H321-H345 HydrophobicContact CB-CB 4.5Å; H321-H345 AromaticContact CE1-CD2 3.4Å; H321-H345 PolarHBondContact CE1-CD2 2.92Å; H321-H345 VanDerWaalsContact CE1-CD2 3.4Å; H321-H345 AromaticContact CE1-CG 3.35Å; H321-H345 AromaticContact CE1-ND1 3.81Å; H321-H345 AromaticContact CE1-NE2 3.9Å; H321-H345 AromaticContact ND1-CG 3.77Å; H321-H345 AromaticContact NE2-CD2 3.28Å; H321-H345 PolarHBondContact NE2-CD2 3.14Å; H321-H345 VanDerWaalsContact NE2-CD2 3.28Å; H321-H345 AromaticContact NE2-CG 3.65Å; H321-H345 AromaticContact NE2-NE2 3.94Å
322	N	98.9	Very high	98.3	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.032	20%	0.199	C	C	.	.	S	Bend	trans	-129.5	-169.6	176.2	-87	-81.2	0	0	0	110.5	L298 N301 H302 L303 M319 E320 V324 H345 N346	L298-N322 PolarHBondContact O-ND2 3.08Å; N301-N322 WeakPolarHBondContact CA-OD1 3.41Å; N301-N322 WeakPolarHBondContact CB-OD1 3.34Å; N301-N322 PolarHBondContact O-OD1 3.35Å; H302-N322 PolarHBondContact N-OD1 3.06Å; L303-N322 HydrophobicContact CB-CB 4.14Å; L303-N322 WeakPolarHBondContact CB-OD1 3.47Å; L303-N322 WeakPolarHBondContact CG-OD1 3.46Å; L303-N322 PolarHBondContact N-OD1 3.22Å; M319-N322 PolarHBondContact O-ND2 3.09Å; M319-N322 VanDerWaalsContact O-ND2 3.14Å; E320-N322 PolarHBondContact O-N 2.86Å; E320-N322 PolarHBondContact O-ND2 3.04Å; N322-V324 HydrophobicContact CB-CG2 4.23Å; N322-H345 PolarHBondContact N-O 2.82Å; N322-N346 WeakPolarHBondContact CA-OD1 3.38Å; N322-N346 WeakPolarHBondContact CB-OD1 3.33Å; N322-N346 PolarHBondContact O-OD1 3.3Å
323	N	98.7	Very high	98.2	Very high	75 Å²	75	41.9 Å²	41.9	40%	0.401	21%	0.205	S	C	.	.			trans	-117	30.4	179.4	-51.8	120.2	0	0	0	111.9	L303 Y325 N346	L303-N323 CarbonylContact O-C 3.21Å; L303-N323 WeakPolarHBondContact O-CA 3.43Å; L303-N323 WeakPolarHBondContact O-CB 3.44Å; L303-N323 PolarHBondContact O-N 3.23Å; N323-Y325 PolarHBondContact O-N 3.28Å; N323-N346 PolarHBondContact N-OD1 2.66Å
324	V	98.7	Very high	98	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.221	C	C	.	.			trans	-70.3	124.9	-178.3	-177.9	0	0	0	0	108.8	L303 V306 N322 V327 N346 S347 L348	L303-V324 HydrophobicContact CB-CG2 4.15Å; L303-V324 PolarHBondContact O-N 2.82Å; L303-V324 VanDerWaalsContact O-N 3.07Å; V306-V324 HydrophobicContact CG1-CG1 3.86Å; N322-V324 HydrophobicContact CB-CG2 4.23Å; V324-V327 HydrophobicContact CG1-CG2 4.41Å; V324-N346 HydrophobicContact CB-CB 4.43Å; V324-N346 VanDerWaalsContact CB-OD1 3.25Å; V324-N346 WeakPolarHBondContact CB-OD1 3.14Å; V324-N346 WeakPolarHBondContact CG2-OD1 3.26Å; V324-N346 PolarHBondContact N-OD1 3.38Å; V324-S347 CarbonylContact O-C 2.96Å; V324-S347 VanDerWaalsContact O-C 3.28Å; V324-S347 WeakPolarHBondContact O-CA 3.37Å; V324-S347 PolarHBondContact O-N 3.31Å; V324-L348 HydrophobicContact CG1-CD2 3.96Å; V324-L348 PolarHBondContact O-N 3.33Å
325	Y	98.3	Very high	98	Very high	102 Å²	102	43.2 Å²	43.2	40%	0.4	22%	0.221	S	C	.	.			trans	-118.2	-11.7	-178	65	-84.4	0	0	0	113.6	R304 N323 S347	R304-Y325 HydrophobicContact CB-CE1 4.19Å; R304-Y325 VanDerWaalsContact O-CD1 3.22Å; R304-Y325 WeakPolarHBondContact O-CD1 3.21Å; R304-Y325 WeakPolarHBondContact O-CE1 3.44Å; N323-Y325 PolarHBondContact O-N 3.28Å; Y325-S347 WeakPolarHBondContact CA-O 3.33Å
326	T	97.9	Very high	97.9	Very high	51 Å²	51	44 Å²	44	31%	0.313	23%	0.231	S	C	.	.			trans	-141.4	144.7	176.2	53	0	0	0	0	111.7	G352	T326-G352 VanDerWaalsContact CA-O 3.28Å; T326-G352 WeakPolarHBondContact CA-O 3.16Å
327	V	98.3	Very high	97.9	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.03	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-127.1	129.5	168	-175.4	0	0	0	0	108.6	V306 V324 Y331 F332 L348 G352 L353 T357	V306-V327 HydrophobicContact CG1-CG2 4.03Å; V324-V327 HydrophobicContact CG1-CG2 4.41Å; V327-Y331 HydrophobicContact CG1-CD1 3.9Å; V327-Y331 HydrophobicContact CG1-CG 3.95Å; V327-F332 HydrophobicContact CG1-CE2 4.49Å; V327-L348 HydrophobicContact CG2-CD2 3.96Å; V327-G352 PolarHBondContact N-O 3.45Å; V327-L353 HydrophobicContact CB-CD2 3.78Å; V327-L353 HydrophobicContact CG2-CD2 3.93Å; V327-T357 HydrophobicContact CB-CG2 3.73Å; V327-T357 HydrophobicContact CG1-CG2 3.46Å; V327-T357 VanDerWaalsContact CG1-CG2 3.46Å
328	P	97	Very high	97.9	Very high	68 Å²	68	47.2 Å²	47.2	44%	0.442	25%	0.245	S	C	.	.			trans	-61.1	164.8	-177.4	-24.2	34.2	0	0	0	115	V306 Y331 T357	V306-P328 HydrophobicContact CG2-CG 4.39Å; P328-Y331 HydrophobicContact CB-CD2 4.44Å; P328-Y331 HydrophobicContact CG-CD2 4.11Å; P328-Y331 WeakPolarHBondContact O-CB 3.39Å; P328-T357 PolarHBondContact O-OG1 3.41Å
329	D	97.8	Very high	97.9	Very high	95 Å²	95	48 Å²	48	51%	0.508	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	138.9	169.6	-172.2	97	0	0	0	111	Y331 A354 N356	D329-Y331 PolarHBondContact O-N 3.29Å; D329-A354 HydrophobicContact CB-CB 3.88Å; D329-A354 WeakPolarHBondContact OD1-CB 3.32Å; D329-N356 VanDerWaalsContact OD1-CG 3.25Å; D329-N356 PolarHBondContact OD1-ND2 2.95Å; D329-N356 PolarHBondContact OD1-OD1 3.36Å; D329-N356 PolarHBondContact OD2-ND2 3.14Å; D329-N356 PolarHBondContact OD2-OD1 2.76Å
330	S	96.8	Very high	97.9	Very high	34 Å²	34	52 Å²	52	24%	0.238	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	22.8	175.6	-61.5	0	0	0	0	115.3	F332 R333 N356	S330-F332 PolarHBondContact O-N 3.29Å; S330-R333 WeakPolarHBondContact O-CB 3.05Å; S330-R333 PolarHBondContact O-N 3.04Å; S330-N356 PolarHBondContact N-OD1 2.72Å; S330-N356 PolarHBondContact OG-ND2 3.32Å; S330-N356 VanDerWaalsContact OG-ND2 3.1Å
331	Y	98.1	Very high	97.9	Very high	25 Å²	25	51.1 Å²	51.1	10%	0.098	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-54.5	-47.1	-169.4	-179.2	-107.9	0	0	0	113.6	V306 P307 L310 V327 P328 D329 R333 G334	V306-Y331 HydrophobicContact CB-CE1 4.1Å; V306-Y331 HydrophobicContact CB-CE2 4.29Å; V306-Y331 HydrophobicContact CG2-CD2 4.07Å; V306-Y331 HydrophobicContact CG2-CE1 4.05Å; V306-Y331 HydrophobicContact CG2-CE2 3.56Å; P307-Y331 WeakPolarHBondContact CD-OH 3.27Å; P307-Y331 WeakPolarHBondContact O-CE2 3.12Å; P307-Y331 PolarHBondContact O-OH 3.35Å; L310-Y331 HydrophobicContact CD1-CD1 4.45Å; L310-Y331 HydrophobicContact CD1-CE1 3.72Å; L310-Y331 WeakPolarHBondContact CD2-OH 3.33Å; L310-Y331 HydrophobicContact CG-CE1 4.11Å; V327-Y331 HydrophobicContact CG1-CD1 3.9Å; V327-Y331 HydrophobicContact CG1-CG 3.95Å; P328-Y331 HydrophobicContact CB-CD2 4.44Å; P328-Y331 HydrophobicContact CG-CD2 4.11Å; P328-Y331 WeakPolarHBondContact O-CB 3.39Å; D329-Y331 PolarHBondContact O-N 3.29Å; Y331-R333 VanDerWaalsContact C-N 3.27Å; Y331-R333 PolarHBondContact O-N 3.38Å; Y331-G334 PolarHBondContact O-N 2.92Å
332	F	98	Very high	97.9	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-76.8	-7	-177.3	-60.4	-65.4	0	0	0	114.3	L310 L317 V327 S330 G334 A335 L338 V341 L343 T357 F358	L310-F332 HydrophobicContact CD1-CD1 4.13Å; L310-F332 HydrophobicContact CD1-CE1 4.43Å; L317-F332 HydrophobicContact CD2-CE1 4.19Å; V327-F332 HydrophobicContact CG1-CE2 4.49Å; S330-F332 PolarHBondContact O-N 3.29Å; F332-G334 PolarHBondContact O-N 3.38Å; F332-A335 PolarHBondContact O-N 2.91Å; F332-A335 VanDerWaalsContact O-N 3.09Å; F332-L338 HydrophobicContact CB-CD2 4.46Å; F332-L338 HydrophobicContact CD1-CD2 3.34Å; F332-L338 HydrophobicContact CE1-CD2 3.89Å; F332-L338 HydrophobicContact CG-CD2 4.18Å; F332-V341 HydrophobicContact CE1-CG1 4.3Å; F332-V341 HydrophobicContact CE1-CG2 4.11Å; F332-V341 HydrophobicContact CZ-CG1 4.08Å; F332-L343 HydrophobicContact CZ-CD1 4.28Å; F332-T357 VanDerWaalsContact CD2-O 3.26Å; F332-T357 WeakPolarHBondContact CD2-O 3.27Å; F332-F358 HydrophobicContact CD2-CD1 4.15Å; F332-F358 AromaticContact CE2-CD1 3.52Å; F332-F358 HydrophobicContact CE2-CD1 3.52Å; F332-F358 AromaticContact CE2-CE1 3.55Å; F332-F358 HydrophobicContact CE2-CE1 3.55Å; F332-F358 HydrophobicContact CZ-CD1 4.44Å; F332-F358 HydrophobicContact CZ-CE1 4.14Å
333	R	95.1	Very high	97.9	Very high	165 Å²	165	52.1 Å²	52.1	62%	0.623	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-63.9	-23.4	173.7	-66	-166.1	177.1	-133.7	-3.6	112.8	S330 Y331 A335	S330-R333 WeakPolarHBondContact O-CB 3.05Å; S330-R333 PolarHBondContact O-N 3.04Å; Y331-R333 VanDerWaalsContact C-N 3.27Å; Y331-R333 PolarHBondContact O-N 3.38Å; R333-A335 PolarHBondContact O-N 2.94Å
334	G	94.2	Very high	97.9	Very high	46 Å²	46	48.9 Å²	48.9	47%	0.474	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-70.5	-16.9	175.2	0	0	0	0	0	114.3	Y331 F332 P336	Y331-G334 PolarHBondContact O-N 2.92Å; F332-G334 PolarHBondContact O-N 3.38Å; G334-P336 WeakPolarHBondContact O-CD 3.24Å
335	A	98	Very high	97.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.			trans	-119.8	77	179.8	0	0	0	0	0	109.9	L310 F332 R333 K337 L338	L310-A335 HydrophobicContact CB-CB 4.07Å; L310-A335 HydrophobicContact CD1-CB 4.07Å; F332-A335 PolarHBondContact O-N 2.91Å; F332-A335 VanDerWaalsContact O-N 3.09Å; R333-A335 PolarHBondContact O-N 2.94Å; A335-K337 PolarHBondContact O-N 2.95Å; A335-L338 HydrophobicContact CB-CB 3.96Å; A335-L338 HydrophobicContact CB-CD2 4.34Å; A335-L338 VanDerWaalsContact O-CB 3.3Å; A335-L338 WeakPolarHBondContact O-CB 3.36Å; A335-L338 PolarHBondContact O-N 3.37Å; A335-L338 VanDerWaalsContact O-N 3.09Å
336	P	97.7	Very high	98	Very high	83 Å²	83	47.7 Å²	47.7	54%	0.539	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9	-171.4	28.8	-37.2	0	0	0	114.5	G334 S362	G334-P336 WeakPolarHBondContact O-CD 3.24Å; P336-S362 WeakPolarHBondContact O-CB 3.34Å
337	K	98.4	Very high	98	Very high	119 Å²	119	47.4 Å²	47.4	52%	0.517	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	4.8	177.3	-63.3	-171.1	177.7	-174.6	0	113.3	L314 E315 A335 L339	L314-K337 CarbonylContact O-C 3.23Å; L314-K337 VanDerWaalsContact O-C 3.23Å; E315-K337 HydrophobicContact CG-CB 4.39Å; A335-K337 PolarHBondContact O-N 2.95Å; K337-L339 WeakPolarHBondContact O-CG 3.22Å; K337-L339 PolarHBondContact O-N 3.25Å
338	L	98.8	Very high	98	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.			trans	-69.1	123.8	-174.2	-166.5	66.5	0	0	0	110.6	L310 L314 L317 F332 A335 V341 S362 L363	L310-L338 HydrophobicContact CD1-CD2 4.46Å; L314-L338 HydrophobicContact CB-CD1 4.36Å; L314-L338 HydrophobicContact CD2-CD1 4.03Å; L314-L338 HydrophobicContact CG-CD1 4Å; L314-L338 VanDerWaalsContact O-CA 3.26Å; L314-L338 WeakPolarHBondContact O-CA 3.09Å; L314-L338 PolarHBondContact O-N 2.83Å; L314-L338 VanDerWaalsContact O-N 3.16Å; L317-L338 HydrophobicContact CB-CD1 3.96Å; F332-L338 HydrophobicContact CB-CD2 4.46Å; F332-L338 HydrophobicContact CD1-CD2 3.34Å; F332-L338 HydrophobicContact CE1-CD2 3.89Å; F332-L338 HydrophobicContact CG-CD2 4.18Å; A335-L338 HydrophobicContact CB-CB 3.96Å; A335-L338 HydrophobicContact CB-CD2 4.34Å; A335-L338 VanDerWaalsContact O-CB 3.3Å; A335-L338 WeakPolarHBondContact O-CB 3.36Å; A335-L338 PolarHBondContact O-N 3.37Å; A335-L338 VanDerWaalsContact O-N 3.09Å; L338-V341 HydrophobicContact CD1-CG2 4.4Å; L338-V341 HydrophobicContact CD2-CG2 3.44Å; L338-V341 VanDerWaalsContact CD2-CG2 3.44Å; L338-V341 HydrophobicContact CG-CG2 3.82Å; L338-S362 CarbonylContact O-C 3.49Å; L338-S362 WeakPolarHBondContact O-CB 3.23Å; L338-S362 PolarHBondContact O-OG 3.04Å; L338-L363 HydrophobicContact CB-CD2 4.32Å; L338-L363 HydrophobicContact CD2-CD2 4.12Å; L338-L363 HydrophobicContact CG-CD2 3.96Å; L338-L363 PolarHBondContact O-N 3.28Å
339	L	98.8	Very high	98.1	Very high	46 Å²	46	46.2 Å²	46.2	24%	0.241	24%	0.236	C	C	.	.			trans	-108.6	-45.1	-175	-59	-179.6	0	0	0	111.8	E315 K337 S362 L364 E365	E315-L339 PolarHBondContact O-N 3.02Å; K337-L339 WeakPolarHBondContact O-CG 3.22Å; K337-L339 PolarHBondContact O-N 3.25Å; L339-S362 WeakPolarHBondContact CD2-O 3.08Å; L339-L364 HydrophobicContact CD2-CD1 4.13Å; L339-L364 HydrophobicContact CD2-CG 4.24Å; L339-L364 PolarHBondContact O-N 3.27Å; L339-E365 PolarHBondContact O-N 3Å; L339-E365 VanDerWaalsContact O-N 3.14Å
340	Y	98.9	Very high	98.1	Very high	85 Å²	85	43.7 Å²	43.7	33%	0.333	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123.2	-171.5	-52.1	-84.9	0	0	0	110.7	E315 Q316 L317 E365	E315-Y340 PolarHBondContact O-N 2.92Å; E315-Y340 VanDerWaalsContact O-N 3.08Å; Q316-Y340 HydrophobicContact CG-CD2 3.75Å; Q316-Y340 HydrophobicContact CG-CG 4.45Å; L317-Y340 PolarHBondContact N-O 3.33Å; Y340-E365 HydrophobicContact CD1-CB 3.79Å; Y340-E365 HydrophobicContact CE1-CB 4.34Å
341	V	98.9	Very high	98.1	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.8	176.3	175.9	0	0	0	0	110.5	L317 F332 L338 L343 L363 E365 L366 D367	L317-V341 WeakPolarHBondContact O-CA 3.43Å; F332-V341 HydrophobicContact CE1-CG1 4.3Å; F332-V341 HydrophobicContact CE1-CG2 4.11Å; F332-V341 HydrophobicContact CZ-CG1 4.08Å; L338-V341 HydrophobicContact CD1-CG2 4.4Å; L338-V341 HydrophobicContact CD2-CG2 3.44Å; L338-V341 VanDerWaalsContact CD2-CG2 3.44Å; L338-V341 HydrophobicContact CG-CG2 3.82Å; V341-L343 HydrophobicContact CG1-CD1 3.96Å; V341-L343 HydrophobicContact CG1-CG 4.17Å; V341-L363 HydrophobicContact CB-CD2 4.37Å; V341-L363 HydrophobicContact CG2-CD2 3.54Å; V341-E365 PolarHBondContact N-O 2.84Å; V341-E365 VanDerWaalsContact N-O 3.09Å; V341-L366 HydrophobicContact CB-CD1 3.95Å; V341-L366 HydrophobicContact CG1-CD1 3.91Å; V341-D367 PolarHBondContact O-N 3.09Å
342	R	98.9	Very high	98	Very high	92 Å²	92	49.1 Å²	49.1	35%	0.347	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.4	171.7	-63.2	-177.8	-177.5	166.2	-0.8	110.4	L317 Y318 M319 E320 D367	L317-R342 PolarHBondContact O-N 3.39Å; Y318-R342 HydrophobicContact CD1-CB 4Å; Y318-R342 HydrophobicContact CD1-CG 3.81Å; Y318-R342 HydrophobicContact CE1-CG 4.15Å; M319-R342 CarbonylContact C-O 3.49Å; M319-R342 WeakPolarHBondContact CA-O 3.49Å; M319-R342 PolarHBondContact N-O 2.9Å; E320-R342 HydrophobicContact CB-CB 4.46Å; E320-R342 PolarHBondContact N-O 3.05Å; E320-R342 VanDerWaalsContact OE2-CB 3.29Å; E320-R342 WeakPolarHBondContact OE2-CB 3.45Å; R342-D367 HydrophobicContact CG-CB 4.35Å
343	L	98.8	Very high	98	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.			trans	-135.8	19	-178.2	-93.6	171.1	0	0	0	110.9	M319 F332 V341 N346 L348 F358 D367 L368 N371	M319-L343 HydrophobicContact CB-CD2 3.96Å; M319-L343 HydrophobicContact CE-CD1 4.32Å; M319-L343 HydrophobicContact CE-CD2 3.84Å; M319-L343 HydrophobicContact CE-CG 4.05Å; F332-L343 HydrophobicContact CZ-CD1 4.28Å; V341-L343 HydrophobicContact CG1-CD1 3.96Å; V341-L343 HydrophobicContact CG1-CG 4.17Å; L343-N346 PolarHBondContact O-ND2 3.03Å; L343-N346 VanDerWaalsContact O-ND2 3.14Å; L343-L348 HydrophobicContact CB-CD1 4.36Å; L343-L348 HydrophobicContact CD1-CD1 4.48Å; L343-F358 HydrophobicContact CD1-CE1 3.97Å; L343-F358 HydrophobicContact CD1-CZ 4.24Å; L343-D367 CarbonylContact C-O 3.22Å; L343-D367 WeakPolarHBondContact CA-O 3.42Å; L343-D367 PolarHBondContact N-O 3.43Å; L343-L368 HydrophobicContact CB-CD2 3.65Å; L343-L368 HydrophobicContact CD1-CD2 4.21Å; L343-N371 PolarHBondContact O-ND2 3.26Å
344	S	98.9	Very high	98.1	Very high	8 Å²	8	43.7 Å²	43.7	6%	0.056	24%	0.24	C	C	.	.			trans	-66.4	161	177	47.1	0	0	0	0	112.6	E320 H321 N346 D367 S369	E320-S344 CarbonylContact C-O 3.58Å; E320-S344 WeakPolarHBondContact CA-O 3.41Å; E320-S344 WeakPolarHBondContact CB-O 3.47Å; E320-S344 WeakPolarHBondContact CB-OG 3.43Å; H321-S344 PolarHBondContact N-O 2.94Å; S344-N346 VanDerWaalsContact C-N 3.31Å; S344-N346 PolarHBondContact O-N 3.43Å; S344-N346 PolarHBondContact O-ND2 3.37Å; S344-N346 VanDerWaalsContact O-ND2 3.07Å; S344-D367 WeakPolarHBondContact CB-OD2 3.25Å; S344-D367 PolarHBondContact N-O 3.13Å; S344-D367 PolarHBondContact OG-OD2 3.21Å; S344-S369 CarbonylContact C-O 3.14Å; S344-S369 WeakPolarHBondContact CA-O 3.49Å; S344-S369 VanDerWaalsContact CB-O 3.25Å; S344-S369 WeakPolarHBondContact CB-O 3.31Å; S344-S369 WeakPolarHBondContact CB-OG 3.34Å
345	H	98.8	Very high	98.2	Very high	72 Å²	72	45.8 Å²	45.8	33%	0.333	25%	0.248	S	C	.	.	S	Bend	trans	51.7	48.8	-178.6	-66.8	-81.6	0	0	0	113.1	H321 N322 S369 Y370	H321-H345 WeakPolarHBondContact CA-O 3.47Å; H321-H345 HydrophobicContact CB-CB 4.5Å; H321-H345 AromaticContact CE1-CD2 3.4Å; H321-H345 PolarHBondContact CE1-CD2 2.92Å; H321-H345 VanDerWaalsContact CE1-CD2 3.4Å; H321-H345 AromaticContact CE1-CG 3.35Å; H321-H345 AromaticContact CE1-ND1 3.81Å; H321-H345 AromaticContact CE1-NE2 3.9Å; H321-H345 AromaticContact ND1-CG 3.77Å; H321-H345 AromaticContact NE2-CD2 3.28Å; H321-H345 PolarHBondContact NE2-CD2 3.14Å; H321-H345 VanDerWaalsContact NE2-CD2 3.28Å; H321-H345 AromaticContact NE2-CG 3.65Å; H321-H345 AromaticContact NE2-NE2 3.94Å; N322-H345 PolarHBondContact N-O 2.82Å; H345-S369 PolarHBondContact N-O 3.19Å; H345-Y370 WeakPolarHBondContact CA-O 3.5Å; H345-Y370 AromaticContact CE1-CD1 3.95Å; H345-Y370 AromaticContact CE1-CD2 3.56Å; H345-Y370 AromaticContact CE1-CG 3.39Å; H345-Y370 AromaticContact ND1-CG 3.92Å; H345-Y370 AromaticContact NE2-CD2 3.39Å; H345-Y370 WeakPolarHBondContact NE2-CD2 3.44Å; H345-Y370 AromaticContact NE2-CG 3.71Å
346	N	98.9	Very high	98	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	26%	0.257	C	S	.	.	S	Bend	trans	-119.2	-167.8	174.3	-88.4	-80.2	0	0	0	110.4	M319 N322 N323 V324 L343 S344 L348 N371 Q372	M319-N346 PolarHBondContact O-ND2 3Å; N322-N346 WeakPolarHBondContact CA-OD1 3.38Å; N322-N346 WeakPolarHBondContact CB-OD1 3.33Å; N322-N346 PolarHBondContact O-OD1 3.3Å; N323-N346 PolarHBondContact N-OD1 2.66Å; V324-N346 HydrophobicContact CB-CB 4.43Å; V324-N346 VanDerWaalsContact CB-OD1 3.25Å; V324-N346 WeakPolarHBondContact CB-OD1 3.14Å; V324-N346 WeakPolarHBondContact CG2-OD1 3.26Å; V324-N346 PolarHBondContact N-OD1 3.38Å; L343-N346 PolarHBondContact O-ND2 3.03Å; L343-N346 VanDerWaalsContact O-ND2 3.14Å; S344-N346 VanDerWaalsContact C-N 3.31Å; S344-N346 PolarHBondContact O-N 3.43Å; S344-N346 PolarHBondContact O-ND2 3.37Å; S344-N346 VanDerWaalsContact O-ND2 3.07Å; N346-L348 HydrophobicContact CB-CG 4.28Å; N346-N371 VanDerWaalsContact CA-OD1 3.32Å; N346-N371 WeakPolarHBondContact CA-OD1 3.39Å; N346-N371 WeakPolarHBondContact CB-OD1 3.49Å; N346-N371 PolarHBondContact N-OD1 3.27Å; N346-N371 PolarHBondContact O-OD1 2.94Å; N346-Q372 PolarHBondContact O-NE2 3.14Å; N346-Q372 VanDerWaalsContact O-NE2 3.08Å
347	S	98.6	Very high	98.1	Very high	45 Å²	45	43.7 Å²	43.7	32%	0.315	23%	0.232	S	C	.	.			trans	-112.6	31.4	-179.7	-56.7	0	0	0	0	113.2	V324 Y325 N371 Q372	V324-S347 CarbonylContact O-C 2.96Å; V324-S347 VanDerWaalsContact O-C 3.28Å; V324-S347 WeakPolarHBondContact O-CA 3.37Å; V324-S347 PolarHBondContact O-N 3.31Å; Y325-S347 WeakPolarHBondContact CA-O 3.33Å; S347-N371 PolarHBondContact N-OD1 3.01Å; S347-Q372 VanDerWaalsContact C-OE1 3.31Å
348	L	98.6	Very high	98	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.208	C	C	.	.			trans	-71.6	137.9	-174.9	-60	175.5	0	0	0	111.6	V324 V327 L343 N346 L353 L368 N371 Q372 L373	V324-L348 HydrophobicContact CG1-CD2 3.96Å; V324-L348 PolarHBondContact O-N 3.33Å; V327-L348 HydrophobicContact CG2-CD2 3.96Å; L343-L348 HydrophobicContact CB-CD1 4.36Å; L343-L348 HydrophobicContact CD1-CD1 4.48Å; N346-L348 HydrophobicContact CB-CG 4.28Å; L348-L353 HydrophobicContact CD2-CD2 4.37Å; L348-L368 HydrophobicContact CD1-CD2 3.9Å; L348-N371 HydrophobicContact CB-CB 4.08Å; L348-N371 VanDerWaalsContact CB-OD1 3.27Å; L348-N371 WeakPolarHBondContact CB-OD1 3.2Å; L348-N371 VanDerWaalsContact CG-OD1 3.32Å; L348-N371 WeakPolarHBondContact CG-OD1 3.45Å; L348-N371 PolarHBondContact N-OD1 2.95Å; L348-Q372 CarbonylContact O-C 3.22Å; L348-Q372 VanDerWaalsContact O-C 3.22Å; L348-Q372 WeakPolarHBondContact O-CA 3.46Å; L348-Q372 PolarHBondContact O-N 2.91Å; L348-L373 HydrophobicContact CB-CD2 4.24Å; L348-L373 PolarHBondContact O-N 2.9Å
349	T	98.4	Very high	97.9	Very high	48 Å²	48	41 Å²	41	29%	0.294	22%	0.223	S	C	.	.			trans	-131.3	156.4	172.2	64.7	0	0	0	0	109.1	N351 G352 L353 Q372	T349-N351 PolarHBondContact O-N 3.46Å; T349-N351 VanDerWaalsContact O-N 3.17Å; T349-G352 PolarHBondContact O-N 2.97Å; T349-L353 WeakPolarHBondContact O-CG 3.14Å; T349-Q372 HydrophobicContact CG2-CB 4.09Å
350	N	97.9	Very high	97.8	Very high	42 Å²	42	39.2 Å²	39.2	23%	0.225	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-59.2	-29.2	177.9	-62.1	89.2	0	0	0	113.3	G352 L353 Q374 K375	N350-G352 VanDerWaalsContact C-N 3.25Å; N350-G352 PolarHBondContact O-N 3.01Å; N350-L353 PolarHBondContact O-N 2.91Å; N350-L353 VanDerWaalsContact O-O 3.07Å; N350-Q374 PolarHBondContact OD1-N 3.08Å; N350-K375 PolarHBondContact ND2-O 3.32Å; N350-K375 PolarHBondContact OD1-N 2.87Å
351	N	97.4	Very high	97.8	Very high	162 Å²	162	39.1 Å²	39.1	87%	0.866	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-69.4	-24.5	176.8	-67.2	-16.1	0	0	0	112.8	T349 L353	T349-N351 PolarHBondContact O-N 3.46Å; T349-N351 VanDerWaalsContact O-N 3.17Å; N351-L353 VanDerWaalsContact C-N 3.3Å
352	G	96.6	Very high	97.7	Very high	11 Å²	11	39.9 Å²	39.9	11%	0.113	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-88.1	4.5	176.5	0	0	0	0	0	114.1	T326 V327 T349 N350	T326-G352 VanDerWaalsContact CA-O 3.28Å; T326-G352 WeakPolarHBondContact CA-O 3.16Å; V327-G352 PolarHBondContact N-O 3.45Å; T349-G352 PolarHBondContact O-N 2.97Å; N350-G352 VanDerWaalsContact C-N 3.25Å; N350-G352 PolarHBondContact O-N 3.01Å
353	L	98.1	Very high	97.7	Very high	25 Å²	25	35.6 Å²	35.6	13%	0.131	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-125	139.7	-175.7	-60.3	172.7	0	0	0	109.8	V327 L348 T349 N350 N351 T357 F358 L373	V327-L353 HydrophobicContact CB-CD2 3.78Å; V327-L353 HydrophobicContact CG2-CD2 3.93Å; L348-L353 HydrophobicContact CD2-CD2 4.37Å; T349-L353 WeakPolarHBondContact O-CG 3.14Å; N350-L353 PolarHBondContact O-N 2.91Å; N350-L353 VanDerWaalsContact O-O 3.07Å; N351-L353 VanDerWaalsContact C-N 3.3Å; L353-T357 HydrophobicContact CD2-CG2 4.15Å; L353-F358 HydrophobicContact CD1-CE2 3.82Å; L353-F358 HydrophobicContact CD2-CE2 3.82Å; L353-F358 HydrophobicContact CD2-CZ 4.17Å; L353-F358 HydrophobicContact CG-CE2 4.4Å; L353-L373 HydrophobicContact CD1-CD2 3.61Å
354	A	97.2	Very high	97.7	Very high	28 Å²	28	38 Å²	38	23%	0.231	23%	0.228	C	C	.	.			trans	-82.2	160.7	167.5	0	0	0	0	0	110.4	D329 N356 T357	D329-A354 HydrophobicContact CB-CB 3.88Å; D329-A354 WeakPolarHBondContact OD1-CB 3.32Å; A354-N356 PolarHBondContact O-N 3.27Å; A354-T357 WeakPolarHBondContact CB-OG1 3.35Å; A354-T357 PolarHBondContact N-OG1 2.87Å; A354-T357 WeakPolarHBondContact O-CB 3.32Å; A354-T357 PolarHBondContact O-N 3.08Å; A354-T357 PolarHBondContact O-OG1 2.89Å
355	S	94.9	Very high	97.7	Very high	90 Å²	90	39.3 Å²	39.3	63%	0.629	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.2	179.8	57.4	0	0	0	0	113.5	P378	S355-P378 WeakPolarHBondContact O-CB 3.39Å; S355-P378 WeakPolarHBondContact O-CG 3.43Å
356	N	95.2	Very high	97.7	Very high	37 Å²	37	35.9 Å²	35.9	20%	0.198	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	4.6	-179.3	66.4	13.2	0	0	0	113.2	D329 S330 A354 F358 N359	D329-N356 VanDerWaalsContact OD1-CG 3.25Å; D329-N356 PolarHBondContact OD1-ND2 2.95Å; D329-N356 PolarHBondContact OD1-OD1 3.36Å; D329-N356 PolarHBondContact OD2-ND2 3.14Å; D329-N356 PolarHBondContact OD2-OD1 2.76Å; S330-N356 PolarHBondContact N-OD1 2.72Å; S330-N356 PolarHBondContact OG-ND2 3.32Å; S330-N356 VanDerWaalsContact OG-ND2 3.1Å; A354-N356 PolarHBondContact O-N 3.27Å; N356-F358 PolarHBondContact O-N 3.07Å; N356-N359 PolarHBondContact O-N 2.64Å; N356-N359 VanDerWaalsContact O-N 3.14Å
357	T	97.9	Very high	97.7	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-49.4	-172.9	-71.8	0	0	0	0	111.6	V327 P328 F332 L353 A354	V327-T357 HydrophobicContact CB-CG2 3.73Å; V327-T357 HydrophobicContact CG1-CG2 3.46Å; V327-T357 VanDerWaalsContact CG1-CG2 3.46Å; P328-T357 PolarHBondContact O-OG1 3.41Å; F332-T357 VanDerWaalsContact CD2-O 3.26Å; F332-T357 WeakPolarHBondContact CD2-O 3.27Å; L353-T357 HydrophobicContact CD2-CG2 4.15Å; A354-T357 WeakPolarHBondContact CB-OG1 3.35Å; A354-T357 PolarHBondContact N-OG1 2.87Å; A354-T357 WeakPolarHBondContact O-CB 3.32Å; A354-T357 PolarHBondContact O-N 3.08Å; A354-T357 PolarHBondContact O-OG1 2.89Å
358	F	98	Very high	97.7	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.018	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	8.5	-179.9	-60.7	-71.4	0	0	0	113.6	F332 L343 L353 N356 S360 L366 L368 P377 V379	F332-F358 HydrophobicContact CD2-CD1 4.15Å; F332-F358 AromaticContact CE2-CD1 3.52Å; F332-F358 HydrophobicContact CE2-CD1 3.52Å; F332-F358 AromaticContact CE2-CE1 3.55Å; F332-F358 HydrophobicContact CE2-CE1 3.55Å; F332-F358 HydrophobicContact CZ-CD1 4.44Å; F332-F358 HydrophobicContact CZ-CE1 4.14Å; L343-F358 HydrophobicContact CD1-CE1 3.97Å; L343-F358 HydrophobicContact CD1-CZ 4.24Å; L353-F358 HydrophobicContact CD1-CE2 3.82Å; L353-F358 HydrophobicContact CD2-CE2 3.82Å; L353-F358 HydrophobicContact CD2-CZ 4.17Å; L353-F358 HydrophobicContact CG-CE2 4.4Å; N356-F358 PolarHBondContact O-N 3.07Å; F358-S360 VanDerWaalsContact C-N 3.27Å; F358-S360 PolarHBondContact O-N 3.37Å; F358-L366 HydrophobicContact CB-CD2 3.93Å; F358-L366 HydrophobicContact CD1-CD1 3.94Å; F358-L366 HydrophobicContact CD1-CD2 3.67Å; F358-L366 HydrophobicContact CD1-CG 4.47Å; F358-L366 HydrophobicContact CE1-CD1 4.01Å; F358-L366 HydrophobicContact CE1-CD2 4.37Å; F358-L366 HydrophobicContact CG-CD2 3.87Å; F358-L368 HydrophobicContact CD2-CD1 4.16Å; F358-L368 HydrophobicContact CE1-CD1 4.29Å; F358-L368 HydrophobicContact CE1-CD2 3.92Å; F358-L368 HydrophobicContact CE2-CD1 3.82Å; F358-L368 HydrophobicContact CE2-CD2 4.3Å; F358-L368 HydrophobicContact CZ-CD1 3.91Å; F358-L368 HydrophobicContact CZ-CD2 3.6Å; F358-L368 HydrophobicContact CZ-CG 4.4Å; F358-P377 HydrophobicContact CD2-CB 3.98Å; F358-P377 HydrophobicContact CD2-CG 4.24Å; F358-P377 HydrophobicContact CE2-CB 4.47Å; F358-V379 HydrophobicContact CB-CG1 4.48Å
359	N	96.3	Very high	97.8	Very high	58 Å²	58	35 Å²	35	31%	0.31	21%	0.21	S	C	.	.			trans	-84.1	73.7	176	-170.8	-1.1	0	0	0	110.1	N356 N380	N356-N359 PolarHBondContact O-N 2.64Å; N356-N359 VanDerWaalsContact O-N 3.14Å; N359-N380 WeakPolarHBondContact OD1-CB 3.21Å; N359-N380 PolarHBondContact OD1-ND2 2.86Å
360	S	97.5	Very high	97.8	Very high	10 Å²	10	38.5 Å²	38.5	7%	0.07	22%	0.218	C	C	.	.			trans	-114.2	134.2	174.3	-176	0	0	0	0	110.6	F358 S362 N380	F358-S360 VanDerWaalsContact C-N 3.27Å; F358-S360 PolarHBondContact O-N 3.37Å; S360-S362 VanDerWaalsContact C-N 3.28Å; S360-S362 PolarHBondContact O-N 3.29Å; S360-S362 PolarHBondContact OG-OG 3.42Å; S360-N380 WeakPolarHBondContact O-CB 3.18Å
361	S	97.3	Very high	97.8	Very high	82 Å²	82	36.7 Å²	36.7	57%	0.573	21%	0.209	S	C	*	.	S	Bend	trans	-76.1	-13.2	-178.3	56.8	0	0	0	0	114.5	N382	S361-N382 PolarHBondContact O-ND2 3.46Å
362	S	98.3	Very high	97.9	Very high	18 Å²	18	32.6 Å²	32.6	13%	0.126	19%	0.185	C	C	.	.	S	Bend	trans	-90.5	-24.7	-176.5	64	0	0	0	0	113.8	P336 L338 L339 S360	P336-S362 WeakPolarHBondContact O-CB 3.34Å; L338-S362 CarbonylContact O-C 3.49Å; L338-S362 WeakPolarHBondContact O-CB 3.23Å; L338-S362 PolarHBondContact O-OG 3.04Å; L339-S362 WeakPolarHBondContact CD2-O 3.08Å; S360-S362 VanDerWaalsContact C-N 3.28Å; S360-S362 PolarHBondContact O-N 3.29Å; S360-S362 PolarHBondContact OG-OG 3.42Å
363	L	98.6	Very high	98	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	18%	0.179	C	C	.	.			trans	-67.7	134.7	-172.6	-69.9	173.5	0	0	0	111.2	L338 V341 L383	L338-L363 HydrophobicContact CB-CD2 4.32Å; L338-L363 HydrophobicContact CD2-CD2 4.12Å; L338-L363 HydrophobicContact CG-CD2 3.96Å; L338-L363 PolarHBondContact O-N 3.28Å; V341-L363 HydrophobicContact CB-CD2 4.37Å; V341-L363 HydrophobicContact CG2-CD2 3.54Å; L363-L383 HydrophobicContact CB-CD1 3.85Å
364	L	98.8	Very high	98	Very high	49 Å²	49	36.1 Å²	36.1	26%	0.257	20%	0.197	S	C	.	.	S	Bend	trans	-107.3	-39.6	173.4	-60.6	-179.6	0	0	0	110.8	L339 L383 E384 N385	L339-L364 HydrophobicContact CD2-CD1 4.13Å; L339-L364 HydrophobicContact CD2-CG 4.24Å; L339-L364 PolarHBondContact O-N 3.27Å; L364-L383 WeakPolarHBondContact O-CD1 3.26Å; L364-E384 HydrophobicContact CD2-CG 4.29Å; L364-E384 PolarHBondContact O-N 3.38Å; L364-N385 PolarHBondContact O-N 3.35Å
365	E	98.9	Very high	98	Very high	37 Å²	37	40 Å²	40	17%	0.173	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.5	-178.3	-176	166.4	126	0	0	112	L339 Y340 V341 N385 Y387	L339-E365 PolarHBondContact O-N 3Å; L339-E365 VanDerWaalsContact O-N 3.14Å; Y340-E365 HydrophobicContact CD1-CB 3.79Å; Y340-E365 HydrophobicContact CE1-CB 4.34Å; V341-E365 PolarHBondContact N-O 2.84Å; V341-E365 VanDerWaalsContact N-O 3.09Å; E365-N385 HydrophobicContact CB-CB 4.25Å; E365-N385 HydrophobicContact CG-CB 3.95Å; E365-N385 PolarHBondContact OE2-ND2 2.98Å; E365-Y387 HydrophobicContact CG-CD2 4.46Å; E365-Y387 HydrophobicContact CG-CE2 3.86Å
366	L	98.9	Very high	98.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	115.7	178.8	178.4	59.5	0	0	0	110.4	V341 F358 L368 V379 L383 N385 L386 Y387	V341-L366 HydrophobicContact CB-CD1 3.95Å; V341-L366 HydrophobicContact CG1-CD1 3.91Å; F358-L366 HydrophobicContact CB-CD2 3.93Å; F358-L366 HydrophobicContact CD1-CD1 3.94Å; F358-L366 HydrophobicContact CD1-CD2 3.67Å; F358-L366 HydrophobicContact CD1-CG 4.47Å; F358-L366 HydrophobicContact CE1-CD1 4.01Å; F358-L366 HydrophobicContact CE1-CD2 4.37Å; F358-L366 HydrophobicContact CG-CD2 3.87Å; L366-L368 HydrophobicContact CD1-CD1 4.37Å; L366-L368 HydrophobicContact CD1-CD2 4.12Å; L366-L368 HydrophobicContact CD1-CG 3.98Å; L366-L368 HydrophobicContact CD2-CD1 3.86Å; L366-L368 HydrophobicContact CD2-CG 4.3Å; L366-L368 HydrophobicContact CG-CD1 4.04Å; L366-L368 HydrophobicContact CG-CG 3.91Å; L366-V379 HydrophobicContact CD2-CG1 4.36Å; L366-L383 HydrophobicContact CB-CD1 3.99Å; L366-L383 HydrophobicContact CB-CD2 4.17Å; L366-N385 PolarHBondContact N-O 3.14Å; L366-L386 HydrophobicContact CB-CD1 4.13Å; L366-L386 HydrophobicContact CD2-CD1 4.02Å; L366-L386 HydrophobicContact CG-CD1 4.08Å; L366-Y387 PolarHBondContact O-N 3.21Å
367	D	98.9	Very high	98.3	Very high	24 Å²	24	34.3 Å²	34.3	13%	0.128	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	114.6	172.7	-177.1	13.4	0	0	0	111.5	V341 R342 L343 S344 S369 Y387	V341-D367 PolarHBondContact O-N 3.09Å; R342-D367 HydrophobicContact CG-CB 4.35Å; L343-D367 CarbonylContact C-O 3.22Å; L343-D367 WeakPolarHBondContact CA-O 3.42Å; L343-D367 PolarHBondContact N-O 3.43Å; S344-D367 WeakPolarHBondContact CB-OD2 3.25Å; S344-D367 PolarHBondContact N-O 3.13Å; S344-D367 PolarHBondContact OG-OD2 3.21Å; D367-S369 WeakPolarHBondContact OD1-CB 3.2Å; D367-S369 PolarHBondContact OD1-N 3.06Å; D367-S369 PolarHBondContact OD1-OG 2.74Å; D367-Y387 HydrophobicContact CB-CD2 4.04Å; D367-Y387 WeakPolarHBondContact OD1-CB 3.19Å
368	L	98.9	Very high	98.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.			trans	-123.3	18.1	176.5	-64.2	175.6	0	0	0	111.4	L343 L348 F358 L366 N371 L373 P377 Y387 L388 N391	L343-L368 HydrophobicContact CB-CD2 3.65Å; L343-L368 HydrophobicContact CD1-CD2 4.21Å; L348-L368 HydrophobicContact CD1-CD2 3.9Å; F358-L368 HydrophobicContact CD2-CD1 4.16Å; F358-L368 HydrophobicContact CE1-CD1 4.29Å; F358-L368 HydrophobicContact CE1-CD2 3.92Å; F358-L368 HydrophobicContact CE2-CD1 3.82Å; F358-L368 HydrophobicContact CE2-CD2 4.3Å; F358-L368 HydrophobicContact CZ-CD1 3.91Å; F358-L368 HydrophobicContact CZ-CD2 3.6Å; F358-L368 HydrophobicContact CZ-CG 4.4Å; L366-L368 HydrophobicContact CD1-CD1 4.37Å; L366-L368 HydrophobicContact CD1-CD2 4.12Å; L366-L368 HydrophobicContact CD1-CG 3.98Å; L366-L368 HydrophobicContact CD2-CD1 3.86Å; L366-L368 HydrophobicContact CD2-CG 4.3Å; L366-L368 HydrophobicContact CG-CD1 4.04Å; L366-L368 HydrophobicContact CG-CG 3.91Å; L368-N371 PolarHBondContact O-ND2 2.82Å; L368-L373 HydrophobicContact CB-CD1 4.18Å; L368-L373 HydrophobicContact CD1-CD1 4.35Å; L368-P377 HydrophobicContact CD1-CG 3.86Å; L368-Y387 CarbonylContact C-O 3.44Å; L368-Y387 WeakPolarHBondContact CA-O 3.48Å; L368-Y387 PolarHBondContact N-O 2.81Å; L368-L388 HydrophobicContact CB-CD2 3.73Å; L368-L388 HydrophobicContact CD1-CD2 4.17Å; L368-N391 PolarHBondContact O-ND2 3.47Å
369	S	98.9	Very high	98.4	Very high	5 Å²	5	36.8 Å²	36.8	4%	0.035	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	155	180	63.3	0	0	0	0	112.5	S344 H345 D367 N371 Y387 Q389	S344-S369 CarbonylContact C-O 3.14Å; S344-S369 WeakPolarHBondContact CA-O 3.49Å; S344-S369 VanDerWaalsContact CB-O 3.25Å; S344-S369 WeakPolarHBondContact CB-O 3.31Å; S344-S369 WeakPolarHBondContact CB-OG 3.34Å; H345-S369 PolarHBondContact N-O 3.19Å; D367-S369 WeakPolarHBondContact OD1-CB 3.2Å; D367-S369 PolarHBondContact OD1-N 3.06Å; D367-S369 PolarHBondContact OD1-OG 2.74Å; S369-N371 VanDerWaalsContact C-N 3.31Å; S369-N371 PolarHBondContact O-N 3.12Å; S369-N371 PolarHBondContact O-ND2 3.3Å; S369-Y387 PolarHBondContact N-O 3.26Å; S369-Q389 CarbonylContact C-O 3.55Å; S369-Q389 VanDerWaalsContact CA-O 3.23Å; S369-Q389 WeakPolarHBondContact CA-O 3.24Å; S369-Q389 VanDerWaalsContact CB-NE2 3.35Å; S369-Q389 WeakPolarHBondContact CB-O 3.3Å
370	Y	98.8	Very high	98.5	Very high	122 Å²	122	35.5 Å²	35.5	48%	0.478	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	44	178.5	-63.4	-81.9	0	0	0	114.4	H345 Q389	H345-Y370 WeakPolarHBondContact CA-O 3.5Å; H345-Y370 AromaticContact CE1-CD1 3.95Å; H345-Y370 AromaticContact CE1-CD2 3.56Å; H345-Y370 AromaticContact CE1-CG 3.39Å; H345-Y370 AromaticContact ND1-CG 3.92Å; H345-Y370 AromaticContact NE2-CD2 3.39Å; H345-Y370 WeakPolarHBondContact NE2-CD2 3.44Å; H345-Y370 AromaticContact NE2-CG 3.71Å; Y370-Q389 HydrophobicContact CE2-CG 4.36Å; Y370-Q389 PolarHBondContact N-O 3.09Å
371	N	98.8	Very high	98.5	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.027	19%	0.194	C	C	.	.	S	Bend	trans	-106.9	-161.2	167.5	-83	-79.9	0	0	0	110.1	L343 N346 S347 L348 L368 S369 L373 N391	L343-N371 PolarHBondContact O-ND2 3.26Å; N346-N371 VanDerWaalsContact CA-OD1 3.32Å; N346-N371 WeakPolarHBondContact CA-OD1 3.39Å; N346-N371 WeakPolarHBondContact CB-OD1 3.49Å; N346-N371 PolarHBondContact N-OD1 3.27Å; N346-N371 PolarHBondContact O-OD1 2.94Å; S347-N371 PolarHBondContact N-OD1 3.01Å; L348-N371 HydrophobicContact CB-CB 4.08Å; L348-N371 VanDerWaalsContact CB-OD1 3.27Å; L348-N371 WeakPolarHBondContact CB-OD1 3.2Å; L348-N371 VanDerWaalsContact CG-OD1 3.32Å; L348-N371 WeakPolarHBondContact CG-OD1 3.45Å; L348-N371 PolarHBondContact N-OD1 2.95Å; L368-N371 PolarHBondContact O-ND2 2.82Å; S369-N371 VanDerWaalsContact C-N 3.31Å; S369-N371 PolarHBondContact O-N 3.12Å; S369-N371 PolarHBondContact O-ND2 3.3Å; N371-L373 HydrophobicContact CB-CG 4.21Å; N371-N391 VanDerWaalsContact CA-OD1 3.26Å; N371-N391 WeakPolarHBondContact CA-OD1 3.44Å; N371-N391 WeakPolarHBondContact CB-OD1 3.09Å; N371-N391 PolarHBondContact N-OD1 2.65Å; N371-N391 PolarHBondContact O-OD1 2.96Å
372	Q	98.6	Very high	98.5	Very high	76 Å²	76	36 Å²	36	36%	0.355	18%	0.178	S	C	.	.			trans	-122.1	38.6	176.3	-59	86.2	58.4	0	0	111.4	N346 S347 L348 T349 N391	N346-Q372 PolarHBondContact O-NE2 3.14Å; N346-Q372 VanDerWaalsContact O-NE2 3.08Å; S347-Q372 VanDerWaalsContact C-OE1 3.31Å; L348-Q372 CarbonylContact O-C 3.22Å; L348-Q372 VanDerWaalsContact O-C 3.22Å; L348-Q372 WeakPolarHBondContact O-CA 3.46Å; L348-Q372 PolarHBondContact O-N 2.91Å; T349-Q372 HydrophobicContact CG2-CB 4.09Å; Q372-N391 PolarHBondContact N-OD1 3.22Å
373	L	98.7	Very high	98.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.			trans	-70.6	134.5	176.3	-57.6	173.2	0	0	0	110.2	L348 L353 L368 N371 P377 L388 N391 R392 I393	L348-L373 HydrophobicContact CB-CD2 4.24Å; L348-L373 PolarHBondContact O-N 2.9Å; L353-L373 HydrophobicContact CD1-CD2 3.61Å; L368-L373 HydrophobicContact CB-CD1 4.18Å; L368-L373 HydrophobicContact CD1-CD1 4.35Å; N371-L373 HydrophobicContact CB-CG 4.21Å; L373-P377 HydrophobicContact CD1-CG 4.44Å; L373-L388 HydrophobicContact CD1-CD2 3.64Å; L373-N391 HydrophobicContact CB-CB 4.22Å; L373-N391 WeakPolarHBondContact CB-OD1 3.35Å; L373-N391 WeakPolarHBondContact CG-OD1 3.43Å; L373-N391 PolarHBondContact N-OD1 3.19Å; L373-R392 CarbonylContact O-C 3.03Å; L373-R392 VanDerWaalsContact O-CA 3.22Å; L373-R392 WeakPolarHBondContact O-CA 3.22Å; L373-R392 PolarHBondContact O-N 3.09Å; L373-I393 HydrophobicContact CB-CG1 4.38Å; L373-I393 PolarHBondContact O-N 2.9Å; L373-I393 VanDerWaalsContact O-N 3.09Å
374	Q	98.3	Very high	98.5	Very high	109 Å²	109	38.1 Å²	38.1	51%	0.509	19%	0.187	S	C	.	.	S	Bend	trans	-101.4	-18.5	175.3	-64.5	177.5	28.3	0	0	112.8	N350 R392 I393 N394	N350-Q374 PolarHBondContact OD1-N 3.08Å; Q374-R392 WeakPolarHBondContact CA-O 3.38Å; Q374-R392 HydrophobicContact CG-CB 4.42Å; Q374-I393 WeakPolarHBondContact O-CA 3.19Å; Q374-N394 PolarHBondContact O-N 3.21Å; Q374-N394 PolarHBondContact O-OD1 3.47Å
375	K	98.2	Very high	98.5	Very high	110 Å²	110	37.2 Å²	37.2	48%	0.478	18%	0.182	S	C	.	.	B	Isolated β-bridge	trans	-135.1	151.3	177	-57.1	-173.9	177.8	-166.1	0	110.3	N350 P377	N350-K375 PolarHBondContact ND2-O 3.32Å; N350-K375 PolarHBondContact OD1-N 2.87Å; K375-P377 WeakPolarHBondContact O-CD 3.45Å
376	I	98.4	Very high	98.5	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.015	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-63.9	116	172.3	-56.9	174.5	0	0	0	108.3	L388 I393 F396 S400 F401 L418	I376-L388 HydrophobicContact CG1-CD1 4.4Å; I376-L388 HydrophobicContact CG2-CD1 3.93Å; I376-I393 HydrophobicContact CG1-CD1 4.25Å; I376-I393 HydrophobicContact CG1-CG2 4.14Å; I376-F396 HydrophobicContact CD1-CD2 4.18Å; I376-F396 HydrophobicContact CD1-CE2 4.45Å; I376-F396 HydrophobicContact CD1-CG 4.44Å; I376-S400 PolarHBondContact O-OG 3.34Å; I376-F401 HydrophobicContact CD1-CE2 4.07Å; I376-F401 HydrophobicContact CD1-CZ 4.11Å; I376-F401 HydrophobicContact CG2-CE1 4.31Å; I376-F401 HydrophobicContact CG2-CE2 4.28Å; I376-F401 HydrophobicContact CG2-CZ 3.82Å; I376-L418 HydrophobicContact CD1-CD1 4.13Å; I376-L418 HydrophobicContact CD1-CD2 4.22Å; I376-L418 HydrophobicContact CG1-CD2 4.19Å
377	P	98.1	Very high	98.5	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.032	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-65.8	145.1	177.8	27.9	-33.2	0	0	0	110.4	F358 L368 L373 K375 V379	F358-P377 HydrophobicContact CD2-CB 3.98Å; F358-P377 HydrophobicContact CD2-CG 4.24Å; F358-P377 HydrophobicContact CE2-CB 4.47Å; L368-P377 HydrophobicContact CD1-CG 3.86Å; L373-P377 HydrophobicContact CD1-CG 4.44Å; K375-P377 WeakPolarHBondContact O-CD 3.45Å; P377-V379 PolarHBondContact O-N 2.68Å
378	P	98.2	Very high	98.5	Very high	48 Å²	48	37 Å²	37	31%	0.312	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-63.5	135.9	177.7	-21.2	33	0	0	0	112.1	S355 S400	S355-P378 WeakPolarHBondContact O-CB 3.39Å; S355-P378 WeakPolarHBondContact O-CG 3.43Å; P378-S400 WeakPolarHBondContact CA-O 3.22Å
379	V	98.3	Very high	98.5	Very high	10 Å²	10	38 Å²	38	6%	0.061	18%	0.183	C	C	.	.			trans	-123.8	163.3	-180	-64.7	0	0	0	0	111	F358 L366 P377 L383 L386 S400 F401	F358-V379 HydrophobicContact CB-CG1 4.48Å; L366-V379 HydrophobicContact CD2-CG1 4.36Å; P377-V379 PolarHBondContact O-N 2.68Å; V379-L383 HydrophobicContact CB-CD2 3.97Å; V379-L383 HydrophobicContact CG1-CD2 3.88Å; V379-L383 HydrophobicContact CG2-CD2 4.26Å; V379-L386 HydrophobicContact CG1-CD2 4.29Å; V379-S400 PolarHBondContact N-O 3.08Å; V379-F401 HydrophobicContact CG2-CD1 3.83Å; V379-F401 HydrophobicContact CG2-CE1 4.39Å
380	N	98.3	Very high	98.5	Very high	30 Å²	30	38.8 Å²	38.8	16%	0.16	19%	0.192	C	C	.	.			trans	-76.5	152.3	173.4	-165.6	-91.5	0	0	0	111.2	N359 S360 N382 L383	N359-N380 WeakPolarHBondContact OD1-CB 3.21Å; N359-N380 PolarHBondContact OD1-ND2 2.86Å; S360-N380 WeakPolarHBondContact O-CB 3.18Å; N380-N382 PolarHBondContact O-N 3.06Å; N380-N382 WeakPolarHBondContact OD1-CB 3.3Å; N380-N382 PolarHBondContact OD1-N 3.16Å; N380-L383 PolarHBondContact O-N 3.17Å
381	T	97.8	Very high	98.5	Very high	55 Å²	55	33.2 Å²	33.2	34%	0.337	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.7	177.3	50.7	0	0	0	0	113.8	K412	T381-K412 VanDerWaalsContact O-CB 3.3Å; T381-K412 WeakPolarHBondContact O-CB 3.4Å; T381-K412 WeakPolarHBondContact O-CG 3.3Å; T381-K412 PolarHBondContact O-N 2.78Å
382	N	98	Very high	98.5	Very high	47 Å²	47	39.8 Å²	39.8	25%	0.251	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-16	175.9	-76.5	-22.3	0	0	0	115	S361 N380 E384 K412	S361-N382 PolarHBondContact O-ND2 3.46Å; N380-N382 PolarHBondContact O-N 3.06Å; N380-N382 WeakPolarHBondContact OD1-CB 3.3Å; N380-N382 PolarHBondContact OD1-N 3.16Å; N382-E384 PolarHBondContact O-N 3.09Å; N382-K412 PolarHBondContact OD1-NZ 2.87Å
383	L	98.6	Very high	98.5	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	18%	0.178	C	C	.	.			trans	-63.3	135.7	-177.2	-169	72.7	0	0	0	110.7	L363 L364 L366 V379 N380 L386 K412 L413	L363-L383 HydrophobicContact CB-CD1 3.85Å; L364-L383 WeakPolarHBondContact O-CD1 3.26Å; L366-L383 HydrophobicContact CB-CD1 3.99Å; L366-L383 HydrophobicContact CB-CD2 4.17Å; V379-L383 HydrophobicContact CB-CD2 3.97Å; V379-L383 HydrophobicContact CG1-CD2 3.88Å; V379-L383 HydrophobicContact CG2-CD2 4.26Å; N380-L383 PolarHBondContact O-N 3.17Å; L383-L386 HydrophobicContact CD2-CB 3.99Å; L383-L386 HydrophobicContact CD2-CD1 4.13Å; L383-L386 HydrophobicContact CD2-CD2 4.49Å; L383-L386 HydrophobicContact CD2-CG 4.43Å; L383-K412 CarbonylContact O-C 3.42Å; L383-L413 HydrophobicContact CB-CD1 4.44Å; L383-L413 HydrophobicContact CD2-CD1 4.23Å; L383-L413 HydrophobicContact CG-CD1 4.21Å; L383-L413 VanDerWaalsContact O-CA 3.26Å; L383-L413 WeakPolarHBondContact O-CA 3.2Å; L383-L413 PolarHBondContact O-N 3.33Å; L383-L413 VanDerWaalsContact O-N 3.15Å
384	E	98.6	Very high	98.4	Very high	62 Å²	62	40 Å²	40	29%	0.29	20%	0.199	S	C	.	.			trans	-103.8	-41.3	-176.9	-60.1	-171.1	-175.8	0	0	111.8	L364 N382 L413 Q414 V415	L364-E384 HydrophobicContact CD2-CG 4.29Å; L364-E384 PolarHBondContact O-N 3.38Å; N382-E384 PolarHBondContact O-N 3.09Å; E384-L413 WeakPolarHBondContact O-CD1 3.44Å; E384-Q414 PolarHBondContact O-N 3.5Å; E384-Q414 PolarHBondContact OE2-NE2 2.99Å; E384-V415 PolarHBondContact O-N 3.14Å; E384-V415 VanDerWaalsContact O-N 3.12Å
385	N	98.8	Very high	98.4	Very high	30 Å²	30	39.5 Å²	39.5	16%	0.16	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.5	-176.8	-58.6	-40.6	0	0	0	111.1	L364 E365 L366 Y387 V415	L364-N385 PolarHBondContact O-N 3.35Å; E365-N385 HydrophobicContact CB-CB 4.25Å; E365-N385 HydrophobicContact CG-CB 3.95Å; E365-N385 PolarHBondContact OE2-ND2 2.98Å; L366-N385 PolarHBondContact N-O 3.14Å; N385-Y387 HydrophobicContact CB-CE2 4.08Å; N385-V415 WeakPolarHBondContact OD1-CB 3.23Å
386	L	98.9	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.1	177.4	-178.3	60	0	0	0	111.6	L366 V379 L383 L388 F401 L413 V415 L416 R417	L366-L386 HydrophobicContact CB-CD1 4.13Å; L366-L386 HydrophobicContact CD2-CD1 4.02Å; L366-L386 HydrophobicContact CG-CD1 4.08Å; V379-L386 HydrophobicContact CG1-CD2 4.29Å; L383-L386 HydrophobicContact CD2-CB 3.99Å; L383-L386 HydrophobicContact CD2-CD1 4.13Å; L383-L386 HydrophobicContact CD2-CD2 4.49Å; L383-L386 HydrophobicContact CD2-CG 4.43Å; L386-L388 HydrophobicContact CD1-CD1 4.28Å; L386-L388 HydrophobicContact CD1-CG 4.14Å; L386-L388 HydrophobicContact CD2-CD1 3.7Å; L386-L388 HydrophobicContact CD2-CG 4.4Å; L386-L388 HydrophobicContact CG-CD1 3.89Å; L386-L388 HydrophobicContact CG-CG 4.04Å; L386-F401 HydrophobicContact CD2-CE1 3.87Å; L386-L413 HydrophobicContact CB-CD1 3.83Å; L386-L413 HydrophobicContact CB-CD2 4.48Å; L386-V415 PolarHBondContact N-O 3.24Å; L386-L416 HydrophobicContact CB-CD1 4.12Å; L386-L416 HydrophobicContact CD2-CD1 3.95Å; L386-L416 HydrophobicContact CG-CD1 4.1Å; L386-L416 WeakPolarHBondContact O-CA 3.44Å; L386-R417 PolarHBondContact O-N 2.98Å
387	Y	98.9	Very high	98.2	Very high	56 Å²	56	35.6 Å²	35.6	22%	0.22	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117.6	178.6	-52.7	-77.1	0	0	0	110.4	E365 L366 D367 L368 S369 N385 V415 R417	E365-Y387 HydrophobicContact CG-CD2 4.46Å; E365-Y387 HydrophobicContact CG-CE2 3.86Å; L366-Y387 PolarHBondContact O-N 3.21Å; D367-Y387 HydrophobicContact CB-CD2 4.04Å; D367-Y387 WeakPolarHBondContact OD1-CB 3.19Å; L368-Y387 CarbonylContact C-O 3.44Å; L368-Y387 WeakPolarHBondContact CA-O 3.48Å; L368-Y387 PolarHBondContact N-O 2.81Å; S369-Y387 PolarHBondContact N-O 3.26Å; N385-Y387 HydrophobicContact CB-CE2 4.08Å; Y387-V415 HydrophobicContact CE1-CG1 4.2Å; Y387-R417 HydrophobicContact CD1-CB 4.11Å; Y387-R417 HydrophobicContact CD1-CG 4.06Å; Y387-R417 HydrophobicContact CE1-CG 4.43Å
388	L	98.9	Very high	98.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.			trans	-132.3	12.4	-177.6	-74.5	168.3	0	0	0	112	L368 L373 I376 L386 N391 I393 R417 L418 N421	L368-L388 HydrophobicContact CB-CD2 3.73Å; L368-L388 HydrophobicContact CD1-CD2 4.17Å; L373-L388 HydrophobicContact CD1-CD2 3.64Å; I376-L388 HydrophobicContact CG1-CD1 4.4Å; I376-L388 HydrophobicContact CG2-CD1 3.93Å; L386-L388 HydrophobicContact CD1-CD1 4.28Å; L386-L388 HydrophobicContact CD1-CG 4.14Å; L386-L388 HydrophobicContact CD2-CD1 3.7Å; L386-L388 HydrophobicContact CD2-CG 4.4Å; L386-L388 HydrophobicContact CG-CD1 3.89Å; L386-L388 HydrophobicContact CG-CG 4.04Å; L388-N391 PolarHBondContact O-ND2 3.4Å; L388-I393 HydrophobicContact CB-CD1 4.02Å; L388-I393 HydrophobicContact CD1-CD1 4.2Å; L388-I393 HydrophobicContact CD2-CD1 4.35Å; L388-I393 HydrophobicContact CG-CD1 4.44Å; L388-R417 CarbonylContact C-O 3.13Å; L388-R417 WeakPolarHBondContact CA-O 3.22Å; L388-R417 WeakPolarHBondContact CB-O 3.39Å; L388-R417 PolarHBondContact N-O 3.17Å; L388-L418 HydrophobicContact CB-CD2 3.77Å; L388-L418 HydrophobicContact CD1-CD2 3.91Å; L388-N421 PolarHBondContact O-ND2 3Å
389	Q	98.6	Very high	98	Very high	20 Å²	20	39.1 Å²	39.1	9%	0.093	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	149.3	-179.8	68.1	-81.6	9.9	0	0	112.7	S369 Y370 N391 R417 D419	S369-Q389 CarbonylContact C-O 3.55Å; S369-Q389 VanDerWaalsContact CA-O 3.23Å; S369-Q389 WeakPolarHBondContact CA-O 3.24Å; S369-Q389 VanDerWaalsContact CB-NE2 3.35Å; S369-Q389 WeakPolarHBondContact CB-O 3.3Å; Y370-Q389 HydrophobicContact CE2-CG 4.36Å; Y370-Q389 PolarHBondContact N-O 3.09Å; Q389-N391 VanDerWaalsContact C-N 3.31Å; Q389-N391 PolarHBondContact O-N 2.73Å; Q389-R417 PolarHBondContact N-O 3.27Å; Q389-D419 CarbonylContact C-O 3.54Å; Q389-D419 WeakPolarHBondContact CA-O 3.36Å; Q389-D419 WeakPolarHBondContact CB-O 3.39Å; Q389-D419 WeakPolarHBondContact CB-OD1 3.26Å
390	G	98.3	Very high	97.9	Very high	23 Å²	23	39 Å²	39	24%	0.237	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	25.4	177.6	0	0	0	0	0	115.1	D419	G390-D419 PolarHBondContact N-O 3.02Å
391	N	98.8	Very high	97.9	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	20%	0.197	C	C	.	.	S	Bend	trans	-93.4	-163.9	170.2	-84.4	-80.9	0	0	0	110.8	L368 N371 Q372 L373 L388 Q389 I393 N421	L368-N391 PolarHBondContact O-ND2 3.47Å; N371-N391 VanDerWaalsContact CA-OD1 3.26Å; N371-N391 WeakPolarHBondContact CA-OD1 3.44Å; N371-N391 WeakPolarHBondContact CB-OD1 3.09Å; N371-N391 PolarHBondContact N-OD1 2.65Å; N371-N391 PolarHBondContact O-OD1 2.96Å; Q372-N391 PolarHBondContact N-OD1 3.22Å; L373-N391 HydrophobicContact CB-CB 4.22Å; L373-N391 WeakPolarHBondContact CB-OD1 3.35Å; L373-N391 WeakPolarHBondContact CG-OD1 3.43Å; L373-N391 PolarHBondContact N-OD1 3.19Å; L388-N391 PolarHBondContact O-ND2 3.4Å; Q389-N391 VanDerWaalsContact C-N 3.31Å; Q389-N391 PolarHBondContact O-N 2.73Å; N391-I393 HydrophobicContact CB-CD1 4.18Å; N391-I393 HydrophobicContact CB-CG1 4.05Å; N391-N421 VanDerWaalsContact CA-OD1 3.24Å; N391-N421 WeakPolarHBondContact CA-OD1 3.45Å; N391-N421 WeakPolarHBondContact CB-OD1 3.44Å; N391-N421 PolarHBondContact N-OD1 3.08Å; N391-N421 PolarHBondContact O-OD1 2.96Å
392	R	98.6	Very high	97.8	Very high	143 Å²	143	35.6 Å²	35.6	54%	0.54	18%	0.184	S	C	.	.			trans	-116.8	29.8	177.4	-54.2	-60.1	-65.4	-110.3	-1.6	111.3	L373 Q374 N394 N421 E422	L373-R392 CarbonylContact O-C 3.03Å; L373-R392 VanDerWaalsContact O-CA 3.22Å; L373-R392 WeakPolarHBondContact O-CA 3.22Å; L373-R392 PolarHBondContact O-N 3.09Å; Q374-R392 WeakPolarHBondContact CA-O 3.38Å; Q374-R392 HydrophobicContact CG-CB 4.42Å; R392-N394 PolarHBondContact O-N 3.23Å; R392-N421 PolarHBondContact N-OD1 3.47Å; R392-E422 IonicContact CZ-OE1 3.16Å; R392-E422 IonicContact NE-OE1 2.72Å; R392-E422 PolarHBondContact NE-OE1 2.04Å; R392-E422 IonicContact NH2-OE1 2.76Å; R392-E422 PolarHBondContact NH2-OE1 3.17Å
393	I	98.6	Very high	97.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.			trans	-68.3	127.1	-174.7	-61.7	167.7	0	0	0	109.1	L373 Q374 I376 L388 N391 E395 L418 N421 E422 I423	L373-I393 HydrophobicContact CB-CG1 4.38Å; L373-I393 PolarHBondContact O-N 2.9Å; L373-I393 VanDerWaalsContact O-N 3.09Å; Q374-I393 WeakPolarHBondContact O-CA 3.19Å; I376-I393 HydrophobicContact CG1-CD1 4.25Å; I376-I393 HydrophobicContact CG1-CG2 4.14Å; L388-I393 HydrophobicContact CB-CD1 4.02Å; L388-I393 HydrophobicContact CD1-CD1 4.2Å; L388-I393 HydrophobicContact CD2-CD1 4.35Å; L388-I393 HydrophobicContact CG-CD1 4.44Å; N391-I393 HydrophobicContact CB-CD1 4.18Å; N391-I393 HydrophobicContact CB-CG1 4.05Å; I393-E395 VanDerWaalsContact CG2-O 3.3Å; I393-E395 WeakPolarHBondContact CG2-O 3.47Å; I393-L418 HydrophobicContact CD1-CD2 3.8Å; I393-N421 HydrophobicContact CB-CB 4.08Å; I393-N421 VanDerWaalsContact CB-OD1 3.27Å; I393-N421 WeakPolarHBondContact CB-OD1 3.45Å; I393-N421 WeakPolarHBondContact CG1-OD1 3.5Å; I393-N421 PolarHBondContact N-OD1 2.85Å; I393-E422 CarbonylContact O-C 3.27Å; I393-E422 VanDerWaalsContact O-C 3.27Å; I393-E422 VanDerWaalsContact O-CA 3.24Å; I393-E422 WeakPolarHBondContact O-CA 3.42Å; I393-E422 WeakPolarHBondContact O-CB 3.28Å; I393-E422 PolarHBondContact O-N 2.87Å; I393-I423 HydrophobicContact CG2-CD1 4.44Å
394	N	97.7	Very high	97.2	Very high	82 Å²	82	44.2 Å²	44.2	44%	0.439	24%	0.238	S	C	.	.			trans	-118.7	-0.5	-176.2	58	28.5	0	0	0	113.9	Q374 R392 E422 I423	Q374-N394 PolarHBondContact O-N 3.21Å; Q374-N394 PolarHBondContact O-OD1 3.47Å; R392-N394 PolarHBondContact O-N 3.23Å; N394-E422 HydrophobicContact CB-CB 4.13Å; N394-I423 WeakPolarHBondContact O-CG2 3.26Å
395	E	96.8	Very high	97	Very high	97 Å²	97	44.2 Å²	44.2	45%	0.453	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-141.2	138.7	179.1	-176	-178.8	-175.1	0	0	110.4	I393	I393-E395 VanDerWaalsContact CG2-O 3.3Å; I393-E395 WeakPolarHBondContact CG2-O 3.47Å
396	F	97.2	Very high	96.8	Very high	11 Å²	11	45.9 Å²	45.9	5%	0.048	25%	0.251	C	S	.	.			trans	-97.4	108.1	170	-170.2	-74	0	0	0	109.5	I376 I398 F401 L416 L418 A427 M428 A432 L436 I444	I376-F396 HydrophobicContact CD1-CD2 4.18Å; I376-F396 HydrophobicContact CD1-CE2 4.45Å; I376-F396 HydrophobicContact CD1-CG 4.44Å; F396-I398 HydrophobicContact CE1-CD1 4.11Å; F396-F401 HydrophobicContact CE1-CE2 4.31Å; F396-F401 HydrophobicContact CZ-CE2 4.05Å; F396-L416 HydrophobicContact CE2-CD2 4.11Å; F396-L416 HydrophobicContact CZ-CD2 4.33Å; F396-L418 HydrophobicContact CD2-CD1 3.72Å; F396-L418 HydrophobicContact CE2-CD1 3.59Å; F396-A427 HydrophobicContact CB-CB 4.43Å; F396-M428 HydrophobicContact CD1-CB 4.47Å; F396-M428 HydrophobicContact CD1-CG 4.18Å; F396-M428 HydrophobicContact CD2-CB 4.42Å; F396-M428 HydrophobicContact CD2-CG 4.48Å; F396-M428 HydrophobicContact CE1-CG 3.91Å; F396-M428 HydrophobicContact CE2-CG 4.2Å; F396-M428 HydrophobicContact CE2-SD 4.22Å; F396-M428 HydrophobicContact CG-CB 4.38Å; F396-M428 HydrophobicContact CG-CG 4.47Å; F396-M428 HydrophobicContact CZ-CG 3.92Å; F396-M428 HydrophobicContact CZ-SD 4.04Å; F396-A432 HydrophobicContact CE1-CB 4.46Å; F396-L436 HydrophobicContact CZ-CD1 3.92Å; F396-I444 HydrophobicContact CD2-CD1 4.32Å; F396-I444 HydrophobicContact CE2-CD1 4.36Å
397	S	95.8	Very high	96.4	Very high	21 Å²	21	51.9 Å²	51.9	15%	0.147	29%	0.287	C	S	.	.			trans	-108.8	109.2	-178	51.4	0	0	0	0	112	S399 S400	S397-S399 PolarHBondContact O-N 3.49Å; S397-S400 WeakPolarHBondContact O-CB 3.13Å; S397-S400 PolarHBondContact O-N 3.37Å; S397-S400 VanDerWaalsContact O-N 3.12Å; S397-S400 PolarHBondContact O-OG 3.48Å; S397-S400 PolarHBondContact OG-OG 3.33Å
398	I	95.9	Very high	96.2	Very high	44 Å²	44	54.5 Å²	54.5	23%	0.226	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-63.5	-27.2	179.9	-158.3	63.9	0	0	0	112.9	F396 S400 F401 C402 A432 C435 L436	F396-I398 HydrophobicContact CE1-CD1 4.11Å; I398-S400 PolarHBondContact O-N 3.15Å; I398-F401 HydrophobicContact CD1-CD2 4.35Å; I398-F401 PolarHBondContact O-N 2.81Å; I398-C402 PolarHBondContact O-N 3.19Å; I398-A432 HydrophobicContact CD1-CB 3.81Å; I398-C435 HydrophobicContact CD1-CB 3.82Å; I398-C435 HydrophobicContact CG1-CB 3.76Å; I398-L436 HydrophobicContact CD1-CD1 4.09Å; I398-L436 HydrophobicContact CD1-CG 4.08Å
399	S	95.8	Very high	96	Very high	82 Å²	82	58.2 Å²	58.2	57%	0.573	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.5	-16.4	176.9	54.3	0	0	0	0	113.9	S397 F401	S397-S399 PolarHBondContact O-N 3.49Å; S399-F401 PolarHBondContact O-N 3.25Å
400	S	97.2	Very high	95.9	Very high	9 Å²	9	60 Å²	60	6%	0.063	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-69.9	-20.6	172.3	-60.3	0	0	0	0	112.7	I376 P378 V379 S397 I398	I376-S400 PolarHBondContact O-OG 3.34Å; P378-S400 WeakPolarHBondContact CA-O 3.22Å; V379-S400 PolarHBondContact N-O 3.08Å; S397-S400 WeakPolarHBondContact O-CB 3.13Å; S397-S400 PolarHBondContact O-N 3.37Å; S397-S400 VanDerWaalsContact O-N 3.12Å; S397-S400 PolarHBondContact O-OG 3.48Å; S397-S400 PolarHBondContact OG-OG 3.33Å; I398-S400 PolarHBondContact O-N 3.15Å
401	F	97.6	Very high	95.9	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.018	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-39.3	-178.5	-54.6	-78.3	0	0	0	112.5	I376 V379 L386 F396 I398 S399 L413 L416 C435 L436	I376-F401 HydrophobicContact CD1-CE2 4.07Å; I376-F401 HydrophobicContact CD1-CZ 4.11Å; I376-F401 HydrophobicContact CG2-CE1 4.31Å; I376-F401 HydrophobicContact CG2-CE2 4.28Å; I376-F401 HydrophobicContact CG2-CZ 3.82Å; V379-F401 HydrophobicContact CG2-CD1 3.83Å; V379-F401 HydrophobicContact CG2-CE1 4.39Å; L386-F401 HydrophobicContact CD2-CE1 3.87Å; F396-F401 HydrophobicContact CE1-CE2 4.31Å; F396-F401 HydrophobicContact CZ-CE2 4.05Å; I398-F401 HydrophobicContact CD1-CD2 4.35Å; I398-F401 PolarHBondContact O-N 2.81Å; S399-F401 PolarHBondContact O-N 3.25Å; F401-L413 HydrophobicContact CD1-CD2 4.09Å; F401-L413 HydrophobicContact CE1-CD2 3.75Å; F401-L416 HydrophobicContact CE1-CD1 4.38Å; F401-L416 HydrophobicContact CE1-CD2 4.31Å; F401-L416 HydrophobicContact CE2-CD2 4.47Å; F401-L416 HydrophobicContact CZ-CD1 4.22Å; F401-L416 HydrophobicContact CZ-CD2 3.74Å; F401-C435 VanDerWaalsContact CB-SG 3.57Å; F401-L436 HydrophobicContact CB-CD2 4Å; F401-L436 HydrophobicContact CD1-CD2 4.03Å; F401-L436 HydrophobicContact CD2-CD1 4.38Å; F401-L436 HydrophobicContact CD2-CD2 4.2Å; F401-L436 HydrophobicContact CE2-CD1 4.37Å; F401-L436 HydrophobicContact CG-CD2 3.82Å
402	C	95.9	Very high	95.9	Very high	8 Å²	8	63.1 Å²	63.1	5%	0.054	34%	0.344	C	S	.	.			trans	-135.7	118.8	-178.6	-56.5	0	0	0	0	111	I398 V405 S411 C435	I398-C402 PolarHBondContact O-N 3.19Å; C402-V405 HydrophobicContact CB-CG2 3.48Å; C402-V405 VanDerWaalsContact CB-CG2 3.48Å; C402-S411 PolarHBondContact SG-N 3.09Å; C402-C435 HydrophobicContact CB-CB 3.87Å; C402-C435 WeakPolarHBondContact CB-SG 3.07Å; C402-C435 WeakPolarHBondContact SG-CB 3.47Å; C402-C435 CovalentContact SG-SG 2.04Å; C402-C435 PolarHBondContact SG-SG 3.43Å
403	T	92.7	Very high	95.9	Very high	139 Å²	139	56.3 Å²	56.3	85%	0.853	32%	0.318	S	S	*	.	S	Bend	trans	-73.8	-36.3	170.2	-48.3	0	0	0	0	111.7
404	V	91.8	Very high	95.8	Very high	94 Å²	94	60.2 Å²	60.2	57%	0.57	34%	0.336	S	S	*	.	S	Bend	trans	-134.4	140.2	177.4	-179.6	0	0	0	0	107.5
405	V	94.9	Very high	95.9	Very high	62 Å²	62	57.5 Å²	57.5	38%	0.376	32%	0.322	S	S	.	.			trans	-125.6	122.7	-179.6	-179.2	0	0	0	0	109.4	C402 N409 L434 C435	C402-V405 HydrophobicContact CB-CG2 3.48Å; C402-V405 VanDerWaalsContact CB-CG2 3.48Å; V405-N409 WeakPolarHBondContact CA-O 3.26Å; V405-L434 HydrophobicContact CG1-CB 4.03Å; V405-L434 WeakPolarHBondContact CG1-O 3.1Å; V405-C435 HydrophobicContact CG2-CB 3.89Å
406	D	93.5	Very high	96	Very high	64 Å²	64	52.9 Å²	52.9	34%	0.342	30%	0.301	S	S	.	.	S	Bend	trans	-147.9	-158	173.2	64.6	38.6	0	0	0	111.1	V408 N409 R437	D406-V408 VanDerWaalsContact C-N 3.32Å; D406-V408 WeakPolarHBondContact OD1-CA 3.41Å; D406-V408 WeakPolarHBondContact OD1-CG2 3.5Å; D406-V408 PolarHBondContact OD1-N 2.99Å; D406-N409 PolarHBondContact N-O 3.22Å; D406-N409 WeakPolarHBondContact OD1-CB 3.39Å; D406-N409 PolarHBondContact OD1-N 3.19Å; D406-N409 PolarHBondContact OD1-ND2 3.42Å; D406-N409 PolarHBondContact OD2-ND2 3.06Å; D406-R437 PolarHBondContact O-NH1 3.04Å; D406-R437 VanDerWaalsContact O-NH1 3.15Å; D406-R437 PolarHBondContact O-NH2 3.33Å
407	V	91.6	Very high	96	Very high	126 Å²	126	55.8 Å²	55.8	76%	0.764	31%	0.311	S	S	*	.	S	Bend	trans	-68.8	-30.2	-179.3	-175.9	0	0	0	0	112.1
408	V	93.9	Very high	96.2	Very high	112 Å²	112	54.8 Å²	54.8	68%	0.679	30%	0.304	S	S	*	.	S	Bend	trans	-110.1	-24.2	-176	-60.7	0	0	0	0	113.4	D406	D406-V408 VanDerWaalsContact C-N 3.32Å; D406-V408 WeakPolarHBondContact OD1-CA 3.41Å; D406-V408 WeakPolarHBondContact OD1-CG2 3.5Å; D406-V408 PolarHBondContact OD1-N 2.99Å
409	N	95.1	Very high	96.3	Very high	78 Å²	78	54.8 Å²	54.8	42%	0.417	31%	0.305	S	S	.	.			trans	-100.6	102.3	-179.3	-66	-52.2	0	0	0	109.8	V405 D406	V405-N409 WeakPolarHBondContact CA-O 3.26Å; D406-N409 PolarHBondContact N-O 3.22Å; D406-N409 WeakPolarHBondContact OD1-CB 3.39Å; D406-N409 PolarHBondContact OD1-N 3.19Å; D406-N409 PolarHBondContact OD1-ND2 3.42Å; D406-N409 PolarHBondContact OD2-ND2 3.06Å
410	F	96.6	Very high	96.3	Very high	57 Å²	57	53.7 Å²	53.7	25%	0.25	31%	0.307	C	S	.	.			trans	-155.6	167	174.7	57.7	-89.9	0	0	0	109.7	R437 L438	F410-R437 HydrophobicContact CB-CG 4.39Å; F410-R437 HydrophobicContact CD2-CG 4.43Å; F410-R437 HydrophobicContact CG-CG 4.44Å; F410-L438 HydrophobicContact CE2-CD1 3.9Å; F410-L438 HydrophobicContact CE2-CG 4.03Å
411	S	97.9	Very high	96.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.309	C	S	.	.			trans	-82.4	139.8	179.5	-179.6	0	0	0	0	111.1	C402 L413 C435	C402-S411 PolarHBondContact SG-N 3.09Å; S411-L413 PolarHBondContact O-N 3.26Å; S411-L413 WeakPolarHBondContact OG-CB 3.44Å; S411-L413 PolarHBondContact OG-N 3.3Å; S411-C435 PolarHBondContact N-O 3.47Å
412	K	97.9	Very high	96.4	Very high	93 Å²	93	58.8 Å²	58.8	40%	0.404	33%	0.33	S	S	.	.			trans	-85.5	7.6	175.4	-62	-177.8	-172.7	162.6	0	113.9	T381 N382 L383 Q414	T381-K412 VanDerWaalsContact O-CB 3.3Å; T381-K412 WeakPolarHBondContact O-CB 3.4Å; T381-K412 WeakPolarHBondContact O-CG 3.3Å; T381-K412 PolarHBondContact O-N 2.78Å; N382-K412 PolarHBondContact OD1-NZ 2.87Å; L383-K412 CarbonylContact O-C 3.42Å; K412-Q414 PolarHBondContact O-N 3.41Å
413	L	98.4	Very high	96.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.331	C	S	.	.			trans	-57.5	127.9	-178.1	-158.1	74.5	0	0	0	110.8	L383 E384 L386 F401 S411 L416 L436 L438 A439	L383-L413 HydrophobicContact CB-CD1 4.44Å; L383-L413 HydrophobicContact CD2-CD1 4.23Å; L383-L413 HydrophobicContact CG-CD1 4.21Å; L383-L413 VanDerWaalsContact O-CA 3.26Å; L383-L413 WeakPolarHBondContact O-CA 3.2Å; L383-L413 PolarHBondContact O-N 3.33Å; L383-L413 VanDerWaalsContact O-N 3.15Å; E384-L413 WeakPolarHBondContact O-CD1 3.44Å; L386-L413 HydrophobicContact CB-CD1 3.83Å; L386-L413 HydrophobicContact CB-CD2 4.48Å; F401-L413 HydrophobicContact CD1-CD2 4.09Å; F401-L413 HydrophobicContact CE1-CD2 3.75Å; S411-L413 PolarHBondContact O-N 3.26Å; S411-L413 WeakPolarHBondContact OG-CB 3.44Å; S411-L413 PolarHBondContact OG-N 3.3Å; L413-L416 HydrophobicContact CD2-CB 3.81Å; L413-L416 HydrophobicContact CD2-CD1 4.19Å; L413-L416 HydrophobicContact CD2-CD2 4.21Å; L413-L416 HydrophobicContact CD2-CG 4.29Å; L413-L436 HydrophobicContact CB-CD2 4.26Å; L413-L436 HydrophobicContact CD2-CD2 4.13Å; L413-L438 CarbonylContact O-C 3.57Å; L413-A439 WeakPolarHBondContact O-CA 3.39Å; L413-A439 PolarHBondContact O-N 2.84Å
414	Q	98.2	Very high	96.6	Very high	82 Å²	82	60.1 Å²	60.1	38%	0.383	32%	0.324	S	S	.	.			trans	-104.7	-39.8	179.4	-61.3	-179	29.6	0	0	111.2	E384 K412 A439 S440 L441	E384-Q414 PolarHBondContact O-N 3.5Å; E384-Q414 PolarHBondContact OE2-NE2 2.99Å; K412-Q414 PolarHBondContact O-N 3.41Å; Q414-A439 CarbonylContact O-C 3.14Å; Q414-A439 WeakPolarHBondContact O-CA 3.34Å; Q414-S440 PolarHBondContact O-N 3.15Å; Q414-S440 PolarHBondContact O-OG 2.77Å; Q414-L441 PolarHBondContact O-N 3.06Å; Q414-L441 VanDerWaalsContact O-N 3.16Å
415	V	98.6	Very high	96.6	Very high	25 Å²	25	63 Å²	63	15%	0.152	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.8	-178.4	-179.6	0	0	0	0	110.2	E384 N385 L386 Y387 L441	E384-V415 PolarHBondContact O-N 3.14Å; E384-V415 VanDerWaalsContact O-N 3.12Å; N385-V415 WeakPolarHBondContact OD1-CB 3.23Å; L386-V415 PolarHBondContact N-O 3.24Å; Y387-V415 HydrophobicContact CE1-CG1 4.2Å; V415-L441 HydrophobicContact CG1-CB 4.46Å; V415-L441 HydrophobicContact CG1-CD2 4.14Å; V415-L441 HydrophobicContact CG2-CB 4.45Å
416	L	98.6	Very high	96.6	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	116.8	173.8	178.9	57.1	0	0	0	110.2	L386 F396 F401 L413 L418 L436 L441 I442 E443	L386-L416 HydrophobicContact CB-CD1 4.12Å; L386-L416 HydrophobicContact CD2-CD1 3.95Å; L386-L416 HydrophobicContact CG-CD1 4.1Å; L386-L416 WeakPolarHBondContact O-CA 3.44Å; F396-L416 HydrophobicContact CE2-CD2 4.11Å; F396-L416 HydrophobicContact CZ-CD2 4.33Å; F401-L416 HydrophobicContact CE1-CD1 4.38Å; F401-L416 HydrophobicContact CE1-CD2 4.31Å; F401-L416 HydrophobicContact CE2-CD2 4.47Å; F401-L416 HydrophobicContact CZ-CD1 4.22Å; F401-L416 HydrophobicContact CZ-CD2 3.74Å; L413-L416 HydrophobicContact CD2-CB 3.81Å; L413-L416 HydrophobicContact CD2-CD1 4.19Å; L413-L416 HydrophobicContact CD2-CD2 4.21Å; L413-L416 HydrophobicContact CD2-CG 4.29Å; L416-L418 HydrophobicContact CD1-CD1 4.19Å; L416-L418 HydrophobicContact CD1-CG 4.03Å; L416-L418 HydrophobicContact CD2-CD1 3.82Å; L416-L418 HydrophobicContact CD2-CG 4.5Å; L416-L418 HydrophobicContact CG-CD1 3.95Å; L416-L418 HydrophobicContact CG-CG 4.1Å; L416-L436 HydrophobicContact CD2-CD1 4.37Å; L416-L441 PolarHBondContact N-O 2.9Å; L416-I442 HydrophobicContact CB-CG1 4.32Å; L416-I442 HydrophobicContact CB-CG2 4.45Å; L416-I442 HydrophobicContact CD2-CG2 4.19Å; L416-I442 HydrophobicContact CG-CG2 4.44Å; L416-I442 WeakPolarHBondContact O-CA 3.49Å; L416-E443 PolarHBondContact O-N 3.1Å
417	R	98.6	Very high	96.7	Very high	72 Å²	72	64.2 Å²	64.2	27%	0.272	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118.9	172.4	-72	-161.6	60.1	-179.1	0.5	111.6	L386 Y387 L388 Q389 D419 E443	L386-R417 PolarHBondContact O-N 2.98Å; Y387-R417 HydrophobicContact CD1-CB 4.11Å; Y387-R417 HydrophobicContact CD1-CG 4.06Å; Y387-R417 HydrophobicContact CE1-CG 4.43Å; L388-R417 CarbonylContact C-O 3.13Å; L388-R417 WeakPolarHBondContact CA-O 3.22Å; L388-R417 WeakPolarHBondContact CB-O 3.39Å; L388-R417 PolarHBondContact N-O 3.17Å; Q389-R417 PolarHBondContact N-O 3.27Å; R417-D419 IonicContact CZ-OD1 3.41Å; R417-D419 IonicContact CZ-OD2 3.78Å; R417-D419 IonicContact NE-OD1 2.92Å; R417-D419 PolarHBondContact NE-OD1 2.97Å; R417-D419 IonicContact NH2-OD1 3.06Å; R417-D419 PolarHBondContact NH2-OD1 2.7Å; R417-D419 IonicContact NH2-OD2 2.71Å; R417-D419 PolarHBondContact NH2-OD2 2.87Å; R417-E443 HydrophobicContact CG-CB 4.43Å; R417-E443 IonicContact CZ-OE2 3.98Å; R417-E443 IonicContact NE-OE2 3.16Å; R417-E443 PolarHBondContact NE-OE2 2.77Å; R417-E443 IonicContact NH2-OE2 3.93Å
418	L	98.5	Very high	96.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.317	C	S	.	.			trans	-127.8	7.4	178.6	-74.7	166.8	0	0	0	111.9	I376 L388 I393 F396 L416 N421 I423 E443 I444	I376-L418 HydrophobicContact CD1-CD1 4.13Å; I376-L418 HydrophobicContact CD1-CD2 4.22Å; I376-L418 HydrophobicContact CG1-CD2 4.19Å; L388-L418 HydrophobicContact CB-CD2 3.77Å; L388-L418 HydrophobicContact CD1-CD2 3.91Å; I393-L418 HydrophobicContact CD1-CD2 3.8Å; F396-L418 HydrophobicContact CD2-CD1 3.72Å; F396-L418 HydrophobicContact CE2-CD1 3.59Å; L416-L418 HydrophobicContact CD1-CD1 4.19Å; L416-L418 HydrophobicContact CD1-CG 4.03Å; L416-L418 HydrophobicContact CD2-CD1 3.82Å; L416-L418 HydrophobicContact CD2-CG 4.5Å; L416-L418 HydrophobicContact CG-CD1 3.95Å; L416-L418 HydrophobicContact CG-CG 4.1Å; L418-N421 WeakPolarHBondContact O-CB 3.35Å; L418-N421 PolarHBondContact O-ND2 3.41Å; L418-I423 HydrophobicContact CB-CD1 4.16Å; L418-I423 HydrophobicContact CD1-CD1 4.16Å; L418-E443 CarbonylContact C-O 3.11Å; L418-E443 WeakPolarHBondContact CA-O 3.38Å; L418-E443 WeakPolarHBondContact CB-O 3.41Å; L418-E443 PolarHBondContact N-O 2.74Å; L418-I444 HydrophobicContact CB-CG1 4.27Å; L418-I444 HydrophobicContact CD1-CG1 4.39Å
419	D	97.9	Very high	96.9	Very high	43 Å²	43	57 Å²	57	23%	0.23	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	150.8	-179.9	60.4	-67.8	0	0	0	112.5	Q389 G390 R417 N421 E443 I444	Q389-D419 CarbonylContact C-O 3.54Å; Q389-D419 WeakPolarHBondContact CA-O 3.36Å; Q389-D419 WeakPolarHBondContact CB-O 3.39Å; Q389-D419 WeakPolarHBondContact CB-OD1 3.26Å; G390-D419 PolarHBondContact N-O 3.02Å; R417-D419 IonicContact CZ-OD1 3.41Å; R417-D419 IonicContact CZ-OD2 3.78Å; R417-D419 IonicContact NE-OD1 2.92Å; R417-D419 PolarHBondContact NE-OD1 2.97Å; R417-D419 IonicContact NH2-OD1 3.06Å; R417-D419 PolarHBondContact NH2-OD1 2.7Å; R417-D419 IonicContact NH2-OD2 2.71Å; R417-D419 PolarHBondContact NH2-OD2 2.87Å; D419-N421 VanDerWaalsContact C-N 3.28Å; D419-N421 PolarHBondContact O-N 3.22Å; D419-E443 HydrophobicContact CB-CB 4.44Å; D419-E443 PolarHBondContact N-O 3.39Å; D419-I444 WeakPolarHBondContact CA-OXT 3.2Å
420	G	97.6	Very high	96.8	Very high	60 Å²	60	58.3 Å²	58.3	62%	0.619	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	22.6	-176.5	0	0	0	0	0	114.5
421	N	98.6	Very high	96.6	Very high	21 Å²	21	60.1 Å²	60.1	11%	0.112	33%	0.332	C	S	.	.	S	Bend	trans	-100.9	-179.7	169	-79.4	-81.1	0	0	0	112	L388 N391 R392 I393 L418 D419 I423	L388-N421 PolarHBondContact O-ND2 3Å; N391-N421 VanDerWaalsContact CA-OD1 3.24Å; N391-N421 WeakPolarHBondContact CA-OD1 3.45Å; N391-N421 WeakPolarHBondContact CB-OD1 3.44Å; N391-N421 PolarHBondContact N-OD1 3.08Å; N391-N421 PolarHBondContact O-OD1 2.96Å; R392-N421 PolarHBondContact N-OD1 3.47Å; I393-N421 HydrophobicContact CB-CB 4.08Å; I393-N421 VanDerWaalsContact CB-OD1 3.27Å; I393-N421 WeakPolarHBondContact CB-OD1 3.45Å; I393-N421 WeakPolarHBondContact CG1-OD1 3.5Å; I393-N421 PolarHBondContact N-OD1 2.85Å; L418-N421 WeakPolarHBondContact O-CB 3.35Å; L418-N421 PolarHBondContact O-ND2 3.41Å; D419-N421 VanDerWaalsContact C-N 3.28Å; D419-N421 PolarHBondContact O-N 3.22Å; N421-I423 HydrophobicContact CB-CG1 3.95Å; N421-I423 PolarHBondContact O-N 2.96Å
422	E	97.9	Very high	96.4	Very high	99 Å²	99	60.1 Å²	60.1	46%	0.463	33%	0.332	S	S	.	.	S	Bend	trans	-88.8	31	178.4	-57.8	-178.6	-176.7	0	0	112.4	R392 I393 N394	R392-E422 IonicContact CZ-OE1 3.16Å; R392-E422 IonicContact NE-OE1 2.72Å; R392-E422 PolarHBondContact NE-OE1 2.04Å; R392-E422 IonicContact NH2-OE1 2.76Å; R392-E422 PolarHBondContact NH2-OE1 3.17Å; I393-E422 CarbonylContact O-C 3.27Å; I393-E422 VanDerWaalsContact O-C 3.27Å; I393-E422 VanDerWaalsContact O-CA 3.24Å; I393-E422 WeakPolarHBondContact O-CA 3.42Å; I393-E422 WeakPolarHBondContact O-CB 3.28Å; I393-E422 PolarHBondContact O-N 2.87Å; N394-E422 HydrophobicContact CB-CB 4.13Å
423	I	96.9	Very high	96.2	Very high	15 Å²	15	59.3 Å²	59.3	8%	0.077	34%	0.337	C	S	.	.			trans	-122.3	159.5	177.7	51.4	170.4	0	0	0	111.5	I393 N394 L418 N421 A427 I444	I393-I423 HydrophobicContact CG2-CD1 4.44Å; N394-I423 WeakPolarHBondContact O-CG2 3.26Å; L418-I423 HydrophobicContact CB-CD1 4.16Å; L418-I423 HydrophobicContact CD1-CD1 4.16Å; N421-I423 HydrophobicContact CB-CG1 3.95Å; N421-I423 PolarHBondContact O-N 2.96Å; I423-A427 HydrophobicContact CB-CB 4.42Å; I423-I444 HydrophobicContact CB-CG2 4.49Å; I423-I444 HydrophobicContact CD1-CG2 3.85Å; I423-I444 HydrophobicContact CG1-CG2 3.84Å
424	K	94.9	Very high	96.1	Very high	160 Å²	160	64 Å²	64	70%	0.696	36%	0.361	S	S	*	.			trans	-116.5	160.3	171.7	-64.7	-178.2	-179.8	178.9	0	109	S426 A427	K424-S426 PolarHBondContact O-N 3.04Å; K424-A427 WeakPolarHBondContact O-CB 3.29Å; K424-A427 PolarHBondContact O-N 3.02Å
425	R	93.4	Very high	96.1	Very high	154 Å²	154	60.1 Å²	60.1	58%	0.581	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-53.2	-31.6	175.9	-164.5	173.3	-170.6	91.6	1.2	113.9	A427 M428 I442	R425-A427 PolarHBondContact O-N 2.95Å; R425-M428 PolarHBondContact O-N 3.23Å; R425-I442 PolarHBondContact NH1-O 2.95Å; R425-I442 VanDerWaalsContact NH1-O 3.12Å
426	S	94	Very high	96	Very high	107 Å²	107	59.3 Å²	59.3	75%	0.748	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-68.3	-12.9	176.3	61	0	0	0	0	114.6	K424 M428	K424-S426 PolarHBondContact O-N 3.04Å; S426-M428 VanDerWaalsContact C-N 3.26Å
427	A	95.3	Very high	95.8	Very high	44 Å²	44	64 Å²	64	36%	0.364	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-74.6	-20.1	175.4	0	0	0	0	0	112.1	F396 I423 K424 R425 P429	F396-A427 HydrophobicContact CB-CB 4.43Å; I423-A427 HydrophobicContact CB-CB 4.42Å; K424-A427 WeakPolarHBondContact O-CB 3.29Å; K424-A427 PolarHBondContact O-N 3.02Å; R425-A427 PolarHBondContact O-N 2.95Å; A427-P429 WeakPolarHBondContact O-CD 3.18Å
428	M	95.9	Very high	95.7	Very high	44 Å²	44	65 Å²	65	22%	0.217	37%	0.365	C	S	.	.	S	Bend	trans	-73.2	123.4	176	-172	171.3	75.1	0	0	109.8	F396 R425 S426 A432 I442 I444	F396-M428 HydrophobicContact CD1-CB 4.47Å; F396-M428 HydrophobicContact CD1-CG 4.18Å; F396-M428 HydrophobicContact CD2-CB 4.42Å; F396-M428 HydrophobicContact CD2-CG 4.48Å; F396-M428 HydrophobicContact CE1-CG 3.91Å; F396-M428 HydrophobicContact CE2-CG 4.2Å; F396-M428 HydrophobicContact CE2-SD 4.22Å; F396-M428 HydrophobicContact CG-CB 4.38Å; F396-M428 HydrophobicContact CG-CG 4.47Å; F396-M428 HydrophobicContact CZ-CG 3.92Å; F396-M428 HydrophobicContact CZ-SD 4.04Å; R425-M428 PolarHBondContact O-N 3.23Å; S426-M428 VanDerWaalsContact C-N 3.26Å; M428-A432 HydrophobicContact CG-CB 3.64Å; M428-A432 HydrophobicContact SD-CB 4.19Å; M428-I442 HydrophobicContact SD-CD1 4.19Å; M428-I442 HydrophobicContact SD-CG2 4.37Å; M428-I444 HydrophobicContact CB-CD1 4.18Å; M428-I444 HydrophobicContact SD-CD1 4.28Å
429	P	94.3	Very high	95.6	Very high	44 Å²	44	66.2 Å²	66.2	29%	0.286	38%	0.376	S	S	.	.			trans	-59.7	148.4	177.3	-26	36.2	0	0	0	112.7	A427 D431 A432	A427-P429 WeakPolarHBondContact O-CD 3.18Å; P429-D431 WeakPolarHBondContact CB-OD1 3.25Å; P429-D431 PolarHBondContact O-N 3.43Å; P429-A432 WeakPolarHBondContact O-CB 3.2Å; P429-A432 PolarHBondContact O-N 3.19Å; P429-A432 VanDerWaalsContact O-N 3.08Å
430	A	92.6	Very high	95.4	Very high	105 Å²	105	69 Å²	69	87%	0.868	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23	-179.8	0	0	0	0	0	113.3	P433	A430-P433 WeakPolarHBondContact O-CD 2.99Å
431	D	91.9	Very high	95.3	Very high	94 Å²	94	69.5 Å²	69.5	50%	0.503	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.1	177.4	64.1	-26.7	0	0	0	113.5	P429 P433 L434	P429-D431 WeakPolarHBondContact CB-OD1 3.25Å; P429-D431 PolarHBondContact O-N 3.43Å; D431-P433 VanDerWaalsContact C-N 3.26Å; D431-L434 HydrophobicContact CB-CD1 4.07Å; D431-L434 VanDerWaalsContact O-CB 3.25Å; D431-L434 WeakPolarHBondContact O-CB 3.46Å; D431-L434 WeakPolarHBondContact O-CG 3.04Å; D431-L434 PolarHBondContact O-N 3.12Å
432	A	94.5	Very high	95.1	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.008	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-51.5	-37.1	174.6	0	0	0	0	0	114.1	F396 I398 M428 P429 L434 C435 L436	F396-A432 HydrophobicContact CE1-CB 4.46Å; I398-A432 HydrophobicContact CD1-CB 3.81Å; M428-A432 HydrophobicContact CG-CB 3.64Å; M428-A432 HydrophobicContact SD-CB 4.19Å; P429-A432 WeakPolarHBondContact O-CB 3.2Å; P429-A432 PolarHBondContact O-N 3.19Å; P429-A432 VanDerWaalsContact O-N 3.08Å; A432-L434 PolarHBondContact O-N 3.43Å; A432-L434 VanDerWaalsContact O-N 3.08Å; A432-C435 PolarHBondContact O-N 2.94Å; A432-L436 PolarHBondContact O-N 2.84Å
433	P	94.6	Very high	94.9	Very high	76 Å²	76	68.6 Å²	68.6	49%	0.494	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-61.7	-12.3	173.9	-24.5	36	0	0	0	114.8	A430 D431 R437	A430-P433 WeakPolarHBondContact O-CD 2.99Å; D431-P433 VanDerWaalsContact C-N 3.26Å; P433-R437 WeakPolarHBondContact O-CA 3.41Å; P433-R437 WeakPolarHBondContact O-CB 3.33Å; P433-R437 WeakPolarHBondContact O-CG 3.39Å; P433-R437 PolarHBondContact O-N 3.21Å
434	L	95.4	Very high	94.6	Very high	98 Å²	98	70.1 Å²	70.1	51%	0.513	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-72.5	-28.8	171.1	-63.7	177.8	0	0	0	112.1	V405 D431 A432 R437	V405-L434 HydrophobicContact CG1-CB 4.03Å; V405-L434 WeakPolarHBondContact CG1-O 3.1Å; D431-L434 HydrophobicContact CB-CD1 4.07Å; D431-L434 VanDerWaalsContact O-CB 3.25Å; D431-L434 WeakPolarHBondContact O-CB 3.46Å; D431-L434 WeakPolarHBondContact O-CG 3.04Å; D431-L434 PolarHBondContact O-N 3.12Å; A432-L434 PolarHBondContact O-N 3.43Å; A432-L434 VanDerWaalsContact O-N 3.08Å; L434-R437 PolarHBondContact O-NE 3.22Å; L434-R437 PolarHBondContact O-NH2 2.88Å
435	C	97.5	Very high	94.6	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.007	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-42.6	174.4	166.3	0	0	0	0	111.3	I398 F401 C402 V405 S411 A432 R437	I398-C435 HydrophobicContact CD1-CB 3.82Å; I398-C435 HydrophobicContact CG1-CB 3.76Å; F401-C435 VanDerWaalsContact CB-SG 3.57Å; C402-C435 HydrophobicContact CB-CB 3.87Å; C402-C435 WeakPolarHBondContact CB-SG 3.07Å; C402-C435 WeakPolarHBondContact SG-CB 3.47Å; C402-C435 CovalentContact SG-SG 2.04Å; C402-C435 PolarHBondContact SG-SG 3.43Å; V405-C435 HydrophobicContact CG2-CB 3.89Å; S411-C435 PolarHBondContact N-O 3.47Å; A432-C435 PolarHBondContact O-N 2.94Å; C435-R437 PolarHBondContact O-N 3.14Å
436	L	97.1	Very high	94.7	Very high	7 Å²	7	60.9 Å²	60.9	4%	0.037	36%	0.364	C	S	.	.	S	Bend	trans	-97.6	44.1	-174.6	-59.6	176.3	0	0	0	112	F396 I398 F401 L413 L416 A432 L438 A439 I442	F396-L436 HydrophobicContact CZ-CD1 3.92Å; I398-L436 HydrophobicContact CD1-CD1 4.09Å; I398-L436 HydrophobicContact CD1-CG 4.08Å; F401-L436 HydrophobicContact CB-CD2 4Å; F401-L436 HydrophobicContact CD1-CD2 4.03Å; F401-L436 HydrophobicContact CD2-CD1 4.38Å; F401-L436 HydrophobicContact CD2-CD2 4.2Å; F401-L436 HydrophobicContact CE2-CD1 4.37Å; F401-L436 HydrophobicContact CG-CD2 3.82Å; L413-L436 HydrophobicContact CB-CD2 4.26Å; L413-L436 HydrophobicContact CD2-CD2 4.13Å; L416-L436 HydrophobicContact CD2-CD1 4.37Å; A432-L436 PolarHBondContact O-N 2.84Å; L436-L438 PolarHBondContact O-N 2.99Å; L436-A439 HydrophobicContact CB-CB 4.17Å; L436-A439 WeakPolarHBondContact O-CB 3.4Å; L436-A439 PolarHBondContact O-N 2.78Å; L436-I442 HydrophobicContact CD1-CD1 4.24Å
437	R	95.3	Very high	94.7	Very high	100 Å²	100	58.4 Å²	58.4	38%	0.377	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.1	-170	-25.3	-156.8	164.6	130.5	9.7	113.7	D406 F410 P433 L434 C435	D406-R437 PolarHBondContact O-NH1 3.04Å; D406-R437 VanDerWaalsContact O-NH1 3.15Å; D406-R437 PolarHBondContact O-NH2 3.33Å; F410-R437 HydrophobicContact CB-CG 4.39Å; F410-R437 HydrophobicContact CD2-CG 4.43Å; F410-R437 HydrophobicContact CG-CG 4.44Å; P433-R437 WeakPolarHBondContact O-CA 3.41Å; P433-R437 WeakPolarHBondContact O-CB 3.33Å; P433-R437 WeakPolarHBondContact O-CG 3.39Å; P433-R437 PolarHBondContact O-N 3.21Å; L434-R437 PolarHBondContact O-NE 3.22Å; L434-R437 PolarHBondContact O-NH2 2.88Å; C435-R437 PolarHBondContact O-N 3.14Å
438	L	95.9	Very high	94.7	Very high	91 Å²	91	59.2 Å²	59.2	48%	0.476	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-1.8	-178.3	-60	-170.5	0	0	0	113.1	F410 L413 L436 S440	F410-L438 HydrophobicContact CE2-CD1 3.9Å; F410-L438 HydrophobicContact CE2-CG 4.03Å; L413-L438 CarbonylContact O-C 3.57Å; L436-L438 PolarHBondContact O-N 2.99Å; L438-S440 PolarHBondContact O-N 2.94Å; L438-S440 VanDerWaalsContact O-N 3.13Å
439	A	95.4	Very high	94.6	Very high	26 Å²	26	60.2 Å²	60.2	22%	0.215	35%	0.349	C	S	.	.			trans	-70.2	111.9	-178.1	0	0	0	0	0	110.2	L413 Q414 L436 I442	L413-A439 WeakPolarHBondContact O-CA 3.39Å; L413-A439 PolarHBondContact O-N 2.84Å; Q414-A439 CarbonylContact O-C 3.14Å; Q414-A439 WeakPolarHBondContact O-CA 3.34Å; L436-A439 HydrophobicContact CB-CB 4.17Å; L436-A439 WeakPolarHBondContact O-CB 3.4Å; L436-A439 PolarHBondContact O-N 2.78Å; A439-I442 HydrophobicContact CB-CD1 3.79Å; A439-I442 HydrophobicContact CB-CG1 3.83Å
440	S	94.1	Very high	94.6	Very high	102 Å²	102	61.3 Å²	61.3	71%	0.713	35%	0.354	S	S	*	.	S	Bend	trans	-85.1	-29.4	176.4	67.4	0	0	0	0	112	Q414 L438	Q414-S440 PolarHBondContact O-N 3.15Å; Q414-S440 PolarHBondContact O-OG 2.77Å; L438-S440 PolarHBondContact O-N 2.94Å; L438-S440 VanDerWaalsContact O-N 3.13Å
441	L	95.1	Very high	94.7	Very high	71 Å²	71	58.1 Å²	58.1	37%	0.372	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	119.6	-179.3	-176.7	62.4	0	0	0	110.4	Q414 V415 L416 E443	Q414-L441 PolarHBondContact O-N 3.06Å; Q414-L441 VanDerWaalsContact O-N 3.16Å; V415-L441 HydrophobicContact CG1-CB 4.46Å; V415-L441 HydrophobicContact CG1-CD2 4.14Å; V415-L441 HydrophobicContact CG2-CB 4.45Å; L416-L441 PolarHBondContact N-O 2.9Å; L441-E443 HydrophobicContact CD1-CG 3.8Å; L441-E443 HydrophobicContact CD2-CG 4.48Å; L441-E443 HydrophobicContact CG-CG 4.06Å
442	I	94.8	Very high	95	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	105.3	169.6	-53.9	179.8	0	0	0	108.5	L416 R425 M428 L436 A439 I444	L416-I442 HydrophobicContact CB-CG1 4.32Å; L416-I442 HydrophobicContact CB-CG2 4.45Å; L416-I442 HydrophobicContact CD2-CG2 4.19Å; L416-I442 HydrophobicContact CG-CG2 4.44Å; L416-I442 WeakPolarHBondContact O-CA 3.49Å; R425-I442 PolarHBondContact NH1-O 2.95Å; R425-I442 VanDerWaalsContact NH1-O 3.12Å; M428-I442 HydrophobicContact SD-CD1 4.19Å; M428-I442 HydrophobicContact SD-CG2 4.37Å; L436-I442 HydrophobicContact CD1-CD1 4.24Å; A439-I442 HydrophobicContact CB-CD1 3.79Å; A439-I442 HydrophobicContact CB-CG1 3.83Å; I442-I444 HydrophobicContact CG2-CD1 4.05Å; I442-I444 HydrophobicContact CG2-CG1 3.99Å
443	E	94.1	Very high	95	Very high	72 Å²	72	59.9 Å²	59.9	34%	0.336	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.9	175.9	-62.6	-172	166.2	0	0	109.4	L416 R417 L418 D419 L441	L416-E443 PolarHBondContact O-N 3.1Å; R417-E443 HydrophobicContact CG-CB 4.43Å; R417-E443 IonicContact CZ-OE2 3.98Å; R417-E443 IonicContact NE-OE2 3.16Å; R417-E443 PolarHBondContact NE-OE2 2.77Å; R417-E443 IonicContact NH2-OE2 3.93Å; L418-E443 CarbonylContact C-O 3.11Å; L418-E443 WeakPolarHBondContact CA-O 3.38Å; L418-E443 WeakPolarHBondContact CB-O 3.41Å; L418-E443 PolarHBondContact N-O 2.74Å; D419-E443 HydrophobicContact CB-CB 4.44Å; D419-E443 PolarHBondContact N-O 3.39Å; L441-E443 HydrophobicContact CD1-CG 3.8Å; L441-E443 HydrophobicContact CD2-CG 4.48Å; L441-E443 HydrophobicContact CG-CG 4.06Å
444	I	90.8	Very high	95	Very high	46 Å²	46	58.5 Å²	58.5	24%	0.236	31%	0.312	C	S	.	.			trans	-132.5	0	-179.9	-57.9	174.8	0	0	0	108.8	F396 L418 D419 I423 M428 I442	F396-I444 HydrophobicContact CD2-CD1 4.32Å; F396-I444 HydrophobicContact CE2-CD1 4.36Å; L418-I444 HydrophobicContact CB-CG1 4.27Å; L418-I444 HydrophobicContact CD1-CG1 4.39Å; D419-I444 WeakPolarHBondContact CA-OXT 3.2Å; I423-I444 HydrophobicContact CB-CG2 4.49Å; I423-I444 HydrophobicContact CD1-CG2 3.85Å; I423-I444 HydrophobicContact CG1-CG2 3.84Å; M428-I444 HydrophobicContact CB-CD1 4.18Å; M428-I444 HydrophobicContact SD-CD1 4.28Å; I442-I444 HydrophobicContact CG2-CD1 4.05Å; I442-I444 HydrophobicContact CG2-CG1 3.99Å

Retrieved 444 of 444 residues in 141.7 ms (Link to these results)

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