G4LVC7_SCHMA Loading...

RNA helicase

AlphaFold DB , UniProt , Accession G4LVC7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 637 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	37.6	Very low	37.8	Very low	247 Å²	247	167.9 Å²	167.9	100%	1.217	84%	0.843	S	S	*	*				0	132.9	0	-72.3	173.3	172.7	0	0	106.6
2	S	31.8	Very low	37.6	Very low	100 Å²	100	166.6 Å²	166.6	70%	0.699	84%	0.84	S	S	*	*			trans	-150.2	130.9	-159.6	43.4	0	0	0	0	109.6
3	Y	48.5	Very low	37.8	Very low	213 Å²	213	168 Å²	168	84%	0.835	84%	0.842	S	S	*	*			trans	-145.1	89.8	171.3	-79.5	-70.2	0	0	0	108.6	Y5	Y3-Y5 HydrophobicContact CD1-CE2 4.47Å
4	D	35.4	Very low	37.8	Very low	157 Å²	157	171.1 Å²	171.1	84%	0.84	85%	0.848	S	S	*	*			trans	-80.5	142.2	153.5	-66.3	-63.8	0	0	0	107.9
5	Y	47.4	Very low	37.7	Very low	219 Å²	219	167.7 Å²	167.7	86%	0.859	84%	0.843	S	S	*	*			trans	-135.8	128.4	167.1	-109	-83.3	0	0	0	108.4	Y3	Y3-Y5 HydrophobicContact CD1-CE2 4.47Å
6	N	34.8	Very low	37.4	Very low	147 Å²	147	163.4 Å²	163.4	79%	0.786	83%	0.834	S	S	*	*			trans	-155.8	108.3	-171.4	179.1	34.3	0	0	0	108.6
7	E	36.6	Very low	37.2	Very low	178 Å²	178	165.2 Å²	165.2	83%	0.832	84%	0.841	S	S	*	*			trans	-175.5	119.1	154.1	-110.1	169.8	-176.9	0	0	113
8	N	36.2	Very low	36.9	Very low	131 Å²	131	162.3 Å²	162.3	70%	0.701	83%	0.833	S	S	*	*			trans	21	159.2	134.3	-58.4	-37	0	0	0	123.9
9	N	34.8	Very low	36.7	Very low	157 Å²	157	160.9 Å²	160.9	84%	0.84	83%	0.826	S	S	*	*			trans	86.6	110.2	158.8	-57.2	-28	0	0	0	118.8
10	L	35.8	Very low	36.6	Very low	175 Å²	175	162.9 Å²	162.9	92%	0.916	83%	0.831	S	S	*	*			trans	-159.7	111.3	137.9	-114.5	168	0	0	0	109.7
11	V	36.2	Very low	36.3	Very low	123 Å²	123	159.7 Å²	159.7	75%	0.745	82%	0.823	S	S	*	*			trans	-144.4	147.8	175.6	-176.2	0	0	0	0	107.2
12	D	35.8	Very low	36.2	Very low	152 Å²	152	156.4 Å²	156.4	81%	0.813	81%	0.811	S	S	*	*			trans	58	104.6	175.2	-63.2	-27.6	0	0	0	118.6
13	E	40	Very low	36.3	Very low	185 Å²	185	155 Å²	155	86%	0.864	81%	0.813	S	S	*	*			trans	-162.5	117.7	132.3	-124.8	-177.8	-161.8	0	0	111.9
14	F	38.5	Very low	35.5	Very low	212 Å²	212	150.3 Å²	150.3	93%	0.93	81%	0.811	S	S	*	*			trans	-171.5	115.9	144.4	-96.3	-57.8	0	0	0	109.5
15	P	36.2	Very low	35.4	Very low	119 Å²	119	150.6 Å²	150.6	77%	0.773	81%	0.812	S	S	*	*			trans	-93.4	171.4	-163.9	35.7	-37.6	0	0	0	116.2
16	S	32.9	Very low	34.6	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	81%	0.807	S	S	*	*			trans	-58.7	150.6	180	55	0	0	0	0	116.6
17	M	33.6	Very low	34.6	Very low	194 Å²	194	140.5 Å²	140.5	96%	0.956	81%	0.809	S	S	*	*			trans	-124.1	151.7	147.2	-78.5	-159.8	-71.2	0	0	110.7
18	T	32.3	Very low	34.2	Very low	112 Å²	112	136 Å²	136	69%	0.687	81%	0.811	S	S	*	*			trans	-123.9	130.9	-154.1	-58.2	0	0	0	0	113.7
19	I	32.1	Very low	34.3	Very low	137 Å²	137	134.7 Å²	134.7	70%	0.703	82%	0.818	S	S	*	*			trans	19.1	120.2	153.4	-50.3	167.4	0	0	0	117.6
20	H	34.7	Very low	34.8	Very low	200 Å²	200	137 Å²	137	93%	0.926	82%	0.821	S	S	*	*			trans	-129.5	141.5	139.6	-96.8	29.6	0	0	0	109
21	S	31.3	Very low	35.1	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	82%	0.818	S	S	*	*			trans	-137.1	125.4	-168.9	56.6	0	0	0	0	112.2
22	N	35	Very low	36.3	Very low	177 Å²	177	136 Å²	136	95%	0.947	80%	0.804	S	S	*	*			trans	-176.4	151.1	153.1	-101.8	-25.8	0	0	0	111.2
23	G	33.3	Very low	37.6	Very low	72 Å²	72	132.1 Å²	132.1	74%	0.742	79%	0.785	S	S	*	*			trans	107.9	109.9	162	0	0	0	0	0	116.6
24	S	32.2	Very low	37.9	Very low	114 Å²	114	124.8 Å²	124.8	80%	0.797	75%	0.753	S	S	*	*			trans	-43.1	156.5	156.6	45.6	0	0	0	0	113.7
25	D	34.2	Very low	38.5	Very low	163 Å²	163	117.6 Å²	117.6	87%	0.872	73%	0.728	S	S	*	*			cis	-156.2	-176.8	43.3	-149.1	-17.4	0	0	0	114.5
26	G	30.9	Very low	39.8	Very low	73 Å²	73	119.2 Å²	119.2	75%	0.753	73%	0.725	S	S	*	*			trans	-68.9	156.4	-158.3	0	0	0	0	0	119.8
27	G	33.1	Very low	41.1	Very low	80 Å²	80	120 Å²	120	83%	0.825	72%	0.72	S	S	*	*			trans	176.4	52.7	178.3	0	0	0	0	0	114.9	A29	G27-A29 PolarHBondContact O-N 3.06Å
28	G	29.7	Very low	42.4	Very low	84 Å²	84	117.9 Å²	117.9	87%	0.866	70%	0.702	S	S	*	*			trans	-68	108.3	-171	0	0	0	0	0	115.6
29	A	37	Very low	43	Very low	103 Å²	103	120.2 Å²	120.2	85%	0.851	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-81.5	117.3	170.4	0	0	0	0	0	111.3	G27	G27-A29 PolarHBondContact O-N 3.06Å
30	K	45	Very low	43.4	Very low	206 Å²	206	125.8 Å²	125.8	90%	0.896	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-75.7	129.7	174	-69.6	-175.4	177.5	-178	0	110.6
31	L	43	Very low	43.6	Very low	165 Å²	165	119.3 Å²	119.3	86%	0.864	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-62.1	142.3	175.3	-152.8	73.9	0	0	0	110.8
32	Y	61.6	Low	43.9	Very low	113 Å²	113	122.1 Å²	122.1	44%	0.443	72%	0.723	S	S	.	*	P	Polyproline II helix	trans	-71.2	129.8	176.7	176.7	-89.1	0	0	0	110.6	P34	Y32-P34 HydrophobicContact CD1-CG 4.35Å; Y32-P34 HydrophobicContact CE1-CB 4.3Å; Y32-P34 HydrophobicContact CE1-CG 4.04Å
33	V	61.9	Low	43.9	Very low	70 Å²	70	118.4 Å²	118.4	42%	0.424	71%	0.711	S	S	.	*			trans	-109.3	118.6	173.1	-180	0	0	0	0	108.7	L37 R38	V33-L37 HydrophobicContact CG1-CB 3.78Å; V33-R38 HydrophobicContact CG1-CG 4.21Å; V33-R38 VanDerWaalsContact O-CZ 3.27Å; V33-R38 PolarHBondContact O-NE 3.19Å; V33-R38 PolarHBondContact O-NH2 2.97Å
34	P	47.8	Very low	44.1	Very low	30 Å²	30	121 Å²	121	20%	0.195	71%	0.708	C	S	.	*			trans	-55.1	150.9	177.9	-28.7	35.3	0	0	0	113.8	Y32 H36 L37	Y32-P34 HydrophobicContact CD1-CG 4.35Å; Y32-P34 HydrophobicContact CE1-CB 4.3Å; Y32-P34 HydrophobicContact CE1-CG 4.04Å; P34-H36 VanDerWaalsContact C-N 3.27Å; P34-H36 VanDerWaalsContact CB-CE1 3.41Å; P34-H36 WeakPolarHBondContact CB-CE1 3.41Å; P34-H36 PolarHBondContact O-N 3.17Å; P34-L37 PolarHBondContact O-N 3.23Å
35	P	49.7	Very low	44.4	Very low	62 Å²	62	121.4 Å²	121.4	40%	0.403	70%	0.701	S	S	.	*	G	3₁₀ helix	trans	-55.1	-38.9	-174.4	-27	35.3	0	0	0	114.1	L37 R38	P35-L37 PolarHBondContact O-N 3.24Å; P35-R38 PolarHBondContact O-N 3.19Å
36	H	63.9	Low	44.5	Very low	152 Å²	152	121.1 Å²	121.1	70%	0.704	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-69.2	-10.4	-177.9	62.3	-98.1	0	0	0	114.5	P34	P34-H36 VanDerWaalsContact C-N 3.27Å; P34-H36 VanDerWaalsContact CB-CE1 3.41Å; P34-H36 WeakPolarHBondContact CB-CE1 3.41Å; P34-H36 PolarHBondContact O-N 3.17Å
37	L	60.2	Low	44.7	Very low	116 Å²	116	121.8 Å²	121.8	61%	0.607	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-102.5	1.5	176.6	-72.5	171.3	0	0	0	113.8	V33 P34 P35	V33-L37 HydrophobicContact CG1-CB 3.78Å; P34-L37 PolarHBondContact O-N 3.23Å; P35-L37 PolarHBondContact O-N 3.24Å
38	R	61.1	Low	44.9	Very low	150 Å²	150	126.5 Å²	126.5	57%	0.566	70%	0.698	S	S	*	*	S	Bend	trans	-82.9	-14.4	-171.5	-64	-175.1	-175.9	-178.2	2.6	115.7	V33 P35	V33-R38 HydrophobicContact CG1-CG 4.21Å; V33-R38 VanDerWaalsContact O-CZ 3.27Å; V33-R38 PolarHBondContact O-NE 3.19Å; V33-R38 PolarHBondContact O-NH2 2.97Å; P35-R38 PolarHBondContact O-N 3.19Å
39	N	44.5	Very low	45.2	Very low	161 Å²	161	127.3 Å²	127.3	86%	0.861	69%	0.691	S	S	*	*			trans	-120.6	79.8	-177.6	-89.4	0.4	0	0	0	113
40	R	41.5	Very low	45.2	Very low	254 Å²	254	127.8 Å²	127.8	96%	0.958	68%	0.682	S	S	*	*			trans	-149.1	82.3	160.5	-100.5	-171	174.9	-175.5	-1.2	110.4
41	G	37.9	Very low	44.8	Very low	65 Å²	65	125.8 Å²	125.8	67%	0.67	68%	0.682	S	S	*	*	S	Bend	trans	177.7	121.4	174.2	0	0	0	0	0	113.6
42	T	37.8	Very low	44.3	Very low	154 Å²	154	124 Å²	124	95%	0.945	67%	0.673	S	S	*	*			trans	55.6	125.4	163.5	50.8	0	0	0	0	119.6
43	S	35.2	Very low	43.1	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	69%	0.692	S	S	*	*			trans	-97.3	-167.4	173.3	53	0	0	0	0	112.4
44	N	38.3	Very low	41.8	Very low	125 Å²	125	127.8 Å²	127.8	67%	0.668	70%	0.696	S	S	*	*			trans	82.5	137.8	173.6	-54.8	58.9	0	0	0	114.3
45	D	38	Very low	41.4	Very low	123 Å²	123	133.5 Å²	133.5	66%	0.658	72%	0.72	S	S	*	*			cis	-164	152.5	-10.1	-107.9	-30.8	0	0	0	111.2
46	L	36.5	Very low	40.8	Very low	158 Å²	158	139.6 Å²	139.6	83%	0.827	74%	0.74	S	S	*	*			trans	63.6	136.3	163.6	-56.1	162.5	0	0	0	116.6
47	A	35.7	Very low	39.6	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	74%	0.741	S	S	*	*			cis	72.5	128.2	46.8	0	0	0	0	0	113.2
48	E	36.8	Very low	38.7	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	76%	0.756	S	S	*	*			cis	-151.8	-164.6	2.1	-134.5	-155.5	81	0	0	108.9
49	S	36.1	Very low	38	Very low	102 Å²	102	142 Å²	142	71%	0.713	77%	0.766	S	S	*	*			cis	-149.3	-139.2	13.7	64.8	0	0	0	0	113.2
50	V	36	Very low	37.8	Very low	112 Å²	112	139.4 Å²	139.4	68%	0.679	76%	0.761	S	S	*	*			trans	-139	143	-172.8	-159.1	0	0	0	0	111.6
51	N	36.5	Very low	37.7	Very low	164 Å²	164	138.9 Å²	138.9	88%	0.877	76%	0.759	S	S	*	*				175	156.7	125	-92.6	-43.5	0	0	0	117.6
52	D	33.3	Very low	37.7	Very low	129 Å²	129	138.8 Å²	138.8	69%	0.69	76%	0.758	S	S	*	*			trans	-88.8	151.3	-169.7	168.7	41.5	0	0	0	115
53	F	36.4	Very low	37.8	Very low	189 Å²	189	139 Å²	139	83%	0.829	76%	0.759	S	S	*	*			trans	-161	165	136.6	-138.5	-102.7	0	0	0	113.9
54	S	34	Very low	38	Very low	73 Å²	73	138 Å²	138	51%	0.51	77%	0.765	S	S	.	*			trans	-141.2	-175.4	-167.9	63.4	0	0	0	0	115.2
55	Q	39.2	Very low	37.9	Very low	150 Å²	150	139.1 Å²	139.1	70%	0.701	77%	0.771	S	S	*	*			trans	79.9	134	176.5	-47	179.1	20.5	0	0	115.1
56	F	38.3	Very low	38	Very low	189 Å²	189	140.2 Å²	140.2	83%	0.829	78%	0.777	S	S	*	*				-155.6	175.5	60.5	-111.7	-93.2	0	0	0	114.2
57	S	37.7	Very low	37.9	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	78%	0.776	S	S	*	*			trans	-141	157.6	-178.2	-29.4	0	0	0	0	113.1
58	R	42.6	Very low	38	Very low	247 Å²	247	148.9 Å²	148.9	93%	0.932	79%	0.785	S	S	*	*				172.1	165.2	125.1	-93.7	170.4	-180	-151.7	-2.1	115.6
59	P	46.1	Very low	38.1	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	79%	0.786	S	S	*	*			trans	-131.2	-167.9	-168.1	44.5	-28.5	0	0	0	115.4
60	S	40.2	Very low	38	Very low	107 Å²	107	151 Å²	151	75%	0.748	80%	0.796	S	S	*	*				144.9	159.4	126	-162.5	0	0	0	0	117.7
61	R	38.8	Very low	38.5	Very low	242 Å²	242	150.3 Å²	150.3	91%	0.913	79%	0.793	S	S	*	*			trans	75.3	144.2	167.3	-55.6	179.4	175	167.7	-2.4	119.1
62	G	39	Very low	38.5	Very low	64 Å²	64	151.9 Å²	151.9	66%	0.66	79%	0.792	S	S	*	*			cis	162.3	141.1	-16	0	0	0	0	0	117.6
63	T	40	Very low	38.9	Very low	157 Å²	157	157.6 Å²	157.6	96%	0.963	80%	0.804	S	S	*	*			trans	61.3	138.9	150.7	48.2	0	0	0	0	124.1
64	G	38.5	Very low	38.8	Very low	79 Å²	79	152 Å²	152	81%	0.814	80%	0.8	S	S	*	*			trans	152.3	109.8	149.6	0	0	0	0	0	118.1
65	D	35.4	Very low	38.9	Very low	149 Å²	149	153.7 Å²	153.7	80%	0.797	81%	0.812	S	S	*	*			trans	-107.3	156.6	175.5	-77.9	-73.3	0	0	0	114
66	N	39.8	Very low	38.6	Very low	146 Å²	146	157.3 Å²	157.3	78%	0.781	82%	0.82	S	S	*	*				167.7	115.9	120.9	-92.8	-66.8	0	0	0	117.6
67	F	36.1	Very low	38.4	Very low	184 Å²	184	154.1 Å²	154.1	81%	0.807	82%	0.822	S	S	*	*				42.5	140	128.3	-92.3	-71.6	0	0	0	127.6
68	R	36.6	Very low	38.1	Very low	243 Å²	243	156.7 Å²	156.7	92%	0.917	83%	0.827	S	S	*	*			trans	86.1	118.4	149.6	-69.7	177.7	-174.4	-162.7	0.9	121.2
69	G	38.5	Very low	37.6	Very low	82 Å²	82	156.8 Å²	156.8	85%	0.845	83%	0.828	S	S	*	*			trans	169.6	129	161.4	0	0	0	0	0	114.8
70	R	34.8	Very low	36.9	Very low	244 Å²	244	154.6 Å²	154.6	92%	0.921	83%	0.827	S	S	*	*			trans	-163.6	167.2	177.2	-119.2	-169.3	-178.1	-159.6	2.7	108.1
71	P	46.6	Very low	36.5	Very low	97 Å²	97	155 Å²	155	63%	0.63	83%	0.83	S	S	*	*			cis	-141.6	-171.1	3.6	43.3	-23.8	0	0	0	117
72	F	37.5	Very low	36.2	Very low	196 Å²	196	153.8 Å²	153.8	86%	0.86	83%	0.831	S	S	*	*			trans	55.9	108.3	150.2	-80.3	-65.4	0	0	0	122.9
73	R	40	Very low	36	Very low	250 Å²	250	157.1 Å²	157.1	94%	0.943	84%	0.838	S	S	*	*				174.1	151.9	104.8	-102.7	-174.3	169.4	-170.3	-1.9	113.2
74	G	35.2	Very low	35.5	Very low	71 Å²	71	153.1 Å²	153.1	73%	0.732	83%	0.829	S	S	*	*			trans	95.4	100	140	0	0	0	0	0	120.8
75	S	35.2	Very low	35.3	Very low	109 Å²	109	155.8 Å²	155.8	76%	0.762	82%	0.824	S	S	*	*			trans	45.7	116.5	141.1	-60.4	0	0	0	0	123.6
76	Y	33.4	Very low	35.1	Very low	225 Å²	225	157.1 Å²	157.1	88%	0.882	83%	0.826	S	S	*	*			trans	41.4	99.9	131.9	-62.9	-80.1	0	0	0	120.8
77	S	33.4	Very low	34.9	Very low	123 Å²	123	160 Å²	160	86%	0.86	83%	0.825	S	S	*	*				-175.2	157.3	119.3	43.4	0	0	0	0	113.7
78	N	32.5	Very low	34.7	Very low	156 Å²	156	157.9 Å²	157.9	83%	0.834	82%	0.818	S	S	*	*			trans	-10.7	119.8	172	-73.6	-26.9	0	0	0	120
79	R	32.2	Very low	34.8	Very low	249 Å²	249	153.9 Å²	153.9	94%	0.94	81%	0.81	S	S	*	*				146.8	149.4	129.5	-82.5	169.8	175.7	-178.5	-0.3	112.1
80	G	30.9	Very low	35	Very low	73 Å²	73	153 Å²	153	75%	0.753	79%	0.791	S	S	*	*			trans	93.1	149.1	177.2	0	0	0	0	0	113.1
81	S	33	Very low	35.3	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	78%	0.778	S	S	*	*			cis	-138.2	147.7	6.1	-73	0	0	0	0	112.2	V83	S81-V83 PolarHBondContact O-N 3.46Å
82	K	31.5	Very low	35	Very low	217 Å²	217	146.4 Å²	146.4	94%	0.943	78%	0.775	S	S	*	*			trans	-67	120.8	165.2	-67.3	179.8	177.8	-178.7	0	108.4
83	V	35.9	Very low	35.5	Very low	133 Å²	133	141 Å²	141	81%	0.806	75%	0.749	S	S	*	*			trans	-105.6	122.3	158.8	179.2	0	0	0	0	106.1	S81	S81-V83 PolarHBondContact O-N 3.46Å
84	G	29.4	Very low	35.7	Very low	74 Å²	74	132.2 Å²	132.2	76%	0.763	72%	0.716	S	S	*	*			trans	-68.4	135	179.7	0	0	0	0	0	110.7
85	N	34.4	Very low	35.9	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	70%	0.7	S	S	*	*			trans	-141.6	104.2	171.8	-154.2	-3.9	0	0	0	108.1	R87	N85-R87 PolarHBondContact O-N 2.59Å
86	E	30.7	Very low	36.2	Very low	178 Å²	178	130.2 Å²	130.2	83%	0.832	69%	0.69	S	S	*	*			trans	-79.9	69.2	-174.1	-67.7	-177.3	112.7	0	0	111.4
87	R	34.4	Very low	36.6	Very low	205 Å²	205	123.9 Å²	123.9	77%	0.774	67%	0.668	S	S	*	*			trans	-104.1	82.4	166.4	-71.1	-170.8	175.4	-168.1	-2.1	109.4	N85	N85-R87 PolarHBondContact O-N 2.59Å
88	Q	33.4	Very low	37	Very low	141 Å²	141	122 Å²	122	66%	0.659	65%	0.648	S	S	*	*			trans	-93.7	140.2	177.8	-67.9	-162.2	27.3	0	0	112
89	Q	38.1	Very low	37.3	Very low	159 Å²	159	120.4 Å²	120.4	74%	0.743	64%	0.637	S	S	*	*	S	Bend	trans	78	8.9	153.3	-62.7	167.5	47.9	0	0	120.7
90	S	41.7	Very low	37.5	Very low	63 Å²	63	116.7 Å²	116.7	44%	0.441	64%	0.636	S	S	.	*	S	Bend	trans	-88.8	-45.7	168.3	46.3	0	0	0	0	114.4	S92	S90-S92 PolarHBondContact O-N 3.06Å
91	D	42.7	Very low	37.8	Very low	122 Å²	122	117.6 Å²	117.6	65%	0.652	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-9.2	-152.4	-56.2	-11.1	0	0	0	114.8	R93	D91-R93 VanDerWaalsContact C-N 3.25Å; D91-R93 PolarHBondContact O-N 3.33Å
92	S	40.5	Very low	37.7	Very low	81 Å²	81	118.9 Å²	118.9	57%	0.566	62%	0.615	S	S	*	*	H	α-helix	trans	-78.8	3.3	-179.6	49.1	0	0	0	0	115.1	S90 S95	S90-S92 PolarHBondContact O-N 3.06Å; S92-S95 PolarHBondContact O-OG 3.35Å
93	R	47.5	Very low	37.8	Very low	81 Å²	81	114.2 Å²	114.2	31%	0.306	61%	0.61	S	S	.	*	H	α-helix	trans	-81	-43.5	178.4	-61	-172.6	-168.2	169.5	8.7	112.9	D91 S95 S96 F97 N449	D91-R93 VanDerWaalsContact C-N 3.25Å; D91-R93 PolarHBondContact O-N 3.33Å; R93-S95 VanDerWaalsContact C-N 3.33Å; R93-S95 PolarHBondContact O-N 3.12Å; R93-S96 PolarHBondContact O-N 3.18Å; R93-F97 WeakPolarHBondContact O-CD2 3.43Å; R93-N449 PolarHBondContact NH1-OD1 3.01Å; R93-N449 PolarHBondContact NH2-OD1 2.72Å
94	W	44.3	Very low	37.5	Very low	66 Å²	66	119.4 Å²	119.4	25%	0.25	62%	0.615	C	S	.	*	H	α-helix	trans	-70.1	-29.8	-178.8	-65.9	90.5	0	0	0	112.4	S96 F97 N98 L472 A473	W94-S96 PolarHBondContact O-N 2.8Å; W94-F97 PolarHBondContact O-N 2.89Å; W94-N98 PolarHBondContact O-N 2.6Å; W94-L472 HydrophobicContact CE3-CD2 3.6Å; W94-L472 HydrophobicContact CE3-CG 4.22Å; W94-L472 HydrophobicContact CZ3-CB 4.17Å; W94-L472 HydrophobicContact CZ3-CD2 3.7Å; W94-L472 HydrophobicContact CZ3-CG 3.8Å; W94-A473 HydrophobicContact CH2-CB 4.18Å
95	S	38.1	Very low	37.4	Very low	58 Å²	58	120.2 Å²	120.2	41%	0.406	62%	0.624	S	S	.	*	H	α-helix	trans	-60.2	-32.4	174.2	48.4	0	0	0	0	113.3	S92 R93 N98	S92-S95 PolarHBondContact O-OG 3.35Å; R93-S95 VanDerWaalsContact C-N 3.33Å; R93-S95 PolarHBondContact O-N 3.12Å; S95-N98 WeakPolarHBondContact O-CB 3.4Å; S95-N98 PolarHBondContact O-N 3.3Å
96	S	41.6	Very low	37	Very low	80 Å²	80	116.7 Å²	116.7	56%	0.559	62%	0.619	S	S	*	*	H	α-helix	trans	-68.8	-38	178.2	-58.6	0	0	0	0	112.4	R93 W94 N98 M99	R93-S96 PolarHBondContact O-N 3.18Å; W94-S96 PolarHBondContact O-N 2.8Å; S96-N98 PolarHBondContact O-N 2.75Å; S96-M99 PolarHBondContact O-N 3.13Å
97	F	43.1	Very low	36.8	Very low	92 Å²	92	117.8 Å²	117.8	40%	0.404	62%	0.624	S	S	.	*	H	α-helix	trans	-70.1	-21.4	172.6	-67.7	-75.8	0	0	0	112.9	R93 W94 M99	R93-F97 WeakPolarHBondContact O-CD2 3.43Å; W94-F97 PolarHBondContact O-N 2.89Å; F97-M99 VanDerWaalsContact C-N 3.34Å
98	N	41.4	Very low	36.7	Very low	85 Å²	85	112.8 Å²	112.8	46%	0.455	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-79.8	-13.3	-179.8	-142.2	-7	0	0	0	113.3	W94 S95 S96 N100 I101	W94-N98 PolarHBondContact O-N 2.6Å; S95-N98 WeakPolarHBondContact O-CB 3.4Å; S95-N98 PolarHBondContact O-N 3.3Å; S96-N98 PolarHBondContact O-N 2.75Å; N98-N100 VanDerWaalsContact C-N 3.27Å; N98-N100 PolarHBondContact O-N 3.38Å; N98-I101 PolarHBondContact O-N 3.26Å
99	M	37.6	Very low	36.6	Very low	122 Å²	122	111.8 Å²	111.8	60%	0.601	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-67.9	-18.9	-175.1	-71.5	-60.5	-168	0	0	114.9	S96 F97	S96-M99 PolarHBondContact O-N 3.13Å; F97-M99 VanDerWaalsContact C-N 3.34Å
100	N	36.6	Very low	36.4	Very low	171 Å²	171	112.7 Å²	112.7	91%	0.914	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-99.9	14.7	170.6	-95.7	-19.2	0	0	0	113.7	N98	N98-N100 VanDerWaalsContact C-N 3.27Å; N98-N100 PolarHBondContact O-N 3.38Å
101	I	38.9	Very low	36	Very low	92 Å²	92	112.2 Å²	112.2	47%	0.472	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.5	-5.4	172.3	-68.2	175.5	0	0	0	111.2	N98 S103	N98-I101 PolarHBondContact O-N 3.26Å; I101-S103 PolarHBondContact O-N 3.37Å
102	Q	29.7	Very low	35.8	Very low	142 Å²	142	108.4 Å²	108.4	66%	0.664	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	53.9	178.5	-62.3	-167.7	3.2	0	0	114.6
103	S	33.8	Very low	35.8	Very low	119 Å²	119	108.9 Å²	108.9	83%	0.832	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.7	38.7	162.8	-89.3	0	0	0	0	115.1	I101	I101-S103 PolarHBondContact O-N 3.37Å
104	R	30.1	Very low	35.7	Very low	242 Å²	242	107.9 Å²	107.9	91%	0.913	62%	0.62	S	S	*	*			trans	-157.4	66.8	149.1	-116.2	168.3	-170.6	-177.9	3.1	112.1	G106	R104-G106 PolarHBondContact O-N 2.84Å; R104-G106 VanDerWaalsContact O-N 3.09Å
105	G	26.9	Very low	35.5	Very low	92 Å²	92	108.8 Å²	108.8	95%	0.948	64%	0.635	S	S	*	*			trans	-63.1	108.4	169	0	0	0	0	0	110.4
106	G	26.1	Very low	36	Very low	59 Å²	59	115.2 Å²	115.2	61%	0.608	65%	0.65	S	S	*	*			trans	-168	129.7	175.8	0	0	0	0	0	110.5	R104 S108	R104-G106 PolarHBondContact O-N 2.84Å; R104-G106 VanDerWaalsContact O-N 3.09Å; G106-S108 PolarHBondContact O-N 2.85Å
107	H	26.9	Very low	36.5	Very low	201 Å²	201	113 Å²	113	93%	0.931	63%	0.629	S	S	*	*			trans	-69.2	80.1	166	-78.9	7.5	0	0	0	109.2	T109	H107-T109 VanDerWaalsContact C-N 3.34Å; H107-T109 PolarHBondContact O-N 3.17Å; H107-T109 VanDerWaalsContact O-N 3.09Å
108	S	31.2	Very low	36.7	Very low	100 Å²	100	112.5 Å²	112.5	70%	0.699	64%	0.637	S	S	*	*			trans	-68.4	102.4	153.5	57.4	0	0	0	0	107	G106 L110	G106-S108 PolarHBondContact O-N 2.85Å; S108-L110 PolarHBondContact O-N 2.85Å
109	T	32	Very low	37.2	Very low	121 Å²	121	109.7 Å²	109.7	74%	0.742	62%	0.62	S	S	*	*			trans	-40.1	135	146.9	41.7	0	0	0	0	108.1	H107 G111	H107-T109 VanDerWaalsContact C-N 3.34Å; H107-T109 PolarHBondContact O-N 3.17Å; H107-T109 VanDerWaalsContact O-N 3.09Å; T109-G111 PolarHBondContact O-N 3.47Å
110	L	33.9	Very low	37.6	Very low	177 Å²	177	110.9 Å²	110.9	93%	0.927	63%	0.629	S	S	*	*			trans	-67.9	86.2	167.7	-90.5	78.7	0	0	0	106.7	S108 S112	S108-L110 PolarHBondContact O-N 2.85Å; L110-S112 PolarHBondContact O-N 3.43Å; L110-S112 VanDerWaalsContact O-N 3.16Å
111	G	32.8	Very low	37.9	Very low	54 Å²	54	105.3 Å²	105.3	56%	0.557	60%	0.604	S	S	*	*			trans	-65.3	116.7	-171.6	0	0	0	0	0	109.2	T109 N113	T109-G111 PolarHBondContact O-N 3.47Å; G111-N113 PolarHBondContact O-N 2.77Å
112	S	38.1	Very low	38.3	Very low	42 Å²	42	108 Å²	108	29%	0.294	61%	0.612	S	S	.	*			trans	-57.7	85.4	160.9	53.1	0	0	0	0	109	L110 V114 E305	L110-S112 PolarHBondContact O-N 3.43Å; L110-S112 VanDerWaalsContact O-N 3.16Å; S112-V114 CarbonylContact C-O 3.48Å; S112-V114 PolarHBondContact O-N 3.48Å; S112-E305 WeakPolarHBondContact CB-OE2 3.46Å; S112-E305 PolarHBondContact OG-OE2 2.9Å
113	N	41	Very low	39.4	Very low	91 Å²	91	107 Å²	107	49%	0.487	62%	0.616	S	S	.	*			trans	-76.7	-4.1	167.4	-113.9	23.1	0	0	0	111.3	G111 N133	G111-N113 PolarHBondContact O-N 2.77Å; N113-N133 PolarHBondContact ND2-ND2 3.1Å
114	V	44.8	Very low	41.1	Very low	60 Å²	60	102.5 Å²	102.5	36%	0.364	58%	0.581	S	S	.	*	S	Bend	trans	-59.1	122.1	150.5	-178	0	0	0	0	106.9	S112 R116 R286	S112-V114 CarbonylContact C-O 3.48Å; S112-V114 PolarHBondContact O-N 3.48Å; V114-R116 PolarHBondContact O-N 3.43Å; V114-R286 HydrophobicContact CG1-CG 4.26Å
115	P	39.9	Very low	43.7	Very low	85 Å²	85	94.1 Å²	94.1	55%	0.552	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-52.6	129.9	-177.3	-28.9	36.5	0	0	0	111.8	R117 L130	P115-R117 PolarHBondContact O-N 3.22Å; P115-R117 VanDerWaalsContact O-N 3.09Å; P115-L130 HydrophobicContact CG-CD1 4.24Å
116	R	48.5	Very low	46.6	Very low	193 Å²	193	89.9 Å²	89.9	73%	0.728	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.3	119.6	172.7	-88.5	-173.9	161.1	-178	-4.6	108.7	V114 S118 E305	V114-R116 PolarHBondContact O-N 3.43Å; R116-S118 PolarHBondContact O-N 3.31Å; R116-E305 IonicContact CZ-OE1 2.83Å; R116-E305 IonicContact NE-OE1 3.91Å; R116-E305 PolarHBondContact NE-OE1 3.33Å; R116-E305 IonicContact NH2-OE1 3.2Å; R116-E305 PolarHBondContact NH2-OE1 3.23Å
117	R	52.3	Low	49.7	Very low	33 Å²	33	89.7 Å²	89.7	13%	0.125	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-54.1	122.7	-169.9	-163.8	178.8	-154.4	158.5	21.4	110.8	P115 W119 E124 N308	P115-R117 PolarHBondContact O-N 3.22Å; P115-R117 VanDerWaalsContact O-N 3.09Å; R117-W119 VanDerWaalsContact C-N 3.31Å; R117-W119 HydrophobicContact CB-CD2 4.48Å; R117-W119 HydrophobicContact CB-CZ2 4.26Å; R117-W119 HydrophobicContact CG-CD2 4.29Å; R117-W119 HydrophobicContact CG-CZ2 4.39Å; R117-W119 PolarHBondContact O-N 2.97Å; R117-W119 PolarHBondContact O-NE1 2.92Å; R117-E124 WeakPolarHBondContact CG-OE1 3.22Å; R117-E124 IonicContact CZ-OE2 3.04Å; R117-E124 VanDerWaalsContact NE-CD 3.32Å; R117-E124 IonicContact NE-OE1 2.74Å; R117-E124 PolarHBondContact NE-OE1 3.44Å; R117-E124 IonicContact NE-OE2 3.18Å; R117-E124 PolarHBondContact NE-OE2 2.93Å; R117-E124 IonicContact NH2-OE2 3.2Å; R117-E124 PolarHBondContact NH2-OE2 3.23Å; R117-N308 PolarHBondContact NH1-ND2 3.4Å; R117-N308 VanDerWaalsContact NH1-ND2 3.12Å
118	S	48	Very low	52.6	Low	82 Å²	82	85.7 Å²	85.7	57%	0.573	48%	0.479	S	S	*	.			trans	-86	78.5	-179.5	-167.9	0	0	0	0	109.3	R116 N120 S121	R116-S118 PolarHBondContact O-N 3.31Å; S118-N120 PolarHBondContact O-N 2.93Å; S118-S121 PolarHBondContact O-N 3.34Å
119	W	52.6	Low	55.4	Low	26 Å²	26	83.1 Å²	83.1	10%	0.098	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	14.3	-178.6	-56.6	94.5	0	0	0	115.6	R117 I244 T247 I248 R252	R117-W119 VanDerWaalsContact C-N 3.31Å; R117-W119 HydrophobicContact CB-CD2 4.48Å; R117-W119 HydrophobicContact CB-CZ2 4.26Å; R117-W119 HydrophobicContact CG-CD2 4.29Å; R117-W119 HydrophobicContact CG-CZ2 4.39Å; R117-W119 PolarHBondContact O-N 2.97Å; R117-W119 PolarHBondContact O-NE1 2.92Å; W119-I244 HydrophobicContact CZ3-CG2 4.34Å; W119-T247 HydrophobicContact CH2-CG2 3.56Å; W119-T247 HydrophobicContact CZ2-CG2 4.47Å; W119-T247 HydrophobicContact CZ3-CG2 3.89Å; W119-I248 HydrophobicContact CE3-CD1 4.2Å; W119-I248 HydrophobicContact CE3-CG1 3.8Å; W119-I248 HydrophobicContact CZ3-CG1 4.19Å; W119-R252 VanDerWaalsContact CB-CZ 3.4Å; W119-R252 VanDerWaalsContact CG-CZ 3.44Å
120	N	45.4	Very low	58.3	Low	147 Å²	147	79.2 Å²	79.2	79%	0.786	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-6.9	176.6	-69.3	8.2	0	0	0	112.7	S118	S118-N120 PolarHBondContact O-N 2.93Å
121	S	43.7	Very low	61.1	Low	54 Å²	54	76.1 Å²	76.1	38%	0.378	42%	0.421	S	S	.	.			trans	-110.7	121.9	168.1	-173.3	0	0	0	0	110.3	S118 T123	S118-S121 PolarHBondContact O-N 3.34Å; S121-T123 PolarHBondContact O-N 3.36Å; S121-T123 PolarHBondContact OG-N 3.46Å; S121-T123 PolarHBondContact OG-OG1 3.12Å
122	F	46.9	Very low	63.9	Low	149 Å²	149	80.1 Å²	80.1	65%	0.654	42%	0.419	S	S	*	.	S	Bend	trans	-78.2	-5.5	173.1	-75	-94	0	0	0	112.7	I248	F122-I248 HydrophobicContact CD1-CD1 4.1Å; F122-I248 HydrophobicContact CE1-CD1 3.67Å; F122-I248 HydrophobicContact CE1-CG2 4.43Å; F122-I248 HydrophobicContact CZ-CD1 4.22Å
123	T	53.3	Low	66.4	Low	119 Å²	119	80.6 Å²	80.6	73%	0.73	42%	0.419	S	S	*	.			trans	-119.4	63	-179.5	52.8	0	0	0	0	110.7	S121 D125	S121-T123 PolarHBondContact O-N 3.36Å; S121-T123 PolarHBondContact OG-N 3.46Å; S121-T123 PolarHBondContact OG-OG1 3.12Å; T123-D125 PolarHBondContact O-N 2.94Å
124	E	68.5	Low	68.7	Low	25 Å²	25	81.7 Å²	81.7	12%	0.117	42%	0.421	C	S	.	.			trans	-71.7	92.9	166.2	-87	-169.4	-167.3	0	0	110.4	R117 W126 I244 L284	R117-E124 WeakPolarHBondContact CG-OE1 3.22Å; R117-E124 IonicContact CZ-OE2 3.04Å; R117-E124 VanDerWaalsContact NE-CD 3.32Å; R117-E124 IonicContact NE-OE1 2.74Å; R117-E124 PolarHBondContact NE-OE1 3.44Å; R117-E124 IonicContact NE-OE2 3.18Å; R117-E124 PolarHBondContact NE-OE2 2.93Å; R117-E124 IonicContact NH2-OE2 3.2Å; R117-E124 PolarHBondContact NH2-OE2 3.23Å; E124-W126 PolarHBondContact O-N 3.21Å; E124-W126 VanDerWaalsContact O-N 3.17Å; E124-I244 HydrophobicContact CB-CD1 4.3Å; E124-L284 HydrophobicContact CB-CD1 4.03Å; E124-L284 HydrophobicContact CG-CD1 4.15Å
125	D	84.6	Confident	70.9	Confident	67 Å²	67	87.6 Å²	87.6	36%	0.358	44%	0.437	S	S	.	.			trans	-68.6	102.6	170.2	170.9	11.6	0	0	0	110.6	T123 T127 Q128	T123-D125 PolarHBondContact O-N 2.94Å; D125-T127 VanDerWaalsContact CG-OG1 3.31Å; D125-T127 PolarHBondContact O-N 2.9Å; D125-T127 VanDerWaalsContact O-N 3.16Å; D125-T127 WeakPolarHBondContact OD1-CB 3.45Å; D125-T127 PolarHBondContact OD1-N 2.84Å; D125-T127 PolarHBondContact OD1-OG1 3.01Å; D125-T127 PolarHBondContact OD2-OG1 3.32Å; D125-Q128 HydrophobicContact CB-CG 4.09Å; D125-Q128 PolarHBondContact O-N 2.7Å; D125-Q128 VanDerWaalsContact OD2-CG 3.28Å; D125-Q128 WeakPolarHBondContact OD2-CG 3.39Å; D125-Q128 PolarHBondContact OD2-NE2 2.78Å
126	W	89.2	Confident	73.2	Confident	2 Å²	2	84.6 Å²	84.6	1%	0.008	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.1	-178.2	-72.1	11.2	0	0	0	114	E124 Q128 M235 I236 P240 V258 L284 I285 N308	E124-W126 PolarHBondContact O-N 3.21Å; E124-W126 VanDerWaalsContact O-N 3.17Å; W126-Q128 VanDerWaalsContact C-N 3.26Å; W126-M235 HydrophobicContact CE3-CB 4.44Å; W126-M235 HydrophobicContact CH2-CE 4.3Å; W126-M235 HydrophobicContact CZ3-CB 4.15Å; W126-M235 HydrophobicContact CZ3-CE 3.88Å; W126-I236 WeakPolarHBondContact O-CG2 3.41Å; W126-P240 HydrophobicContact CH2-CB 4.08Å; W126-P240 HydrophobicContact CZ2-CB 3.57Å; W126-P240 HydrophobicContact CZ2-CG 4.45Å; W126-V258 HydrophobicContact CH2-CG2 4.38Å; W126-L284 HydrophobicContact CG-CB 4.34Å; W126-I285 HydrophobicContact CD2-CG1 4.12Å; W126-I285 HydrophobicContact CE3-CD1 3.94Å; W126-I285 HydrophobicContact CE3-CG1 3.62Å; W126-I285 HydrophobicContact CH2-CG1 4.4Å; W126-I285 HydrophobicContact CZ3-CD1 4.13Å; W126-I285 HydrophobicContact CZ3-CG1 3.8Å; W126-N308 HydrophobicContact CH2-CB 3.91Å; W126-N308 HydrophobicContact CZ2-CB 4.32Å
127	T	90.2	Very high	75.3	Confident	55 Å²	55	76.5 Å²	76.5	34%	0.337	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.5	173.4	75.2	0	0	0	0	112.7	D125 Q129 H181 I236	D125-T127 VanDerWaalsContact CG-OG1 3.31Å; D125-T127 PolarHBondContact O-N 2.9Å; D125-T127 VanDerWaalsContact O-N 3.16Å; D125-T127 WeakPolarHBondContact OD1-CB 3.45Å; D125-T127 PolarHBondContact OD1-N 2.84Å; D125-T127 PolarHBondContact OD1-OG1 3.01Å; D125-T127 PolarHBondContact OD2-OG1 3.32Å; T127-Q129 PolarHBondContact O-N 3.5Å; T127-H181 PolarHBondContact O-CE1 3.33Å; T127-I236 HydrophobicContact CG2-CG2 4.26Å
128	Q	88.6	Confident	76.9	Confident	118 Å²	118	81.6 Å²	81.6	55%	0.551	41%	0.412	S	S	*	.			trans	-75	114.7	-179.3	-60.5	-174.3	16.3	0	0	111.5	D125 W126 L130	D125-Q128 HydrophobicContact CB-CG 4.09Å; D125-Q128 PolarHBondContact O-N 2.7Å; D125-Q128 VanDerWaalsContact OD2-CG 3.28Å; D125-Q128 WeakPolarHBondContact OD2-CG 3.39Å; D125-Q128 PolarHBondContact OD2-NE2 2.78Å; W126-Q128 VanDerWaalsContact C-N 3.26Å; Q128-L130 PolarHBondContact O-N 2.83Å
129	Q	89.5	Confident	78.8	Confident	45 Å²	45	81.7 Å²	81.7	21%	0.21	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-75.8	119.3	177.1	-172	179.2	51.6	0	0	110.5	T127 I183 D186 R282	T127-Q129 PolarHBondContact O-N 3.5Å; Q129-I183 HydrophobicContact CB-CD1 4.2Å; Q129-I183 HydrophobicContact CB-CG1 3.72Å; Q129-I183 HydrophobicContact CG-CG1 3.91Å; Q129-D186 PolarHBondContact NE2-OD2 3.49Å; Q129-R282 WeakPolarHBondContact CA-O 3.37Å; Q129-R282 VanDerWaalsContact CD-CZ 3.48Å; Q129-R282 VanDerWaalsContact CD-NH2 3.29Å; Q129-R282 HydrophobicContact CG-CB 4.04Å
130	L	92.3	Very high	80.5	Confident	39 Å²	39	81.2 Å²	81.2	20%	0.204	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-66.6	162.8	179.6	-60	176.6	0	0	0	112.4	P115 Q128 R282 S283 L284	P115-L130 HydrophobicContact CG-CD1 4.24Å; Q128-L130 PolarHBondContact O-N 2.83Å; L130-R282 HydrophobicContact CB-CB 4.33Å; L130-R282 PolarHBondContact N-O 3.49Å; L130-R282 PolarHBondContact O-NE 3Å; L130-R282 PolarHBondContact O-NH2 2.92Å; L130-S283 VanDerWaalsContact CD1-O 3.24Å; L130-S283 WeakPolarHBondContact CD1-O 3.35Å; L130-L284 HydrophobicContact CD1-CD2 4.35Å; L130-L284 HydrophobicContact CD2-CD2 4.02Å; L130-L284 HydrophobicContact CD2-CG 4.48Å
131	P	92.2	Very high	82.5	Confident	112 Å²	112	75.5 Å²	75.5	73%	0.727	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-55.1	153.6	171.6	-26.4	36	0	0	0	113.4
132	R	91.7	Very high	83.9	Confident	138 Å²	138	80.3 Å²	80.3	52%	0.521	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-70	140.7	175.1	-166.7	-171.1	-175.2	-158.4	14.1	110.3	E134 E137	R132-E134 IonicContact CZ-OE1 2.86Å; R132-E134 IonicContact NH1-OE1 3.65Å; R132-E134 PolarHBondContact NH1-OE1 3.16Å; R132-E137 WeakPolarHBondContact CG-OE2 3.39Å; R132-E137 IonicContact CZ-OE1 3.63Å; R132-E137 IonicContact CZ-OE2 2.71Å; R132-E137 IonicContact NE-OE1 3.53Å; R132-E137 PolarHBondContact NE-OE1 3.27Å; R132-E137 VanDerWaalsContact NE-OE1 3.16Å; R132-E137 IonicContact NE-OE2 2.72Å; R132-E137 PolarHBondContact NE-OE2 2.94Å; R132-E137 IonicContact NH2-OE1 2.77Å; R132-E137 PolarHBondContact NH2-OE1 3.46Å; R132-E137 IonicContact NH2-OE2 3.15Å
133	N	91.6	Very high	84.5	Confident	53 Å²	53	81.9 Å²	81.9	28%	0.283	39%	0.392	S	S	.	.			trans	-127.4	100.6	170.9	-176.7	-24.5	0	0	0	108.6	N113 R135 T136 E137 Y281	N113-N133 PolarHBondContact ND2-ND2 3.1Å; N133-R135 VanDerWaalsContact C-N 3.32Å; N133-R135 PolarHBondContact O-N 2.87Å; N133-R135 PolarHBondContact OD1-N 3.24Å; N133-T136 PolarHBondContact O-N 3.08Å; N133-T136 VanDerWaalsContact O-N 3.16Å; N133-T136 PolarHBondContact OD1-N 3.34Å; N133-E137 PolarHBondContact O-N 3.47Å; N133-Y281 PolarHBondContact N-OH 3.33Å; N133-Y281 PolarHBondContact O-OH 2.93Å
134	E	90.1	Very high	84.7	Confident	114 Å²	114	81.2 Å²	81.2	53%	0.533	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-36.5	-169.1	-54.6	-169.3	142.5	0	0	113	R132 E137 Q138	R132-E134 IonicContact CZ-OE1 2.86Å; R132-E134 IonicContact NH1-OE1 3.65Å; R132-E134 PolarHBondContact NH1-OE1 3.16Å; E134-E137 PolarHBondContact O-N 3.07Å; E134-Q138 WeakPolarHBondContact O-CB 3.49Å; E134-Q138 VanDerWaalsContact O-CG 3.31Å; E134-Q138 WeakPolarHBondContact O-CG 3.36Å; E134-Q138 PolarHBondContact O-N 3.49Å
135	R	90.4	Very high	84.1	Confident	184 Å²	184	84.8 Å²	84.8	69%	0.694	42%	0.415	S	S	*	.	H	α-helix	trans	-62.2	-44.9	176	175.3	177.8	167.7	177.1	-3.3	111.2	N133 E137 E139	N133-R135 VanDerWaalsContact C-N 3.32Å; N133-R135 PolarHBondContact O-N 2.87Å; N133-R135 PolarHBondContact OD1-N 3.24Å; R135-E137 VanDerWaalsContact C-N 3.35Å; R135-E139 WeakPolarHBondContact O-CB 3.11Å; R135-E139 PolarHBondContact O-N 3.05Å; R135-E139 VanDerWaalsContact O-N 3.08Å
136	T	88.8	Confident	82.9	Confident	21 Å²	21	84.6 Å²	84.6	13%	0.129	42%	0.423	C	S	.	.	H	α-helix	trans	-71.6	-31.7	178.7	-61.5	0	0	0	0	111.5	N133 E139 L140 Y281	N133-T136 PolarHBondContact O-N 3.08Å; N133-T136 VanDerWaalsContact O-N 3.16Å; N133-T136 PolarHBondContact OD1-N 3.34Å; T136-E139 WeakPolarHBondContact O-CB 3.28Å; T136-E139 PolarHBondContact O-N 2.89Å; T136-L140 HydrophobicContact CG2-CD1 3.75Å; T136-L140 HydrophobicContact CG2-CG 4.26Å; T136-L140 WeakPolarHBondContact O-CB 3.38Å; T136-L140 VanDerWaalsContact O-CG 3.3Å; T136-L140 WeakPolarHBondContact O-CG 3.33Å; T136-L140 PolarHBondContact O-N 3.37Å; T136-Y281 HydrophobicContact CG2-CD2 4.12Å; T136-Y281 HydrophobicContact CG2-CE2 3.91Å
137	E	90.6	Very high	81.5	Confident	23 Å²	23	84.9 Å²	84.9	11%	0.107	43%	0.427	C	S	.	.	H	α-helix	trans	-65.1	-47.8	173.8	-151.4	175	99.6	0	0	111.5	R132 N133 E134 R135 E139 L140 F141 L190 Y281	R132-E137 WeakPolarHBondContact CG-OE2 3.39Å; R132-E137 IonicContact CZ-OE1 3.63Å; R132-E137 IonicContact CZ-OE2 2.71Å; R132-E137 IonicContact NE-OE1 3.53Å; R132-E137 PolarHBondContact NE-OE1 3.27Å; R132-E137 VanDerWaalsContact NE-OE1 3.16Å; R132-E137 IonicContact NE-OE2 2.72Å; R132-E137 PolarHBondContact NE-OE2 2.94Å; R132-E137 IonicContact NH2-OE1 2.77Å; R132-E137 PolarHBondContact NH2-OE1 3.46Å; R132-E137 IonicContact NH2-OE2 3.15Å; N133-E137 PolarHBondContact O-N 3.47Å; E134-E137 PolarHBondContact O-N 3.07Å; R135-E137 VanDerWaalsContact C-N 3.35Å; E137-E139 PolarHBondContact O-N 2.87Å; E137-L140 PolarHBondContact O-N 3.45Å; E137-F141 HydrophobicContact CG-CD2 3.78Å; E137-F141 HydrophobicContact CG-CE2 4.24Å; E137-F141 WeakPolarHBondContact O-CD2 3.42Å; E137-F141 PolarHBondContact O-N 3.35Å; E137-L190 HydrophobicContact CG-CD1 4.29Å; E137-L190 HydrophobicContact CG-CD2 4.34Å; E137-Y281 HydrophobicContact CB-CE1 4.29Å; E137-Y281 HydrophobicContact CG-CE1 3.85Å; E137-Y281 PolarHBondContact OE2-OH 3.06Å
138	Q	87.3	Confident	80	Confident	140 Å²	140	90 Å²	90	65%	0.654	45%	0.45	S	S	*	.	H	α-helix	trans	-66.2	-20.4	174.8	-69.2	174.8	12.5	0	0	113.7	E134 K142	E134-Q138 WeakPolarHBondContact O-CB 3.49Å; E134-Q138 VanDerWaalsContact O-CG 3.31Å; E134-Q138 WeakPolarHBondContact O-CG 3.36Å; E134-Q138 PolarHBondContact O-N 3.49Å; Q138-K142 WeakPolarHBondContact O-CE 3.49Å; Q138-K142 WeakPolarHBondContact O-CG 3.37Å
139	E	87	Confident	78.8	Confident	85 Å²	85	85.8 Å²	85.8	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-77.4	-49.4	173.3	-171.9	-174.3	122.1	0	0	111.1	R135 T136 E137 R277	R135-E139 WeakPolarHBondContact O-CB 3.11Å; R135-E139 PolarHBondContact O-N 3.05Å; R135-E139 VanDerWaalsContact O-N 3.08Å; T136-E139 WeakPolarHBondContact O-CB 3.28Å; T136-E139 PolarHBondContact O-N 2.89Å; E137-E139 PolarHBondContact O-N 2.87Å; E139-R277 IonicContact OE1-CZ 3.76Å; E139-R277 IonicContact OE1-NH1 3.29Å; E139-R277 IonicContact OE1-NH2 2.77Å; E139-R277 PolarHBondContact OE1-NH2 3.33Å
140	L	88.2	Confident	77.7	Confident	15 Å²	15	85.2 Å²	85.2	8%	0.079	43%	0.428	C	S	.	.	H	α-helix	trans	-79.6	-40.9	-172.3	-68.7	174.4	0	0	0	113.9	T136 E137 R277 K278 Y281	T136-L140 HydrophobicContact CG2-CD1 3.75Å; T136-L140 HydrophobicContact CG2-CG 4.26Å; T136-L140 WeakPolarHBondContact O-CB 3.38Å; T136-L140 VanDerWaalsContact O-CG 3.3Å; T136-L140 WeakPolarHBondContact O-CG 3.33Å; T136-L140 PolarHBondContact O-N 3.37Å; E137-L140 PolarHBondContact O-N 3.45Å; L140-R277 HydrophobicContact CD2-CB 3.72Å; L140-K278 HydrophobicContact CB-CG 4.05Å; L140-K278 HydrophobicContact CD2-CG 4.39Å; L140-K278 VanDerWaalsContact O-CE 3.3Å; L140-K278 WeakPolarHBondContact O-CE 3.41Å; L140-Y281 HydrophobicContact CD1-CD2 3.91Å; L140-Y281 HydrophobicContact CD1-CG 4.3Å
141	F	87.3	Confident	76.7	Confident	27 Å²	27	88.6 Å²	88.6	12%	0.118	45%	0.447	C	S	.	.			trans	-104.7	37.5	-169.3	-58.7	-77.9	0	0	0	113.3	E137 K143 N187 L190 A191 K278 Y281	E137-F141 HydrophobicContact CG-CD2 3.78Å; E137-F141 HydrophobicContact CG-CE2 4.24Å; E137-F141 WeakPolarHBondContact O-CD2 3.42Å; E137-F141 PolarHBondContact O-N 3.35Å; F141-K143 PolarHBondContact O-N 2.98Å; F141-N187 WeakPolarHBondContact CE1-O 3.29Å; F141-N187 HydrophobicContact CZ-CB 4.4Å; F141-L190 VanDerWaalsContact CD1-C 3.48Å; F141-L190 HydrophobicContact CD1-CB 3.73Å; F141-L190 WeakPolarHBondContact CD1-O 3.17Å; F141-L190 HydrophobicContact CD2-CB 4.16Å; F141-L190 HydrophobicContact CD2-CD1 4.38Å; F141-L190 HydrophobicContact CE1-CB 3.68Å; F141-L190 HydrophobicContact CE2-CB 4.13Å; F141-L190 HydrophobicContact CE2-CD1 3.95Å; F141-L190 HydrophobicContact CG-CB 3.96Å; F141-L190 HydrophobicContact CZ-CB 3.89Å; F141-L190 HydrophobicContact CZ-CD1 4.15Å; F141-A191 HydrophobicContact CD1-CB 4.34Å; F141-A191 HydrophobicContact CE1-CB 4.35Å; F141-K278 HydrophobicContact CE1-CB 3.89Å; F141-K278 HydrophobicContact CE1-CG 4.3Å; F141-K278 HydrophobicContact CZ-CB 4.21Å; F141-K278 WeakPolarHBondContact CZ-O 3.44Å; F141-Y281 AromaticContact CE2-CD1 3.61Å; F141-Y281 HydrophobicContact CE2-CD1 3.61Å; F141-Y281 HydrophobicContact CE2-CE1 4.18Å; F141-Y281 AromaticContact CE2-CG 3.91Å; F141-Y281 HydrophobicContact CE2-CG 3.91Å; F141-Y281 HydrophobicContact CZ-CD1 4.14Å; F141-Y281 HydrophobicContact CZ-CG 4.35Å
142	K	73.6	Confident	75.6	Confident	156 Å²	156	87.5 Å²	87.5	68%	0.678	43%	0.432	S	S	*	.			trans	-64.3	129.4	172.4	-66.2	-175.2	-179.4	175.8	0	110	Q138 V144	Q138-K142 WeakPolarHBondContact O-CE 3.49Å; Q138-K142 WeakPolarHBondContact O-CG 3.37Å; K142-V144 PolarHBondContact O-N 2.98Å
143	K	59.5	Low	74.5	Confident	181 Å²	181	81.7 Å²	81.7	79%	0.787	41%	0.41	S	S	*	.			trans	-58.6	123.3	-175.3	-66.1	-168.4	174.7	-166.7	0	111.8	F141	F141-K143 PolarHBondContact O-N 2.98Å
144	V	58.1	Low	73.6	Confident	106 Å²	106	82.3 Å²	82.3	64%	0.642	41%	0.413	S	S	*	.			trans	-113.2	119.7	160.2	179.6	0	0	0	0	106	K142	K142-V144 PolarHBondContact O-N 2.98Å
145	S	56.3	Low	72.9	Confident	99 Å²	99	83.4 Å²	83.4	69%	0.692	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-74.1	136.7	-179.2	-56	0	0	0	0	111.1
146	A	58.7	Low	72.3	Confident	64 Å²	64	77.2 Å²	77.2	53%	0.529	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-66.3	146.7	164.8	0	0	0	0	0	110.2	F150 V525	A146-F150 HydrophobicContact CB-CD1 4.4Å; A146-F150 HydrophobicContact CB-CG 4.49Å; A146-V525 HydrophobicContact CB-CG1 4.45Å
147	G	58.7	Low	72	Confident	8 Å²	8	80.8 Å²	80.8	8%	0.082	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-84.7	161.2	-178.7	0	0	0	0	0	113.7	N149 F150 V525 G526 N527	G147-N149 VanDerWaalsContact C-N 3.25Å; G147-N149 PolarHBondContact O-N 2.74Å; G147-N149 VanDerWaalsContact O-N 3.16Å; G147-F150 WeakPolarHBondContact O-CB 3.24Å; G147-F150 PolarHBondContact O-N 3.03Å; G147-V525 WeakPolarHBondContact CA-O 3.13Å; G147-V525 PolarHBondContact N-O 3.5Å; G147-G526 CarbonylContact C-O 3.56Å; G147-G526 VanDerWaalsContact C-O 3.25Å; G147-G526 WeakPolarHBondContact CA-O 3.43Å; G147-N527 WeakPolarHBondContact CA-OD1 3.44Å
148	I	59.6	Low	71.8	Confident	162 Å²	162	81.5 Å²	81.5	83%	0.831	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-54.3	-39.1	-172.3	-59.3	169.2	0	0	0	112.3	F150 G526	I148-F150 VanDerWaalsContact C-N 3.25Å; I148-F150 PolarHBondContact O-N 3.16Å; I148-G526 PolarHBondContact N-O 3.01Å
149	N	63.6	Low	71.8	Confident	29 Å²	29	79.2 Å²	79.2	16%	0.155	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-84.7	14.1	-176.4	-68.1	-1.2	0	0	0	113.7	G147 N151 Q152 N404 G526 L528	G147-N149 VanDerWaalsContact C-N 3.25Å; G147-N149 PolarHBondContact O-N 2.74Å; G147-N149 VanDerWaalsContact O-N 3.16Å; N149-N151 PolarHBondContact O-N 3.46Å; N149-N151 VanDerWaalsContact O-N 3.08Å; N149-Q152 HydrophobicContact CB-CG 4.21Å; N149-Q152 PolarHBondContact ND2-OE1 2.88Å; N149-Q152 WeakPolarHBondContact O-CB 3.48Å; N149-Q152 PolarHBondContact O-N 2.89Å; N149-N404 WeakPolarHBondContact CB-OD1 3.47Å; N149-N404 PolarHBondContact ND2-OD1 2.74Å; N149-G526 WeakPolarHBondContact CB-O 3.44Å; N149-G526 PolarHBondContact N-O 3.08Å; N149-L528 WeakPolarHBondContact ND2-CD2 3.45Å
150	F	67	Low	71.9	Confident	34 Å²	34	75.6 Å²	75.6	15%	0.149	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-58	-26.5	179.6	-164.9	-131.1	0	0	0	112.9	A146 G147 I148 Q152 Y153 R195 T197 V525	A146-F150 HydrophobicContact CB-CD1 4.4Å; A146-F150 HydrophobicContact CB-CG 4.49Å; G147-F150 WeakPolarHBondContact O-CB 3.24Å; G147-F150 PolarHBondContact O-N 3.03Å; I148-F150 VanDerWaalsContact C-N 3.25Å; I148-F150 PolarHBondContact O-N 3.16Å; F150-Q152 VanDerWaalsContact C-N 3.32Å; F150-Q152 PolarHBondContact O-N 3.32Å; F150-Y153 HydrophobicContact CD2-CD2 4.11Å; F150-Y153 HydrophobicContact CD2-CE2 4.35Å; F150-Y153 PolarHBondContact O-N 3.08Å; F150-R195 VanDerWaalsContact C-NH2 3.29Å; F150-R195 VanDerWaalsContact CD1-NH2 3.27Å; F150-R195 HydrophobicContact CE1-CG 3.85Å; F150-R195 PolarHBondContact O-NH2 3.1Å; F150-T197 HydrophobicContact CE2-CG2 3.92Å; F150-T197 HydrophobicContact CZ-CG2 4.01Å; F150-V525 HydrophobicContact CD2-CG1 4.37Å; F150-V525 HydrophobicContact CE2-CG1 4.34Å
151	N	70.2	Confident	72.1	Confident	110 Å²	110	76.1 Å²	76.1	59%	0.588	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-65.1	-28.2	172.3	-72.8	-18.2	0	0	0	114.3	N149 Y153 D154 R195	N149-N151 PolarHBondContact O-N 3.46Å; N149-N151 VanDerWaalsContact O-N 3.08Å; N151-Y153 PolarHBondContact O-N 3.45Å; N151-D154 PolarHBondContact O-N 2.89Å; N151-R195 PolarHBondContact OD1-NH1 2.98Å; N151-R195 VanDerWaalsContact OD1-NH1 3.08Å; N151-R195 PolarHBondContact OD1-NH2 3.35Å
152	Q	68.5	Low	72.1	Confident	88 Å²	88	76.1 Å²	76.1	41%	0.411	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-71.2	-20.2	-177.8	-62.5	176.7	-4.1	0	0	112.3	N149 F150 D154 N155	N149-Q152 HydrophobicContact CB-CG 4.21Å; N149-Q152 PolarHBondContact ND2-OE1 2.88Å; N149-Q152 WeakPolarHBondContact O-CB 3.48Å; N149-Q152 PolarHBondContact O-N 2.89Å; F150-Q152 VanDerWaalsContact C-N 3.32Å; F150-Q152 PolarHBondContact O-N 3.32Å; Q152-D154 PolarHBondContact O-N 2.85Å; Q152-N155 WeakPolarHBondContact O-CB 3.24Å; Q152-N155 PolarHBondContact O-N 2.85Å; Q152-N155 VanDerWaalsContact O-N 3.14Å
153	Y	70.2	Confident	72.6	Confident	16 Å²	16	71 Å²	71	6%	0.063	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31.3	176.6	-76.4	-104.6	0	0	0	112.2	F150 N151 N155 I156 P198 V525 G526	F150-Y153 HydrophobicContact CD2-CD2 4.11Å; F150-Y153 HydrophobicContact CD2-CE2 4.35Å; F150-Y153 PolarHBondContact O-N 3.08Å; N151-Y153 PolarHBondContact O-N 3.45Å; Y153-N155 PolarHBondContact O-N 3.06Å; Y153-I156 HydrophobicContact CD1-CD1 3.74Å; Y153-I156 HydrophobicContact CE1-CD1 4.38Å; Y153-I156 HydrophobicContact CG-CD1 4.11Å; Y153-I156 WeakPolarHBondContact O-CB 3.33Å; Y153-I156 WeakPolarHBondContact O-CG1 3.37Å; Y153-I156 PolarHBondContact O-N 2.84Å; Y153-P198 WeakPolarHBondContact O-CG 3.38Å; Y153-V525 PolarHBondContact OH-N 3.43Å; Y153-G526 PolarHBondContact OH-N 3.34Å
154	D	72.9	Confident	73.5	Confident	67 Å²	67	70 Å²	70	36%	0.358	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-67.2	-14.1	179.1	-71.3	-45.5	0	0	0	113.3	N151 Q152 R195 K201	N151-D154 PolarHBondContact O-N 2.89Å; Q152-D154 PolarHBondContact O-N 2.85Å; D154-R195 IonicContact OD2-CZ 2.6Å; D154-R195 IonicContact OD2-NE 3.04Å; D154-R195 IonicContact OD2-NH1 2.59Å; D154-R195 PolarHBondContact OD2-NH1 3.4Å; D154-K201 IonicContact OD1-NZ 2.83Å; D154-K201 PolarHBondContact OD1-NZ 2.89Å
155	N	75.3	Confident	74.4	Confident	137 Å²	137	66.7 Å²	66.7	73%	0.733	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-89.8	-8.9	173.6	-62.5	-27.1	0	0	0	113.6	Q152 Y153 P157	Q152-N155 WeakPolarHBondContact O-CB 3.24Å; Q152-N155 PolarHBondContact O-N 2.85Å; Q152-N155 VanDerWaalsContact O-N 3.14Å; Y153-N155 PolarHBondContact O-N 3.06Å; N155-P157 WeakPolarHBondContact O-CD 3.48Å
156	I	76.4	Confident	75.2	Confident	53 Å²	53	66.7 Å²	66.7	27%	0.272	38%	0.376	S	S	.	.	S	Bend	trans	-69.7	121.7	-176.9	-63.5	174.5	0	0	0	108.7	Y153 V158 V395 G396	Y153-I156 HydrophobicContact CD1-CD1 3.74Å; Y153-I156 HydrophobicContact CE1-CD1 4.38Å; Y153-I156 HydrophobicContact CG-CD1 4.11Å; Y153-I156 WeakPolarHBondContact O-CB 3.33Å; Y153-I156 WeakPolarHBondContact O-CG1 3.37Å; Y153-I156 PolarHBondContact O-N 2.84Å; I156-V158 PolarHBondContact O-N 2.84Å; I156-V395 HydrophobicContact CG2-CG1 3.99Å; I156-G396 VanDerWaalsContact CG2-N 3.33Å
157	P	82.8	Confident	75.6	Confident	97 Å²	97	66.8 Å²	66.8	63%	0.63	37%	0.367	S	S	*	.			trans	-65.8	127.3	-177.9	26.4	-34	0	0	0	110.4	N155 G396	N155-P157 WeakPolarHBondContact O-CD 3.48Å; P157-G396 WeakPolarHBondContact O-CA 3.48Å; P157-G396 PolarHBondContact O-N 2.89Å
158	V	85.8	Confident	75.7	Confident	37 Å²	37	72 Å²	72	22%	0.224	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	142.7	173	-173.7	0	0	0	0	109.1	I156 P198 L393 T394 V395	I156-V158 PolarHBondContact O-N 2.84Å; V158-P198 HydrophobicContact CG2-CB 3.83Å; V158-L393 HydrophobicContact CG1-CD1 3.48Å; V158-L393 VanDerWaalsContact CG1-CD1 3.48Å; V158-T394 WeakPolarHBondContact CA-O 3.38Å; V158-V395 HydrophobicContact CG1-CG2 4.06Å; V158-V395 HydrophobicContact CG2-CG1 4.24Å; V158-V395 HydrophobicContact CG2-CG2 4.16Å
159	N	88.7	Confident	75.8	Confident	92 Å²	92	68 Å²	68	49%	0.492	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	127.5	173.4	-173.2	-6.9	0	0	0	108.8	T161 T394	N159-T161 WeakPolarHBondContact OD1-CG2 3.39Å; N159-T394 PolarHBondContact N-O 3.08Å; N159-T394 PolarHBondContact O-N 2.64Å; N159-T394 PolarHBondContact O-OG1 3.48Å
160	A	89.2	Confident	76.1	Confident	9 Å²	9	67.8 Å²	67.8	7%	0.074	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.4	-178	0	0	0	0	0	109.2	F165 I391 F392 L393	A160-F165 HydrophobicContact CB-CD1 4.21Å; A160-F165 HydrophobicContact CB-CE1 3.37Å; A160-F165 HydrophobicContact CB-CE2 4.37Å; A160-F165 HydrophobicContact CB-CZ 3.47Å; A160-F165 VanDerWaalsContact CB-CZ 3.47Å; A160-F165 WeakPolarHBondContact O-CD1 3.39Å; A160-F165 WeakPolarHBondContact O-CE1 3.29Å; A160-I391 HydrophobicContact CB-CG2 4.37Å; A160-F392 CarbonylContact C-O 3.45Å; A160-F392 WeakPolarHBondContact CA-O 3.5Å; A160-L393 HydrophobicContact CB-CD1 3.84Å
161	T	91	Very high	76.8	Confident	27 Å²	27	69 Å²	69	17%	0.166	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	136.5	-172.9	68.9	0	0	0	0	111.7	N159 F392 R590 Q591	N159-T161 WeakPolarHBondContact OD1-CG2 3.39Å; T161-F392 PolarHBondContact N-O 2.91Å; T161-F392 PolarHBondContact O-N 3.42Å; T161-R590 PolarHBondContact O-NH2 3.18Å; T161-Q591 PolarHBondContact OG1-NE2 3.14Å
162	G	87.5	Confident	77.7	Confident	27 Å²	27	64.6 Å²	64.6	28%	0.278	38%	0.381	S	S	.	.			trans	171.6	169.4	177.5	0	0	0	0	0	113.1	N164 F165	G162-N164 PolarHBondContact O-N 3.38Å; G162-F165 WeakPolarHBondContact O-CB 3.48Å; G162-F165 PolarHBondContact O-N 3.3Å
163	P	84.2	Confident	78.6	Confident	47 Å²	47	64 Å²	64	31%	0.305	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	134.1	179	22.9	-30.5	0	0	0	111.1	F165 R211 N389	P163-F165 PolarHBondContact O-N 3.06Å; P163-F165 VanDerWaalsContact O-N 3.13Å; P163-R211 PolarHBondContact O-NH1 2.55Å; P163-R211 PolarHBondContact O-NH2 2.74Å; P163-N389 WeakPolarHBondContact CG-OD1 3.49Å
164	N	79.1	Confident	79.5	Confident	160 Å²	160	64.5 Å²	64.5	86%	0.856	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	27.7	-177.5	-55.9	-13.3	0	0	0	114.3	G162	G162-N164 PolarHBondContact O-N 3.38Å
165	F	77.6	Confident	80.2	Confident	38 Å²	38	62 Å²	62	17%	0.167	38%	0.379	C	S	.	.			trans	-87.1	128.4	173.6	-173.2	-103.1	0	0	0	110.4	A160 G162 P163 D167 I206 I391	A160-F165 HydrophobicContact CB-CD1 4.21Å; A160-F165 HydrophobicContact CB-CE1 3.37Å; A160-F165 HydrophobicContact CB-CE2 4.37Å; A160-F165 HydrophobicContact CB-CZ 3.47Å; A160-F165 VanDerWaalsContact CB-CZ 3.47Å; A160-F165 WeakPolarHBondContact O-CD1 3.39Å; A160-F165 WeakPolarHBondContact O-CE1 3.29Å; G162-F165 WeakPolarHBondContact O-CB 3.48Å; G162-F165 PolarHBondContact O-N 3.3Å; P163-F165 PolarHBondContact O-N 3.06Å; P163-F165 VanDerWaalsContact O-N 3.13Å; F165-D167 HydrophobicContact CD1-CB 4.44Å; F165-D167 HydrophobicContact CE1-CB 3.69Å; F165-D167 WeakPolarHBondContact CE1-OD1 3.34Å; F165-D167 HydrophobicContact CZ-CB 4.4Å; F165-I206 HydrophobicContact CE2-CD1 3.87Å; F165-I206 HydrophobicContact CE2-CG1 3.84Å; F165-I206 HydrophobicContact CZ-CD1 4.39Å; F165-I391 HydrophobicContact CB-CD1 3.83Å; F165-I391 HydrophobicContact CD2-CD1 3.88Å; F165-I391 HydrophobicContact CD2-CG1 4.04Å; F165-I391 HydrophobicContact CD2-CG2 4.02Å; F165-I391 HydrophobicContact CE2-CG2 4.22Å; F165-I391 HydrophobicContact CG-CD1 4.15Å; F165-I391 HydrophobicContact CG-CG2 4.36Å
166	N	72.3	Confident	80.8	Confident	99 Å²	99	61.2 Å²	61.2	53%	0.529	38%	0.379	S	S	.	.			trans	-123.3	105.9	172.6	-175.5	8.6	0	0	0	108.6	S168 A169 S170	N166-S168 VanDerWaalsContact C-N 3.34Å; N166-S168 PolarHBondContact O-N 3.33Å; N166-A169 HydrophobicContact CB-CB 4.39Å; N166-A169 PolarHBondContact O-N 3.12Å; N166-S170 WeakPolarHBondContact O-CB 3.39Å; N166-S170 PolarHBondContact O-N 2.86Å; N166-S170 PolarHBondContact O-OG 2.99Å
167	D	66.5	Low	81.2	Confident	66 Å²	66	63.5 Å²	63.5	35%	0.353	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-60.6	-42.6	-168.8	-158.4	30.1	0	0	0	111.9	F165 A169 S170 T171 H202	F165-D167 HydrophobicContact CD1-CB 4.44Å; F165-D167 HydrophobicContact CE1-CB 3.69Å; F165-D167 WeakPolarHBondContact CE1-OD1 3.34Å; F165-D167 HydrophobicContact CZ-CB 4.4Å; D167-A169 PolarHBondContact O-N 3.05Å; D167-A169 VanDerWaalsContact O-N 3.07Å; D167-S170 PolarHBondContact O-N 3.25Å; D167-T171 PolarHBondContact O-OG1 2.86Å; D167-H202 IonicContact OD1-CE1 3.33Å; D167-H202 IonicContact OD1-ND1 2.69Å
168	S	61.8	Low	81.4	Confident	116 Å²	116	60.1 Å²	60.1	81%	0.811	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-65.1	-10.4	177.6	-46	0	0	0	0	115	N166	N166-S168 VanDerWaalsContact C-N 3.34Å; N166-S168 PolarHBondContact O-N 3.33Å
169	A	60.5	Low	81.6	Confident	78 Å²	78	62.8 Å²	62.8	65%	0.645	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-114.5	-2.5	177	0	0	0	0	0	112.9	N166 D167	N166-A169 HydrophobicContact CB-CB 4.39Å; N166-A169 PolarHBondContact O-N 3.12Å; D167-A169 PolarHBondContact O-N 3.05Å; D167-A169 VanDerWaalsContact O-N 3.07Å
170	S	71	Confident	81.7	Confident	26 Å²	26	59.5 Å²	59.5	18%	0.182	37%	0.367	C	S	.	.	S	Bend	trans	-125.2	23.5	-167.5	-49.3	0	0	0	0	112.7	N166 D167 P205	N166-S170 WeakPolarHBondContact O-CB 3.39Å; N166-S170 PolarHBondContact O-N 2.86Å; N166-S170 PolarHBondContact O-OG 2.99Å; D167-S170 PolarHBondContact O-N 3.25Å; S170-P205 WeakPolarHBondContact O-CG 3.3Å
171	T	82.2	Confident	81.9	Confident	59 Å²	59	61.1 Å²	61.1	36%	0.362	37%	0.373	S	S	.	.			trans	-130.8	146.5	-177.3	41.7	0	0	0	0	110.5	D167 K201 H202	D167-T171 PolarHBondContact O-OG1 2.86Å; T171-K201 WeakPolarHBondContact CA-O 3.22Å; T171-H202 WeakPolarHBondContact CG2-CE1 3.1Å; T171-H202 VanDerWaalsContact CG2-ND1 3.31Å; T171-H202 WeakPolarHBondContact CG2-ND1 3.38Å
172	I	88.6	Confident	82.1	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.087	39%	0.387	C	S	.	.			trans	-120	148.5	174.6	61.6	174.6	0	0	0	111.1	E177 L178 P196 K201 P205	I172-E177 WeakPolarHBondContact CA-OE2 3.43Å; I172-E177 WeakPolarHBondContact CB-OE2 3.46Å; I172-E177 HydrophobicContact CG2-CB 4.26Å; I172-L178 HydrophobicContact CD1-CD1 3.63Å; I172-L178 HydrophobicContact CD1-CD2 4.01Å; I172-L178 HydrophobicContact CD1-CG 3.73Å; I172-L178 HydrophobicContact CG2-CD2 4.02Å; I172-L178 HydrophobicContact CG2-CG 4.34Å; I172-P196 HydrophobicContact CD1-CG 4.3Å; I172-P196 HydrophobicContact CG1-CG 4.37Å; I172-K201 PolarHBondContact N-O 3.43Å; I172-K201 WeakPolarHBondContact O-CB 3.27Å; I172-K201 VanDerWaalsContact O-CG 3.26Å; I172-K201 WeakPolarHBondContact O-CG 3.36Å; I172-P205 HydrophobicContact CG2-CG 4.29Å
173	S	86.6	Confident	82.4	Confident	75 Å²	75	63.4 Å²	63.4	52%	0.524	37%	0.373	S	S	.	.	S	Bend	trans	-89.6	-34.3	168.3	92.8	0	0	0	0	112	E177 P196	S173-E177 WeakPolarHBondContact CB-OE1 3.32Å; S173-E177 PolarHBondContact N-OE2 2.92Å; S173-E177 PolarHBondContact OG-OE1 3.05Å; S173-P196 WeakPolarHBondContact O-CD 3.49Å; S173-P196 WeakPolarHBondContact O-CG 3.34Å
174	S	89	Confident	82.9	Confident	28 Å²	28	61.2 Å²	61.2	20%	0.196	36%	0.359	C	S	.	.	S	Bend	trans	-138.1	151.7	-171.5	175.3	0	0	0	0	112.2	T176 E177	S174-T176 WeakPolarHBondContact CB-OG1 3.27Å; S174-T176 PolarHBondContact O-N 2.88Å; S174-T176 PolarHBondContact OG-N 3.28Å; S174-T176 VanDerWaalsContact OG-N 3.14Å; S174-T176 PolarHBondContact OG-OG1 2.9Å; S174-E177 PolarHBondContact N-OE1 3.16Å; S174-E177 PolarHBondContact O-N 3.37Å
175	F	88.1	Confident	83.6	Confident	15 Å²	15	58.7 Å²	58.7	7%	0.066	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21.9	170.4	-66.4	-69	0	0	0	113.1	E177 L178 V188 Y193 P196 I204 I229	F175-E177 VanDerWaalsContact C-N 3.27Å; F175-E177 PolarHBondContact O-N 2.89Å; F175-L178 HydrophobicContact CD1-CD1 4.31Å; F175-L178 PolarHBondContact O-N 3.29Å; F175-V188 HydrophobicContact CB-CG1 4.47Å; F175-V188 HydrophobicContact CD1-CG1 4.4Å; F175-V188 HydrophobicContact CD2-CG1 4.08Å; F175-V188 HydrophobicContact CE2-CG1 4.39Å; F175-V188 HydrophobicContact CG-CG1 4.08Å; F175-Y193 WeakPolarHBondContact CD2-O 3.47Å; F175-Y193 WeakPolarHBondContact CE2-O 3.42Å; F175-Y193 HydrophobicContact CZ-CD2 4.28Å; F175-P196 HydrophobicContact CD1-CB 4.43Å; F175-P196 HydrophobicContact CE1-CB 3.95Å; F175-P196 HydrophobicContact CE2-CB 4.16Å; F175-P196 VanDerWaalsContact CE2-N 3.34Å; F175-P196 HydrophobicContact CZ-CB 3.81Å; F175-I204 HydrophobicContact CD1-CD1 4.39Å; F175-I204 HydrophobicContact CE1-CD1 3.82Å; F175-I229 HydrophobicContact CE1-CD1 3.98Å
176	T	87	Confident	84.4	Confident	119 Å²	119	58 Å²	58	73%	0.73	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-72.3	-16.2	179.3	56.8	0	0	0	0	114.1	S174 L178	S174-T176 WeakPolarHBondContact CB-OG1 3.27Å; S174-T176 PolarHBondContact O-N 2.88Å; S174-T176 PolarHBondContact OG-N 3.28Å; S174-T176 VanDerWaalsContact OG-N 3.14Å; S174-T176 PolarHBondContact OG-OG1 2.9Å; T176-L178 VanDerWaalsContact C-N 3.33Å
177	E	86.9	Confident	85.4	Confident	102 Å²	102	53.3 Å²	53.3	48%	0.477	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-80.1	-18.7	176.9	-66.8	162.1	-165	0	0	112.2	I172 S173 S174 F175	I172-E177 WeakPolarHBondContact CA-OE2 3.43Å; I172-E177 WeakPolarHBondContact CB-OE2 3.46Å; I172-E177 HydrophobicContact CG2-CB 4.26Å; S173-E177 WeakPolarHBondContact CB-OE1 3.32Å; S173-E177 PolarHBondContact N-OE2 2.92Å; S173-E177 PolarHBondContact OG-OE1 3.05Å; S174-E177 PolarHBondContact N-OE1 3.16Å; S174-E177 PolarHBondContact O-N 3.37Å; F175-E177 VanDerWaalsContact C-N 3.27Å; F175-E177 PolarHBondContact O-N 2.89Å
178	L	86.8	Confident	86.7	Confident	26 Å²	26	50.4 Å²	50.4	14%	0.136	30%	0.295	C	S	.	.	S	Bend	trans	-79.1	139.2	178.1	-66	168	0	0	0	111.1	I172 F175 T176 L180 I204	I172-L178 HydrophobicContact CD1-CD1 3.63Å; I172-L178 HydrophobicContact CD1-CD2 4.01Å; I172-L178 HydrophobicContact CD1-CG 3.73Å; I172-L178 HydrophobicContact CG2-CD2 4.02Å; I172-L178 HydrophobicContact CG2-CG 4.34Å; F175-L178 HydrophobicContact CD1-CD1 4.31Å; F175-L178 PolarHBondContact O-N 3.29Å; T176-L178 VanDerWaalsContact C-N 3.33Å; L178-L180 HydrophobicContact CB-CD1 4.41Å; L178-L180 HydrophobicContact CB-CD2 4.19Å; L178-L180 HydrophobicContact CB-CG 3.77Å; L178-L180 HydrophobicContact CD1-CD1 4.34Å; L178-L180 HydrophobicContact CD1-CD2 4.3Å; L178-L180 HydrophobicContact CD1-CG 4.32Å; L178-L180 PolarHBondContact O-N 3.04Å; L178-I204 HydrophobicContact CD1-CB 4.38Å; L178-I204 HydrophobicContact CD1-CG2 3.47Å; L178-I204 VanDerWaalsContact CD1-CG2 3.47Å; L178-I204 HydrophobicContact CD2-CG2 3.86Å; L178-I204 HydrophobicContact CG-CG2 4.32Å
179	S	89.1	Confident	88.1	Confident	93 Å²	93	50.4 Å²	50.4	65%	0.65	28%	0.282	S	S	*	.			trans	-74.9	56.4	169.5	62.7	0	0	0	0	112.1	N233 K237	S179-N233 PolarHBondContact O-ND2 2.67Å; S179-K237 VanDerWaalsContact O-CE 3.31Å; S179-K237 WeakPolarHBondContact O-CE 3.04Å; S179-K237 PolarHBondContact O-NZ 3.16Å; S179-K237 PolarHBondContact OG-NZ 3.09Å
180	L	91.4	Very high	89.5	Confident	23 Å²	23	49 Å²	49	12%	0.12	26%	0.264	C	S	.	.			trans	-69	135.8	177	-64.7	-179.2	0	0	0	111	L178 V184 R185 I229 N233	L178-L180 HydrophobicContact CB-CD1 4.41Å; L178-L180 HydrophobicContact CB-CD2 4.19Å; L178-L180 HydrophobicContact CB-CG 3.77Å; L178-L180 HydrophobicContact CD1-CD1 4.34Å; L178-L180 HydrophobicContact CD1-CD2 4.3Å; L178-L180 HydrophobicContact CD1-CG 4.32Å; L178-L180 PolarHBondContact O-N 3.04Å; L180-V184 HydrophobicContact CD1-CG1 4.49Å; L180-V184 HydrophobicContact CD2-CG1 4.3Å; L180-R185 HydrophobicContact CB-CB 4.17Å; L180-I229 HydrophobicContact CD1-CG2 4.17Å; L180-I229 HydrophobicContact CD2-CG2 3.74Å; L180-N233 HydrophobicContact CD2-CB 4.15Å
181	H	93.5	Very high	90.4	Very high	42 Å²	42	48.8 Å²	48.8	19%	0.194	26%	0.263	C	S	.	.			trans	-63.4	145.1	168.3	-175.5	-98.2	0	0	0	110.2	T127 I183 V184 R185 N233 I236	T127-H181 PolarHBondContact O-CE1 3.33Å; H181-I183 VanDerWaalsContact C-N 3.28Å; H181-I183 PolarHBondContact ND1-N 3Å; H181-I183 PolarHBondContact O-N 2.53Å; H181-I183 VanDerWaalsContact O-N 3.09Å; H181-V184 PolarHBondContact O-N 3.23Å; H181-R185 PolarHBondContact O-N 3.43Å; H181-R185 VanDerWaalsContact O-N 3.13Å; H181-N233 WeakPolarHBondContact CB-OD1 3.34Å; H181-N233 PolarHBondContact N-OD1 2.9Å; H181-I236 HydrophobicContact CB-CG2 4.17Å; H181-I236 WeakPolarHBondContact ND1-CG2 3.44Å
182	K	93.9	Very high	90.6	Very high	103 Å²	103	50.5 Å²	50.5	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-45.6	-49.5	-172.6	-168.3	-160.5	176.8	-149.7	0	112.9	V184 R185 D186	K182-V184 VanDerWaalsContact C-N 3.32Å; K182-V184 PolarHBondContact O-N 3.03Å; K182-R185 PolarHBondContact O-N 2.9Å; K182-D186 WeakPolarHBondContact CE-OD2 3.36Å; K182-D186 WeakPolarHBondContact CG-OD1 3.46Å; K182-D186 IonicContact NZ-OD2 3.69Å; K182-D186 WeakPolarHBondContact O-CB 3.49Å; K182-D186 PolarHBondContact O-N 3.38Å; K182-D186 VanDerWaalsContact O-OD1 3.1Å
183	I	94.8	Very high	90.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-55.2	-45.8	-178.9	-56	166.9	0	0	0	111.8	Q129 H181 N187 I236 Y281	Q129-I183 HydrophobicContact CB-CD1 4.2Å; Q129-I183 HydrophobicContact CB-CG1 3.72Å; Q129-I183 HydrophobicContact CG-CG1 3.91Å; H181-I183 VanDerWaalsContact C-N 3.28Å; H181-I183 PolarHBondContact ND1-N 3Å; H181-I183 PolarHBondContact O-N 2.53Å; H181-I183 VanDerWaalsContact O-N 3.09Å; I183-N187 WeakPolarHBondContact O-CB 3.49Å; I183-N187 PolarHBondContact O-N 3.24Å; I183-N187 VanDerWaalsContact O-N 3.11Å; I183-N187 PolarHBondContact O-ND2 2.98Å; I183-N187 VanDerWaalsContact O-ND2 3.14Å; I183-I236 HydrophobicContact CB-CD1 4.23Å; I183-I236 HydrophobicContact CD1-CD1 4.33Å; I183-I236 HydrophobicContact CG2-CD1 4.42Å; I183-Y281 WeakPolarHBondContact CG2-O 3.18Å
184	V	94.8	Very high	90.2	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-70.4	-41.7	-178.2	-174.5	0	0	0	0	110.6	L180 H181 K182 N187 V188 I229 N233 I236	L180-V184 HydrophobicContact CD1-CG1 4.49Å; L180-V184 HydrophobicContact CD2-CG1 4.3Å; H181-V184 PolarHBondContact O-N 3.23Å; K182-V184 VanDerWaalsContact C-N 3.32Å; K182-V184 PolarHBondContact O-N 3.03Å; V184-N187 PolarHBondContact O-N 2.69Å; V184-V188 HydrophobicContact CG1-CG2 4.49Å; V184-V188 WeakPolarHBondContact O-CG2 3.26Å; V184-V188 PolarHBondContact O-N 2.77Å; V184-I229 HydrophobicContact CG1-CG2 3.98Å; V184-N233 HydrophobicContact CG2-CB 4.27Å; V184-I236 HydrophobicContact CG2-CD1 3.74Å
185	R	94.1	Very high	90.1	Very high	107 Å²	107	60.6 Å²	60.6	40%	0.404	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-51.7	177.6	-166.4	-160.8	63.3	-138.9	-17.4	111.4	L180 H181 K182 N187 V188 E189	L180-R185 HydrophobicContact CB-CB 4.17Å; H181-R185 PolarHBondContact O-N 3.43Å; H181-R185 VanDerWaalsContact O-N 3.13Å; K182-R185 PolarHBondContact O-N 2.9Å; R185-N187 PolarHBondContact O-N 2.72Å; R185-V188 PolarHBondContact O-N 3.03Å; R185-E189 WeakPolarHBondContact CD-OE1 3.47Å; R185-E189 WeakPolarHBondContact CG-OE1 3.46Å; R185-E189 IonicContact NE-OE1 2.72Å; R185-E189 PolarHBondContact NE-OE1 3.48Å; R185-E189 WeakPolarHBondContact O-CG 3.31Å; R185-E189 PolarHBondContact O-N 3.09Å
186	D	93.4	Very high	90.1	Very high	23 Å²	23	59.9 Å²	59.9	12%	0.123	30%	0.296	C	S	.	.	H	α-helix	trans	-55.7	-35.5	176.7	-64.3	7.9	0	0	0	111.1	Q129 K182 L190	Q129-D186 PolarHBondContact NE2-OD2 3.49Å; K182-D186 WeakPolarHBondContact CE-OD2 3.36Å; K182-D186 WeakPolarHBondContact CG-OD1 3.46Å; K182-D186 IonicContact NZ-OD2 3.69Å; K182-D186 WeakPolarHBondContact O-CB 3.49Å; K182-D186 PolarHBondContact O-N 3.38Å; K182-D186 VanDerWaalsContact O-OD1 3.1Å; D186-L190 VanDerWaalsContact O-CG 3.32Å; D186-L190 WeakPolarHBondContact O-CG 3.5Å; D186-L190 PolarHBondContact O-N 2.95Å
187	N	94.4	Very high	90.2	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-77.1	-29.9	176.8	-68.7	-18.7	0	0	0	114.2	F141 I183 V184 R185 A191 K278 F279 Y281	F141-N187 WeakPolarHBondContact CE1-O 3.29Å; F141-N187 HydrophobicContact CZ-CB 4.4Å; I183-N187 WeakPolarHBondContact O-CB 3.49Å; I183-N187 PolarHBondContact O-N 3.24Å; I183-N187 VanDerWaalsContact O-N 3.11Å; I183-N187 PolarHBondContact O-ND2 2.98Å; I183-N187 VanDerWaalsContact O-ND2 3.14Å; V184-N187 PolarHBondContact O-N 2.69Å; R185-N187 PolarHBondContact O-N 2.72Å; N187-A191 WeakPolarHBondContact O-CB 3.32Å; N187-A191 PolarHBondContact O-N 3.02Å; N187-K278 PolarHBondContact ND2-O 3.07Å; N187-F279 PolarHBondContact ND2-O 2.72Å; N187-Y281 PolarHBondContact ND2-N 3.08Å; N187-Y281 PolarHBondContact ND2-O 3.2Å
188	V	92.3	Very high	90.3	Very high	6 Å²	6	50.3 Å²	50.3	4%	0.036	25%	0.245	C	C	.	.	H	α-helix	trans	-70.9	-37.9	172.1	169.6	0	0	0	0	110.4	F175 V184 R185 A191 N192 Y193 I229 F279	F175-V188 HydrophobicContact CB-CG1 4.47Å; F175-V188 HydrophobicContact CD1-CG1 4.4Å; F175-V188 HydrophobicContact CD2-CG1 4.08Å; F175-V188 HydrophobicContact CE2-CG1 4.39Å; F175-V188 HydrophobicContact CG-CG1 4.08Å; V184-V188 HydrophobicContact CG1-CG2 4.49Å; V184-V188 WeakPolarHBondContact O-CG2 3.26Å; V184-V188 PolarHBondContact O-N 2.77Å; R185-V188 PolarHBondContact O-N 3.03Å; V188-A191 PolarHBondContact O-N 2.77Å; V188-N192 PolarHBondContact O-N 3.38Å; V188-Y193 PolarHBondContact O-N 3.4Å; V188-I229 HydrophobicContact CG2-CD1 3.77Å; V188-I229 HydrophobicContact CG2-CG1 4.07Å; V188-F279 HydrophobicContact CG2-CD1 4.2Å; V188-F279 HydrophobicContact CG2-CE1 4.18Å
189	E	90.9	Very high	90.5	Very high	115 Å²	115	49.1 Å²	49.1	54%	0.537	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-48.3	170.4	-68.3	167.3	-148.4	0	0	111	R185 A191 N192	R185-E189 WeakPolarHBondContact CD-OE1 3.47Å; R185-E189 WeakPolarHBondContact CG-OE1 3.46Å; R185-E189 IonicContact NE-OE1 2.72Å; R185-E189 PolarHBondContact NE-OE1 3.48Å; R185-E189 WeakPolarHBondContact O-CG 3.31Å; R185-E189 PolarHBondContact O-N 3.09Å; E189-A191 VanDerWaalsContact C-N 3.25Å; E189-A191 PolarHBondContact O-N 2.74Å; E189-N192 WeakPolarHBondContact O-CA 3.38Å; E189-N192 PolarHBondContact O-N 2.83Å
190	L	91.5	Very high	90.7	Very high	50 Å²	50	45 Å²	45	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-29.8	174.2	-75.5	171.1	0	0	0	113.5	E137 F141 D186 N192 Y281	E137-L190 HydrophobicContact CG-CD1 4.29Å; E137-L190 HydrophobicContact CG-CD2 4.34Å; F141-L190 VanDerWaalsContact CD1-C 3.48Å; F141-L190 HydrophobicContact CD1-CB 3.73Å; F141-L190 WeakPolarHBondContact CD1-O 3.17Å; F141-L190 HydrophobicContact CD2-CB 4.16Å; F141-L190 HydrophobicContact CD2-CD1 4.38Å; F141-L190 HydrophobicContact CE1-CB 3.68Å; F141-L190 HydrophobicContact CE2-CB 4.13Å; F141-L190 HydrophobicContact CE2-CD1 3.95Å; F141-L190 HydrophobicContact CG-CB 3.96Å; F141-L190 HydrophobicContact CZ-CB 3.89Å; F141-L190 HydrophobicContact CZ-CD1 4.15Å; D186-L190 VanDerWaalsContact O-CG 3.32Å; D186-L190 WeakPolarHBondContact O-CG 3.5Å; D186-L190 PolarHBondContact O-N 2.95Å; L190-N192 PolarHBondContact O-N 3.41Å; L190-N192 PolarHBondContact O-ND2 3.41Å; L190-Y281 HydrophobicContact CD1-CD1 4.07Å; L190-Y281 HydrophobicContact CD1-CE1 4.1Å
191	A	88.4	Confident	90.7	Very high	20 Å²	20	45.8 Å²	45.8	17%	0.165	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-8.2	173	0	0	0	0	0	113.7	F141 N187 V188 E189 Y193 F279	F141-A191 HydrophobicContact CD1-CB 4.34Å; F141-A191 HydrophobicContact CE1-CB 4.35Å; N187-A191 WeakPolarHBondContact O-CB 3.32Å; N187-A191 PolarHBondContact O-N 3.02Å; V188-A191 PolarHBondContact O-N 2.77Å; E189-A191 VanDerWaalsContact C-N 3.25Å; E189-A191 PolarHBondContact O-N 2.74Å; A191-Y193 VanDerWaalsContact C-N 3.3Å; A191-Y193 HydrophobicContact CB-CD1 3.72Å; A191-Y193 HydrophobicContact CB-CE1 3.87Å; A191-Y193 HydrophobicContact CB-CG 4.07Å; A191-Y193 WeakPolarHBondContact O-CD1 3.43Å; A191-F279 HydrophobicContact CB-CE1 4.32Å
192	N	86.6	Confident	90.7	Very high	96 Å²	96	45 Å²	45	51%	0.513	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	36.8	-175.1	-50.2	-104.2	0	0	0	112.4	V188 E189 L190 E194	V188-N192 PolarHBondContact O-N 3.38Å; E189-N192 WeakPolarHBondContact O-CA 3.38Å; E189-N192 PolarHBondContact O-N 2.83Å; L190-N192 PolarHBondContact O-N 3.41Å; L190-N192 PolarHBondContact O-ND2 3.41Å; N192-E194 PolarHBondContact O-N 3.33Å
193	Y	84.7	Confident	90.7	Very high	82 Å²	82	40 Å²	40	32%	0.322	19%	0.187	S	C	.	.			trans	-87.2	83.7	-180	-79.2	17.6	0	0	0	110.7	F175 V188 A191 R195 A225 F279	F175-Y193 WeakPolarHBondContact CD2-O 3.47Å; F175-Y193 WeakPolarHBondContact CE2-O 3.42Å; F175-Y193 HydrophobicContact CZ-CD2 4.28Å; V188-Y193 PolarHBondContact O-N 3.4Å; A191-Y193 VanDerWaalsContact C-N 3.3Å; A191-Y193 HydrophobicContact CB-CD1 3.72Å; A191-Y193 HydrophobicContact CB-CE1 3.87Å; A191-Y193 HydrophobicContact CB-CG 4.07Å; A191-Y193 WeakPolarHBondContact O-CD1 3.43Å; Y193-R195 PolarHBondContact O-N 3.07Å; Y193-A225 HydrophobicContact CE2-CB 3.78Å; Y193-F279 HydrophobicContact CD2-CE1 4.48Å; Y193-F279 HydrophobicContact CD2-CZ 4.42Å; Y193-F279 HydrophobicContact CE2-CE1 4.1Å; Y193-F279 AromaticContact CE2-CZ 3.62Å; Y193-F279 HydrophobicContact CE2-CZ 3.62Å; Y193-F279 AromaticContact CZ-CZ 4Å
194	E	82.6	Confident	90.7	Very high	181 Å²	181	40.1 Å²	40.1	85%	0.846	19%	0.187	S	C	*	.			trans	-63	-40.1	-173.8	-62.1	178.5	167.5	0	0	114.2	N192	N192-E194 PolarHBondContact O-N 3.33Å
195	R	85.9	Confident	90.6	Very high	68 Å²	68	41.2 Å²	41.2	26%	0.257	19%	0.194	S	C	.	.	S	Bend	trans	-143.5	149.9	177.9	64.5	165.7	179.2	-148.1	-30	112.4	F150 N151 D154 Y193	F150-R195 VanDerWaalsContact C-NH2 3.29Å; F150-R195 VanDerWaalsContact CD1-NH2 3.27Å; F150-R195 HydrophobicContact CE1-CG 3.85Å; F150-R195 PolarHBondContact O-NH2 3.1Å; N151-R195 PolarHBondContact OD1-NH1 2.98Å; N151-R195 VanDerWaalsContact OD1-NH1 3.08Å; N151-R195 PolarHBondContact OD1-NH2 3.35Å; D154-R195 IonicContact OD2-CZ 2.6Å; D154-R195 IonicContact OD2-NE 3.04Å; D154-R195 IonicContact OD2-NH1 2.59Å; D154-R195 PolarHBondContact OD2-NH1 3.4Å; Y193-R195 PolarHBondContact O-N 3.07Å
196	P	89.7	Confident	90.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.176	C	C	.	.			trans	-69.6	142.9	174.7	27.4	-34.5	0	0	0	112.3	I172 S173 F175 Q200 K201	I172-P196 HydrophobicContact CD1-CG 4.3Å; I172-P196 HydrophobicContact CG1-CG 4.37Å; S173-P196 WeakPolarHBondContact O-CD 3.49Å; S173-P196 WeakPolarHBondContact O-CG 3.34Å; F175-P196 HydrophobicContact CD1-CB 4.43Å; F175-P196 HydrophobicContact CE1-CB 3.95Å; F175-P196 HydrophobicContact CE2-CB 4.16Å; F175-P196 VanDerWaalsContact CE2-N 3.34Å; F175-P196 HydrophobicContact CZ-CB 3.81Å; P196-Q200 HydrophobicContact CB-CB 3.81Å; P196-K201 HydrophobicContact CB-CG 3.9Å; P196-K201 HydrophobicContact CG-CG 3.69Å; P196-K201 VanDerWaalsContact O-CE 3.3Å; P196-K201 WeakPolarHBondContact O-CE 3.45Å
197	T	88.4	Confident	90.6	Very high	13 Å²	13	35.2 Å²	35.2	8%	0.08	17%	0.17	C	C	.	.			trans	-72.1	164.3	169.6	70.7	0	0	0	0	111.6	F150 V199 Q200 K201 S221	F150-T197 HydrophobicContact CE2-CG2 3.92Å; F150-T197 HydrophobicContact CZ-CG2 4.01Å; T197-V199 VanDerWaalsContact C-N 3.3Å; T197-V199 PolarHBondContact O-N 3.15Å; T197-Q200 CarbonylContact O-C 3.52Å; T197-Q200 WeakPolarHBondContact O-CA 3.33Å; T197-Q200 WeakPolarHBondContact O-CB 3.09Å; T197-Q200 PolarHBondContact O-N 2.84Å; T197-Q200 VanDerWaalsContact OG1-CD 3.23Å; T197-Q200 WeakPolarHBondContact OG1-CG 3.35Å; T197-Q200 PolarHBondContact OG1-OE1 2.93Å; T197-K201 WeakPolarHBondContact O-CG 3.34Å; T197-K201 PolarHBondContact O-N 3.29Å; T197-S221 VanDerWaalsContact CB-O 3.25Å; T197-S221 WeakPolarHBondContact CB-O 3.21Å; T197-S221 PolarHBondContact OG1-O 3.45Å
198	P	88.6	Confident	90.6	Very high	8 Å²	8	37.1 Å²	37.1	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-55	-38.5	-178.5	-27.7	34.3	0	0	0	114.6	Y153 V158 K201 H202 V395	Y153-P198 WeakPolarHBondContact O-CG 3.38Å; V158-P198 HydrophobicContact CG2-CB 3.83Å; P198-K201 PolarHBondContact O-N 2.63Å; P198-H202 PolarHBondContact O-CD2 2.83Å; P198-V395 HydrophobicContact CB-CG1 4.02Å
199	V	90.8	Very high	90.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.7	-36.7	174.7	74.5	0	0	0	0	111.6	T197 A203 A217 S221 A226 L393 V395	T197-V199 VanDerWaalsContact C-N 3.3Å; T197-V199 PolarHBondContact O-N 3.15Å; V199-A203 WeakPolarHBondContact O-CB 3.35Å; V199-A203 PolarHBondContact O-N 3.02Å; V199-A217 HydrophobicContact CB-CB 4.31Å; V199-A217 HydrophobicContact CG2-CB 3.97Å; V199-S221 VanDerWaalsContact CG1-O 3.28Å; V199-S221 WeakPolarHBondContact CG1-O 3.43Å; V199-A226 HydrophobicContact CG1-CB 4.37Å; V199-L393 HydrophobicContact CG2-CD2 4.12Å; V199-V395 HydrophobicContact CB-CG2 3.92Å; V199-V395 HydrophobicContact CG2-CG2 4.05Å
200	Q	93.4	Very high	90.6	Very high	7 Å²	7	37.4 Å²	37.4	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-69.4	-38.6	177.6	-67.6	164.8	1.3	0	0	111.9	P196 T197 H202 I204 G222 A226	P196-Q200 HydrophobicContact CB-CB 3.81Å; T197-Q200 CarbonylContact O-C 3.52Å; T197-Q200 WeakPolarHBondContact O-CA 3.33Å; T197-Q200 WeakPolarHBondContact O-CB 3.09Å; T197-Q200 PolarHBondContact O-N 2.84Å; T197-Q200 VanDerWaalsContact OG1-CD 3.23Å; T197-Q200 WeakPolarHBondContact OG1-CG 3.35Å; T197-Q200 PolarHBondContact OG1-OE1 2.93Å; Q200-H202 VanDerWaalsContact C-N 3.25Å; Q200-H202 PolarHBondContact O-N 3.33Å; Q200-I204 HydrophobicContact CB-CD1 3.76Å; Q200-I204 HydrophobicContact CB-CG1 4.28Å; Q200-I204 HydrophobicContact CG-CD1 4.19Å; Q200-I204 WeakPolarHBondContact O-CB 3.25Å; Q200-I204 WeakPolarHBondContact O-CG1 3.45Å; Q200-I204 PolarHBondContact O-N 3.02Å; Q200-I204 VanDerWaalsContact O-N 3.09Å; Q200-G222 PolarHBondContact NE2-O 2.85Å; Q200-A226 HydrophobicContact CB-CB 4.4Å; Q200-A226 HydrophobicContact CG-CB 3.64Å
201	K	92.3	Very high	90.7	Very high	40 Å²	40	37.3 Å²	37.3	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-33.5	179	-74	-176.5	171.9	178.1	0	113.9	D154 T171 I172 P196 T197 P198 P205	D154-K201 IonicContact OD1-NZ 2.83Å; D154-K201 PolarHBondContact OD1-NZ 2.89Å; T171-K201 WeakPolarHBondContact CA-O 3.22Å; I172-K201 PolarHBondContact N-O 3.43Å; I172-K201 WeakPolarHBondContact O-CB 3.27Å; I172-K201 VanDerWaalsContact O-CG 3.26Å; I172-K201 WeakPolarHBondContact O-CG 3.36Å; P196-K201 HydrophobicContact CB-CG 3.9Å; P196-K201 HydrophobicContact CG-CG 3.69Å; P196-K201 VanDerWaalsContact O-CE 3.3Å; P196-K201 WeakPolarHBondContact O-CE 3.45Å; T197-K201 WeakPolarHBondContact O-CG 3.34Å; T197-K201 PolarHBondContact O-N 3.29Å; P198-K201 PolarHBondContact O-N 2.63Å; K201-P205 WeakPolarHBondContact O-CG 3.43Å
202	H	92.3	Very high	91.1	Very high	24 Å²	24	36.7 Å²	36.7	11%	0.111	20%	0.198	C	C	.	.	H	α-helix	trans	-101.2	-44	176.2	-63.5	-113.9	0	0	0	112.1	D167 T171 P198 Q200 P205 I206 L393	D167-H202 IonicContact OD1-CE1 3.33Å; D167-H202 IonicContact OD1-ND1 2.69Å; T171-H202 WeakPolarHBondContact CG2-CE1 3.1Å; T171-H202 VanDerWaalsContact CG2-ND1 3.31Å; T171-H202 WeakPolarHBondContact CG2-ND1 3.38Å; P198-H202 PolarHBondContact O-CD2 2.83Å; Q200-H202 VanDerWaalsContact C-N 3.25Å; Q200-H202 PolarHBondContact O-N 3.33Å; H202-P205 WeakPolarHBondContact O-CD 3.04Å; H202-P205 WeakPolarHBondContact O-CG 3.43Å; H202-I206 HydrophobicContact CB-CD1 4.47Å; H202-I206 VanDerWaalsContact O-CD1 3.26Å; H202-I206 WeakPolarHBondContact O-CD1 3.37Å; H202-I206 WeakPolarHBondContact O-CG1 3.29Å; H202-I206 PolarHBondContact O-N 2.9Å; H202-L393 HydrophobicContact CB-CD1 3.61Å; H202-L393 HydrophobicContact CB-CD2 4.1Å
203	A	94.3	Very high	91.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-40.3	-173.3	0	0	0	0	0	113.2	V199 I206 I207 L213 A226 L393	V199-A203 WeakPolarHBondContact O-CB 3.35Å; V199-A203 PolarHBondContact O-N 3.02Å; A203-I206 PolarHBondContact O-N 3.19Å; A203-I207 HydrophobicContact CB-CD1 4.19Å; A203-I207 WeakPolarHBondContact O-CB 3.45Å; A203-I207 WeakPolarHBondContact O-CD1 3.44Å; A203-I207 WeakPolarHBondContact O-CG1 3.35Å; A203-I207 PolarHBondContact O-N 2.91Å; A203-L213 HydrophobicContact CB-CD2 3.65Å; A203-A226 HydrophobicContact CB-CB 4.16Å; A203-L393 HydrophobicContact CB-CD2 4.03Å
204	I	94.7	Very high	92.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-50.2	-176.8	-60.4	173.8	0	0	0	112.2	F175 L178 Q200 I207 A208 A226 I229 P230	F175-I204 HydrophobicContact CD1-CD1 4.39Å; F175-I204 HydrophobicContact CE1-CD1 3.82Å; L178-I204 HydrophobicContact CD1-CB 4.38Å; L178-I204 HydrophobicContact CD1-CG2 3.47Å; L178-I204 VanDerWaalsContact CD1-CG2 3.47Å; L178-I204 HydrophobicContact CD2-CG2 3.86Å; L178-I204 HydrophobicContact CG-CG2 4.32Å; Q200-I204 HydrophobicContact CB-CD1 3.76Å; Q200-I204 HydrophobicContact CB-CG1 4.28Å; Q200-I204 HydrophobicContact CG-CD1 4.19Å; Q200-I204 WeakPolarHBondContact O-CB 3.25Å; Q200-I204 WeakPolarHBondContact O-CG1 3.45Å; Q200-I204 PolarHBondContact O-N 3.02Å; Q200-I204 VanDerWaalsContact O-N 3.09Å; I204-I207 PolarHBondContact O-N 2.85Å; I204-A208 VanDerWaalsContact O-CB 3.25Å; I204-A208 WeakPolarHBondContact O-CB 3.47Å; I204-A208 PolarHBondContact O-N 3.2Å; I204-A226 HydrophobicContact CG1-CB 4.5Å; I204-A226 WeakPolarHBondContact CG1-O 3.26Å; I204-I229 HydrophobicContact CD1-CD1 4.4Å; I204-P230 HydrophobicContact CG2-CB 4.14Å; I204-P230 HydrophobicContact CG2-CG 4.14Å
205	P	93.1	Very high	92.6	Very high	24 Å²	24	19.6 Å²	19.6	16%	0.156	12%	0.118	C	C	.	.	H	α-helix	trans	-63.7	-37.6	174.5	22.3	-32.5	0	0	0	113.4	S170 I172 K201 H202 I207 A208 S209	S170-P205 WeakPolarHBondContact O-CG 3.3Å; I172-P205 HydrophobicContact CG2-CG 4.29Å; K201-P205 WeakPolarHBondContact O-CG 3.43Å; H202-P205 WeakPolarHBondContact O-CD 3.04Å; H202-P205 WeakPolarHBondContact O-CG 3.43Å; P205-I207 PolarHBondContact O-N 3.41Å; P205-A208 PolarHBondContact O-N 3.37Å; P205-S209 PolarHBondContact O-N 2.97Å
206	I	93.5	Very high	92.9	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-58.2	-50.5	174.2	-68.2	164.4	0	0	0	110.6	F165 H202 A203 S209 R211 L213 I391	F165-I206 HydrophobicContact CE2-CD1 3.87Å; F165-I206 HydrophobicContact CE2-CG1 3.84Å; F165-I206 HydrophobicContact CZ-CD1 4.39Å; H202-I206 HydrophobicContact CB-CD1 4.47Å; H202-I206 VanDerWaalsContact O-CD1 3.26Å; H202-I206 WeakPolarHBondContact O-CD1 3.37Å; H202-I206 WeakPolarHBondContact O-CG1 3.29Å; H202-I206 PolarHBondContact O-N 2.9Å; A203-I206 PolarHBondContact O-N 3.19Å; I206-S209 PolarHBondContact O-N 2.78Å; I206-S209 PolarHBondContact O-OG 3.49Å; I206-R211 HydrophobicContact CG2-CB 4.06Å; I206-L213 HydrophobicContact CD1-CD1 4.12Å; I206-L213 HydrophobicContact CG2-CB 4.44Å; I206-L213 HydrophobicContact CG2-CD1 4.17Å; I206-I391 HydrophobicContact CD1-CB 4.23Å; I206-I391 HydrophobicContact CD1-CG2 3.81Å; I206-I391 HydrophobicContact CG2-CB 4.13Å; I206-I391 HydrophobicContact CG2-CG1 3.87Å
207	I	95.2	Very high	92.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-68.1	-39.9	-177.6	-60.9	159.5	0	0	0	110.5	A203 I204 P205 S209 G210 L213 A226 F227 P230 I231 Q367 L369 F371	A203-I207 HydrophobicContact CB-CD1 4.19Å; A203-I207 WeakPolarHBondContact O-CB 3.45Å; A203-I207 WeakPolarHBondContact O-CD1 3.44Å; A203-I207 WeakPolarHBondContact O-CG1 3.35Å; A203-I207 PolarHBondContact O-N 2.91Å; I204-I207 PolarHBondContact O-N 2.85Å; P205-I207 PolarHBondContact O-N 3.41Å; I207-S209 PolarHBondContact O-N 3.32Å; I207-G210 PolarHBondContact O-N 3.17Å; I207-L213 HydrophobicContact CD1-CD2 3.92Å; I207-L213 HydrophobicContact CG1-CD2 4.01Å; I207-A226 WeakPolarHBondContact CD1-O 3.29Å; I207-F227 HydrophobicContact CD1-CB 4.25Å; I207-P230 HydrophobicContact CB-CB 3.96Å; I207-P230 HydrophobicContact CB-CG 3.72Å; I207-P230 HydrophobicContact CD1-CG 4.03Å; I207-P230 HydrophobicContact CG2-CB 3.77Å; I207-P230 HydrophobicContact CG2-CG 3.62Å; I207-I231 HydrophobicContact CG2-CG1 4.38Å; I207-Q367 PolarHBondContact O-NE2 2.94Å; I207-L369 HydrophobicContact CD1-CD1 3.71Å; I207-L369 HydrophobicContact CD1-CD2 4.49Å; I207-L369 HydrophobicContact CG1-CD1 3.85Å; I207-L369 HydrophobicContact CG1-CD2 3.85Å; I207-L369 HydrophobicContact CG2-CD1 3.9Å; I207-L369 HydrophobicContact CG2-CD2 4.36Å; I207-F371 HydrophobicContact CD1-CZ 4.28Å
208	A	92.8	Very high	92.1	Very high	42 Å²	42	18 Å²	18	35%	0.347	11%	0.113	S	C	.	.	H	α-helix	trans	-60.5	-29.5	175.2	0	0	0	0	0	112.8	I204 P205 G210 P230	I204-A208 VanDerWaalsContact O-CB 3.25Å; I204-A208 WeakPolarHBondContact O-CB 3.47Å; I204-A208 PolarHBondContact O-N 3.2Å; P205-A208 PolarHBondContact O-N 3.37Å; A208-G210 PolarHBondContact O-N 2.91Å; A208-P230 HydrophobicContact CB-CB 4.44Å
209	S	90.6	Very high	91.2	Very high	80 Å²	80	19.1 Å²	19.1	56%	0.559	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	1	174.1	77.7	0	0	0	0	115	P205 I206 I207 R211	P205-S209 PolarHBondContact O-N 2.97Å; I206-S209 PolarHBondContact O-N 2.78Å; I206-S209 PolarHBondContact O-OG 3.49Å; I207-S209 PolarHBondContact O-N 3.32Å; S209-R211 VanDerWaalsContact C-N 3.34Å; S209-R211 VanDerWaalsContact OG-CG 3.3Å; S209-R211 WeakPolarHBondContact OG-CG 3.48Å
210	G	92.3	Very high	90.2	Very high	46 Å²	46	20.6 Å²	20.6	47%	0.474	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	17.7	179.2	0	0	0	0	0	114.5	I207 A208	I207-G210 PolarHBondContact O-N 3.17Å; A208-G210 PolarHBondContact O-N 2.91Å
211	R	93.9	Very high	89.4	Confident	49 Å²	49	20.7 Å²	20.7	19%	0.185	14%	0.136	C	C	.	.			trans	-92.1	141.7	179.6	-64.1	-67.9	-64	-82.1	2.7	111.8	P163 I206 S209 Q367 N389	P163-R211 PolarHBondContact O-NH1 2.55Å; P163-R211 PolarHBondContact O-NH2 2.74Å; I206-R211 HydrophobicContact CG2-CB 4.06Å; S209-R211 VanDerWaalsContact C-N 3.34Å; S209-R211 VanDerWaalsContact OG-CG 3.3Å; S209-R211 WeakPolarHBondContact OG-CG 3.48Å; R211-Q367 PolarHBondContact O-NE2 3.42Å; R211-N389 PolarHBondContact NE-O 3.04Å; R211-N389 PolarHBondContact NH2-O 3.45Å
212	D	96.8	Very high	89	Confident	7 Å²	7	19.9 Å²	19.9	4%	0.037	14%	0.14	C	C	.	.			trans	-64.6	149.7	168.8	-75.6	14.5	0	0	0	111	Q367 T368 L387 N388 Y390 I391	D212-Q367 WeakPolarHBondContact OD1-CA 3.38Å; D212-T368 VanDerWaalsContact CA-O 3.24Å; D212-T368 WeakPolarHBondContact CA-O 3.45Å; D212-T368 VanDerWaalsContact CB-O 3.24Å; D212-T368 WeakPolarHBondContact CB-O 3.41Å; D212-T368 VanDerWaalsContact CG-N 3.34Å; D212-T368 VanDerWaalsContact CG-O 3.26Å; D212-T368 PolarHBondContact OD1-N 3.47Å; D212-L387 HydrophobicContact CB-CB 4.33Å; D212-L387 HydrophobicContact CB-CD2 4.49Å; D212-L387 WeakPolarHBondContact OD2-CA 3.46Å; D212-N388 WeakPolarHBondContact CB-O 3.31Å; D212-N388 PolarHBondContact OD2-N 3.36Å; D212-Y390 CarbonylContact O-C 3.52Å; D212-Y390 VanDerWaalsContact O-CA 3.27Å; D212-Y390 WeakPolarHBondContact O-CA 3.22Å; D212-Y390 WeakPolarHBondContact O-CB 3.41Å; D212-I391 PolarHBondContact O-N 2.96Å
213	L	96.4	Very high	88.9	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	131.1	-173.7	179.1	67.4	0	0	0	110.8	A203 I206 I207 A215 T368 L369 M370 F371 I391 L393	A203-L213 HydrophobicContact CB-CD2 3.65Å; I206-L213 HydrophobicContact CD1-CD1 4.12Å; I206-L213 HydrophobicContact CG2-CB 4.44Å; I206-L213 HydrophobicContact CG2-CD1 4.17Å; I207-L213 HydrophobicContact CD1-CD2 3.92Å; I207-L213 HydrophobicContact CG1-CD2 4.01Å; L213-A215 HydrophobicContact CD1-CB 4.43Å; L213-A215 HydrophobicContact CD2-CB 4.05Å; L213-A215 HydrophobicContact CG-CB 4.03Å; L213-T368 PolarHBondContact N-O 3.06Å; L213-L369 HydrophobicContact CB-CD2 3.87Å; L213-L369 CarbonylContact O-C 3.53Å; L213-L369 WeakPolarHBondContact O-CA 3.25Å; L213-M370 PolarHBondContact O-N 2.71Å; L213-F371 HydrophobicContact CD2-CE1 4.27Å; L213-F371 HydrophobicContact CD2-CZ 3.89Å; L213-I391 WeakPolarHBondContact CA-O 3.39Å; L213-I391 HydrophobicContact CD1-CB 4.34Å; L213-L393 HydrophobicContact CD1-CB 3.8Å; L213-L393 HydrophobicContact CD1-CD2 4.3Å
214	M	95.7	Very high	88.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	113.2	160.8	178	65.6	-143.1	0	0	107.9	M370 F375 I379 A383 L387 Y390 I391 F392 L393	M214-M370 HydrophobicContact CE-CB 4.5Å; M214-M370 HydrophobicContact SD-CB 3.5Å; M214-M370 WeakPolarHBondContact SD-CB 3.31Å; M214-M370 HydrophobicContact SD-CE 4.06Å; M214-F375 HydrophobicContact CE-CD2 3.67Å; M214-F375 HydrophobicContact CE-CE2 3.68Å; M214-F375 HydrophobicContact CG-CD2 4.44Å; M214-F375 HydrophobicContact CG-CE2 3.62Å; M214-F375 HydrophobicContact CG-CZ 4.07Å; M214-F375 HydrophobicContact SD-CD2 4.47Å; M214-F375 HydrophobicContact SD-CE2 3.87Å; M214-I379 HydrophobicContact CE-CG2 3.9Å; M214-I379 HydrophobicContact SD-CG2 4.43Å; M214-A383 HydrophobicContact CG-CB 4.43Å; M214-A383 HydrophobicContact SD-CB 4.05Å; M214-L387 HydrophobicContact CB-CD1 3.74Å; M214-Y390 HydrophobicContact CB-CD2 3.77Å; M214-Y390 HydrophobicContact CB-CE2 3.86Å; M214-I391 PolarHBondContact N-O 3.49Å; M214-F392 HydrophobicContact CB-CD2 4.01Å; M214-F392 HydrophobicContact CG-CD2 3.71Å; M214-F392 HydrophobicContact CG-CE2 3.98Å; M214-F392 WeakPolarHBondContact O-CA 3.17Å; M214-L393 PolarHBondContact O-N 3.47Å
215	A	94.5	Very high	88.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	111.1	-174.8	0	0	0	0	0	112.1	L213 M370 F371 S372 L393	L213-A215 HydrophobicContact CD1-CB 4.43Å; L213-A215 HydrophobicContact CD2-CB 4.05Å; L213-A215 HydrophobicContact CG-CB 4.03Å; A215-M370 PolarHBondContact N-O 3.23Å; A215-F371 HydrophobicContact CB-CD1 3.56Å; A215-F371 HydrophobicContact CB-CE1 3.61Å; A215-F371 HydrophobicContact CB-CG 4.37Å; A215-F371 HydrophobicContact CB-CZ 4.43Å; A215-F371 WeakPolarHBondContact O-CA 3.28Å; A215-S372 PolarHBondContact O-N 3.31Å; A215-L393 CarbonylContact C-O 3.56Å; A215-L393 WeakPolarHBondContact CA-O 3.3Å; A215-L393 HydrophobicContact CB-CB 4.37Å; A215-L393 HydrophobicContact CB-CD2 4.26Å
216	C	91.8	Very high	88.8	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.007	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	108	172.5	-63.5	0	0	0	0	109.3	S372 L393 T394 V395 V398	C216-S372 WeakPolarHBondContact CA-O 3.42Å; C216-L393 PolarHBondContact N-O 3.42Å; C216-T394 HydrophobicContact CB-CG2 4.41Å; C216-V395 PolarHBondContact O-N 3.33Å; C216-V398 HydrophobicContact CB-CG1 4.18Å; C216-V398 HydrophobicContact CB-CG2 3.83Å
217	A	85.5	Confident	89	Confident	2 Å²	2	19 Å²	19	2%	0.017	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	141.8	180	0	0	0	0	0	111.6	V199 K223 S372 V395	V199-A217 HydrophobicContact CB-CB 4.31Å; V199-A217 HydrophobicContact CG2-CB 3.97Å; A217-K223 HydrophobicContact CB-CD 4.11Å; A217-K223 HydrophobicContact CB-CG 4.36Å; A217-S372 PolarHBondContact N-O 3.44Å; A217-S372 VanDerWaalsContact O-O 3.09Å; A217-V395 HydrophobicContact CB-CB 3.86Å; A217-V395 HydrophobicContact CB-CG2 4.24Å
218	Q	76.2	Confident	89.1	Confident	45 Å²	45	19 Å²	19	21%	0.21	14%	0.135	C	C	.	.			trans	-56.8	155.5	-178.1	-62.3	-177.8	-1.2	0	0	113.1	S221 S400 T401	Q218-S221 VanDerWaalsContact O-CB 3.24Å; Q218-S221 WeakPolarHBondContact O-CB 3.47Å; Q218-S221 PolarHBondContact O-N 2.76Å; Q218-S221 PolarHBondContact O-OG 2.84Å; Q218-S400 PolarHBondContact NE2-O 3.1Å; Q218-T401 PolarHBondContact NE2-O 2.73Å
219	T	69.1	Low	89.3	Confident	31 Å²	31	17 Å²	17	19%	0.19	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	139.5	173.6	52.5	0	0	0	0	111.5	S221 G520	T219-S221 VanDerWaalsContact C-N 3.3Å; T219-S221 PolarHBondContact O-N 3.09Å; T219-G520 PolarHBondContact OG1-O 3.43Å
220	G	70.2	Confident	89.5	Confident	30 Å²	30	13.2 Å²	13.2	31%	0.309	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	5.4	-178.5	0	0	0	0	0	115.1	G222	G220-G222 VanDerWaalsContact C-N 3.26Å; G220-G222 PolarHBondContact O-N 2.71Å
221	S	76	Confident	89.8	Confident	9 Å²	9	11 Å²	11	6%	0.063	7%	0.069	C	C	.	.	S	Bend	trans	-75.1	-5.4	173.5	58	0	0	0	0	114.8	T197 V199 Q218 T219 K223	T197-S221 VanDerWaalsContact CB-O 3.25Å; T197-S221 WeakPolarHBondContact CB-O 3.21Å; T197-S221 PolarHBondContact OG1-O 3.45Å; V199-S221 VanDerWaalsContact CG1-O 3.28Å; V199-S221 WeakPolarHBondContact CG1-O 3.43Å; Q218-S221 VanDerWaalsContact O-CB 3.24Å; Q218-S221 WeakPolarHBondContact O-CB 3.47Å; Q218-S221 PolarHBondContact O-N 2.76Å; Q218-S221 PolarHBondContact O-OG 2.84Å; T219-S221 VanDerWaalsContact C-N 3.3Å; T219-S221 PolarHBondContact O-N 3.09Å; S221-K223 WeakPolarHBondContact OG-CG 3.34Å
222	G	83.9	Confident	89.9	Confident	24 Å²	24	8.8 Å²	8.8	25%	0.247	6%	0.061	C	C	.	.	S	Bend	trans	92.7	19.6	179.4	0	0	0	0	0	115.9	Q200 G220 T224 A225 A226	Q200-G222 PolarHBondContact NE2-O 2.85Å; G220-G222 VanDerWaalsContact C-N 3.26Å; G220-G222 PolarHBondContact O-N 2.71Å; G222-T224 VanDerWaalsContact C-N 3.29Å; G222-T224 PolarHBondContact O-N 3.01Å; G222-A225 PolarHBondContact O-N 3.44Å; G222-A226 PolarHBondContact O-N 3.38Å
223	K	90	Very high	89.9	Confident	14 Å²	14	8.7 Å²	8.7	6%	0.061	6%	0.06	C	C	.	.	H	α-helix	trans	-48.2	-45.1	-179.8	-55.8	-164.8	-62.6	-177.4	0	113.5	A217 S221 A225 A226 F227 D337 F371 S372	A217-K223 HydrophobicContact CB-CD 4.11Å; A217-K223 HydrophobicContact CB-CG 4.36Å; S221-K223 WeakPolarHBondContact OG-CG 3.34Å; K223-A225 PolarHBondContact O-N 3.15Å; K223-A226 WeakPolarHBondContact O-CA 3.34Å; K223-A226 WeakPolarHBondContact O-CB 3.39Å; K223-A226 PolarHBondContact O-N 2.97Å; K223-F227 WeakPolarHBondContact O-CD1 3.28Å; K223-F227 PolarHBondContact O-N 2.71Å; K223-D337 WeakPolarHBondContact CE-OD1 3.41Å; K223-D337 IonicContact NZ-OD1 2.77Å; K223-D337 PolarHBondContact NZ-OD1 3.04Å; K223-F371 HydrophobicContact CB-CD1 3.98Å; K223-F371 HydrophobicContact CB-CE1 4.47Å; K223-F371 HydrophobicContact CD-CB 4.23Å; K223-F371 HydrophobicContact CD-CD1 4.05Å; K223-F371 HydrophobicContact CG-CD1 4.25Å; K223-S372 PolarHBondContact NZ-O 2.93Å
224	T	92.8	Very high	89.9	Confident	16 Å²	16	9.6 Å²	9.6	10%	0.098	7%	0.065	C	C	.	.	H	α-helix	trans	-55.8	-51.9	-176.1	-45.3	0	0	0	0	113	G222 A226 F227 L228 I272 D275	G222-T224 VanDerWaalsContact C-N 3.29Å; G222-T224 PolarHBondContact O-N 3.01Å; T224-A226 VanDerWaalsContact C-N 3.29Å; T224-A226 PolarHBondContact O-N 3.02Å; T224-F227 HydrophobicContact CG2-CZ 4.26Å; T224-F227 PolarHBondContact O-N 3.09Å; T224-L228 HydrophobicContact CG2-CD1 3.78Å; T224-L228 WeakPolarHBondContact O-CB 3.43Å; T224-L228 VanDerWaalsContact O-CG 3.3Å; T224-L228 WeakPolarHBondContact O-CG 3.39Å; T224-L228 PolarHBondContact O-N 3.37Å; T224-I272 HydrophobicContact CG2-CB 4.36Å; T224-I272 HydrophobicContact CG2-CG1 3.9Å; T224-I272 HydrophobicContact CG2-CG2 4.45Å; T224-D275 HydrophobicContact CG2-CB 4Å; T224-D275 WeakPolarHBondContact CG2-OD2 3.16Å
225	A	93.5	Very high	89.8	Confident	3 Å²	3	9.6 Å²	9.6	3%	0.025	7%	0.065	C	C	.	.	H	α-helix	trans	-69	-28.1	175.7	0	0	0	0	0	112.7	Y193 G222 K223 F227 I229 F279	Y193-A225 HydrophobicContact CE2-CB 3.78Å; G222-A225 PolarHBondContact O-N 3.44Å; K223-A225 PolarHBondContact O-N 3.15Å; A225-F227 VanDerWaalsContact C-N 3.27Å; A225-F227 PolarHBondContact O-N 3.43Å; A225-I229 HydrophobicContact CB-CD1 4.04Å; A225-I229 WeakPolarHBondContact O-CB 3.44Å; A225-I229 WeakPolarHBondContact O-CG1 3.48Å; A225-I229 PolarHBondContact O-N 3Å; A225-I229 VanDerWaalsContact O-N 3.1Å; A225-F279 HydrophobicContact CB-CE2 3.94Å; A225-F279 HydrophobicContact CB-CZ 3.89Å
226	A	94.9	Very high	89.8	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.4	-31	178.6	0	0	0	0	0	113	V199 Q200 A203 I204 I207 G222 K223 T224 P230	V199-A226 HydrophobicContact CG1-CB 4.37Å; Q200-A226 HydrophobicContact CB-CB 4.4Å; Q200-A226 HydrophobicContact CG-CB 3.64Å; A203-A226 HydrophobicContact CB-CB 4.16Å; I204-A226 HydrophobicContact CG1-CB 4.5Å; I204-A226 WeakPolarHBondContact CG1-O 3.26Å; I207-A226 WeakPolarHBondContact CD1-O 3.29Å; G222-A226 PolarHBondContact O-N 3.38Å; K223-A226 WeakPolarHBondContact O-CA 3.34Å; K223-A226 WeakPolarHBondContact O-CB 3.39Å; K223-A226 PolarHBondContact O-N 2.97Å; T224-A226 VanDerWaalsContact C-N 3.29Å; T224-A226 PolarHBondContact O-N 3.02Å; A226-P230 VanDerWaalsContact O-CD 3.29Å; A226-P230 WeakPolarHBondContact O-CD 3.37Å; A226-P230 VanDerWaalsContact O-CG 3.25Å; A226-P230 WeakPolarHBondContact O-CG 3.22Å
227	F	96.7	Very high	89.9	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-96.1	-38.2	171	62	-104.8	0	0	0	114.2	I207 K223 T224 A225 I229 P230 I231 I261 I272 V335 D337 L369 F371	I207-F227 HydrophobicContact CD1-CB 4.25Å; K223-F227 WeakPolarHBondContact O-CD1 3.28Å; K223-F227 PolarHBondContact O-N 2.71Å; T224-F227 HydrophobicContact CG2-CZ 4.26Å; T224-F227 PolarHBondContact O-N 3.09Å; A225-F227 VanDerWaalsContact C-N 3.27Å; A225-F227 PolarHBondContact O-N 3.43Å; F227-I229 PolarHBondContact O-N 3.22Å; F227-P230 WeakPolarHBondContact O-CD 3.36Å; F227-P230 WeakPolarHBondContact O-CG 3.33Å; F227-I231 HydrophobicContact CB-CD1 4.19Å; F227-I231 HydrophobicContact CD2-CD1 4.44Å; F227-I231 VanDerWaalsContact O-CB 3.32Å; F227-I231 WeakPolarHBondContact O-CB 3.32Å; F227-I231 WeakPolarHBondContact O-CD1 3.12Å; F227-I231 VanDerWaalsContact O-CG1 3.22Å; F227-I231 WeakPolarHBondContact O-CG1 3.44Å; F227-I231 PolarHBondContact O-N 2.82Å; F227-I231 VanDerWaalsContact O-N 3.12Å; F227-I261 HydrophobicContact CE2-CD1 3.95Å; F227-I261 HydrophobicContact CE2-CG1 4.2Å; F227-I261 HydrophobicContact CE2-CG2 4.16Å; F227-I261 HydrophobicContact CZ-CG2 4.27Å; F227-I272 HydrophobicContact CE2-CG2 4.18Å; F227-I272 HydrophobicContact CZ-CD1 4.39Å; F227-I272 HydrophobicContact CZ-CG2 4.27Å; F227-V335 HydrophobicContact CD1-CG1 4.06Å; F227-V335 HydrophobicContact CD2-CG1 4.09Å; F227-V335 HydrophobicContact CD2-CG2 4.28Å; F227-V335 HydrophobicContact CE1-CG1 4.12Å; F227-V335 HydrophobicContact CE2-CG1 4.19Å; F227-V335 HydrophobicContact CG-CG1 4.04Å; F227-V335 HydrophobicContact CZ-CG1 4.19Å; F227-D337 HydrophobicContact CE1-CB 4.23Å; F227-D337 HydrophobicContact CZ-CB 4.44Å; F227-L369 HydrophobicContact CB-CD1 3.86Å; F227-F371 HydrophobicContact CB-CE2 3.73Å; F227-F371 HydrophobicContact CB-CZ 3.93Å; F227-F371 AromaticContact CD1-CD2 3.73Å; F227-F371 HydrophobicContact CD1-CD2 3.73Å; F227-F371 HydrophobicContact CD1-CE1 4.44Å; F227-F371 AromaticContact CD1-CE2 3.47Å; F227-F371 HydrophobicContact CD1-CE2 3.47Å; F227-F371 VanDerWaalsContact CD1-CE2 3.47Å; F227-F371 HydrophobicContact CD1-CG 4.34Å; F227-F371 AromaticContact CD1-CZ 3.86Å; F227-F371 HydrophobicContact CD1-CZ 3.86Å; F227-F371 HydrophobicContact CE1-CD2 4.24Å; F227-F371 HydrophobicContact CE1-CE2 4.41Å; F227-F371 AromaticContact CG-CE2 3.98Å; F227-F371 HydrophobicContact CG-CE2 3.98Å; F227-F371 HydrophobicContact CG-CZ 4.39Å
228	L	97.4	Very high	90.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-42.7	-177.4	-72.8	176.7	0	0	0	113.1	T224 L232 I261 D275 A276 F279 L309	T224-L228 HydrophobicContact CG2-CD1 3.78Å; T224-L228 WeakPolarHBondContact O-CB 3.43Å; T224-L228 VanDerWaalsContact O-CG 3.3Å; T224-L228 WeakPolarHBondContact O-CG 3.39Å; T224-L228 PolarHBondContact O-N 3.37Å; L228-L232 HydrophobicContact CB-CD1 4.46Å; L228-L232 VanDerWaalsContact O-CB 3.28Å; L228-L232 WeakPolarHBondContact O-CB 3.35Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.24Å; L228-L232 PolarHBondContact O-N 3.41Å; L228-I261 HydrophobicContact CD2-CD1 3.79Å; L228-D275 HydrophobicContact CD1-CB 3.72Å; L228-A276 HydrophobicContact CD1-CB 4.26Å; L228-A276 HydrophobicContact CD2-CB 4.02Å; L228-F279 HydrophobicContact CB-CD2 3.94Å; L228-F279 HydrophobicContact CD1-CD2 3.98Å; L228-F279 HydrophobicContact CD1-CE2 4.33Å; L228-L309 HydrophobicContact CD2-CD1 4.07Å
229	I	96.2	Very high	90.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-56	-178.7	-68.6	170.4	0	0	0	111.9	F175 L180 V184 V188 I204 A225 F227 N233 F279	F175-I229 HydrophobicContact CE1-CD1 3.98Å; L180-I229 HydrophobicContact CD1-CG2 4.17Å; L180-I229 HydrophobicContact CD2-CG2 3.74Å; V184-I229 HydrophobicContact CG1-CG2 3.98Å; V188-I229 HydrophobicContact CG2-CD1 3.77Å; V188-I229 HydrophobicContact CG2-CG1 4.07Å; I204-I229 HydrophobicContact CD1-CD1 4.4Å; A225-I229 HydrophobicContact CB-CD1 4.04Å; A225-I229 WeakPolarHBondContact O-CB 3.44Å; A225-I229 WeakPolarHBondContact O-CG1 3.48Å; A225-I229 PolarHBondContact O-N 3Å; A225-I229 VanDerWaalsContact O-N 3.1Å; F227-I229 PolarHBondContact O-N 3.22Å; I229-N233 VanDerWaalsContact O-CB 3.25Å; I229-N233 WeakPolarHBondContact O-CB 3.46Å; I229-N233 PolarHBondContact O-N 3.35Å; I229-F279 HydrophobicContact CD1-CE1 4.35Å; I229-F279 HydrophobicContact CG1-CD1 4.21Å; I229-F279 HydrophobicContact CG1-CE1 4.28Å; I229-F279 HydrophobicContact CG1-CG 4.44Å
230	P	96.4	Very high	91.7	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-69.6	-35.7	179.7	26.2	-34.5	0	0	0	113.3	I204 I207 A208 A226 F227 N233 N234	I204-P230 HydrophobicContact CG2-CB 4.14Å; I204-P230 HydrophobicContact CG2-CG 4.14Å; I207-P230 HydrophobicContact CB-CB 3.96Å; I207-P230 HydrophobicContact CB-CG 3.72Å; I207-P230 HydrophobicContact CD1-CG 4.03Å; I207-P230 HydrophobicContact CG2-CB 3.77Å; I207-P230 HydrophobicContact CG2-CG 3.62Å; A208-P230 HydrophobicContact CB-CB 4.44Å; A226-P230 VanDerWaalsContact O-CD 3.29Å; A226-P230 WeakPolarHBondContact O-CD 3.37Å; A226-P230 VanDerWaalsContact O-CG 3.25Å; A226-P230 WeakPolarHBondContact O-CG 3.22Å; F227-P230 WeakPolarHBondContact O-CD 3.36Å; F227-P230 WeakPolarHBondContact O-CG 3.33Å; P230-N233 PolarHBondContact O-N 3.08Å; P230-N234 WeakPolarHBondContact O-CB 3.33Å; P230-N234 PolarHBondContact O-N 2.94Å
231	I	97.4	Very high	92.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-50.7	176.7	-70.6	171.5	0	0	0	110.5	I207 F227 N233 N234 M235 A259 F333 V335 L369	I207-I231 HydrophobicContact CG2-CG1 4.38Å; F227-I231 HydrophobicContact CB-CD1 4.19Å; F227-I231 HydrophobicContact CD2-CD1 4.44Å; F227-I231 VanDerWaalsContact O-CB 3.32Å; F227-I231 WeakPolarHBondContact O-CB 3.32Å; F227-I231 WeakPolarHBondContact O-CD1 3.12Å; F227-I231 VanDerWaalsContact O-CG1 3.22Å; F227-I231 WeakPolarHBondContact O-CG1 3.44Å; F227-I231 PolarHBondContact O-N 2.82Å; F227-I231 VanDerWaalsContact O-N 3.12Å; I231-N233 VanDerWaalsContact C-N 3.32Å; I231-N233 PolarHBondContact O-N 3.22Å; I231-N234 PolarHBondContact O-N 3.28Å; I231-M235 HydrophobicContact CG2-CG 4.23Å; I231-M235 HydrophobicContact CG2-SD 3.75Å; I231-M235 WeakPolarHBondContact O-CB 3.37Å; I231-M235 VanDerWaalsContact O-CG 3.29Å; I231-M235 WeakPolarHBondContact O-CG 3.44Å; I231-M235 PolarHBondContact O-N 3.39Å; I231-A259 HydrophobicContact CG2-CB 3.93Å; I231-F333 HydrophobicContact CD1-CB 4.24Å; I231-F333 HydrophobicContact CG1-CB 4.34Å; I231-F333 HydrophobicContact CG1-CD1 4.12Å; I231-F333 HydrophobicContact CG1-CG 4.23Å; I231-F333 HydrophobicContact CG2-CB 4.18Å; I231-F333 HydrophobicContact CG2-CD2 3.95Å; I231-F333 HydrophobicContact CG2-CG 3.95Å; I231-V335 HydrophobicContact CD1-CG2 3.5Å; I231-V335 VanDerWaalsContact CD1-CG2 3.5Å; I231-L369 HydrophobicContact CD1-CD1 3.92Å; I231-L369 HydrophobicContact CG1-CD1 4.48Å
232	L	97.1	Very high	93	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-36.6	179.8	-70.9	168.5	0	0	0	111.9	L228 M235 I236 F279 I285 L309	L228-L232 HydrophobicContact CB-CD1 4.46Å; L228-L232 VanDerWaalsContact O-CB 3.28Å; L228-L232 WeakPolarHBondContact O-CB 3.35Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.24Å; L228-L232 PolarHBondContact O-N 3.41Å; L232-M235 HydrophobicContact CD2-SD 4.36Å; L232-M235 PolarHBondContact O-N 2.93Å; L232-I236 WeakPolarHBondContact O-CB 3.25Å; L232-I236 VanDerWaalsContact O-CG1 3.27Å; L232-I236 WeakPolarHBondContact O-CG1 3.45Å; L232-I236 PolarHBondContact O-N 3.33Å; L232-F279 HydrophobicContact CD1-CB 3.45Å; L232-F279 VanDerWaalsContact CD1-CB 3.45Å; L232-I285 HydrophobicContact CD2-CD1 3.85Å; L232-I285 HydrophobicContact CD2-CG2 3.91Å; L232-L309 HydrophobicContact CD2-CD1 3.86Å; L232-L309 HydrophobicContact CG-CD1 4.38Å
233	N	96.3	Very high	93.1	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.027	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-47.6	172.7	-173.8	42.6	0	0	0	112	S179 L180 H181 V184 I229 P230 I231 I236 K237	S179-N233 PolarHBondContact O-ND2 2.67Å; L180-N233 HydrophobicContact CD2-CB 4.15Å; H181-N233 WeakPolarHBondContact CB-OD1 3.34Å; H181-N233 PolarHBondContact N-OD1 2.9Å; V184-N233 HydrophobicContact CG2-CB 4.27Å; I229-N233 VanDerWaalsContact O-CB 3.25Å; I229-N233 WeakPolarHBondContact O-CB 3.46Å; I229-N233 PolarHBondContact O-N 3.35Å; P230-N233 PolarHBondContact O-N 3.08Å; I231-N233 VanDerWaalsContact C-N 3.32Å; I231-N233 PolarHBondContact O-N 3.22Å; N233-I236 PolarHBondContact O-N 3.31Å; N233-K237 WeakPolarHBondContact O-CG 3.39Å; N233-K237 PolarHBondContact O-N 3.39Å; N233-K237 WeakPolarHBondContact OD1-CE 3.43Å
234	N	95.2	Very high	92.8	Very high	19 Å²	19	21 Å²	21	10%	0.102	12%	0.12	C	C	.	.	H	α-helix	trans	-69.6	-40.6	179.1	-73.7	-7.3	0	0	0	111.8	P230 I231 I236 K237 Q238 F333	P230-N234 WeakPolarHBondContact O-CB 3.33Å; P230-N234 PolarHBondContact O-N 2.94Å; I231-N234 PolarHBondContact O-N 3.28Å; N234-I236 PolarHBondContact O-N 3.15Å; N234-K237 PolarHBondContact O-N 3.41Å; N234-Q238 VanDerWaalsContact O-CB 3.26Å; N234-Q238 WeakPolarHBondContact O-CB 3.46Å; N234-Q238 VanDerWaalsContact O-CG 3.26Å; N234-Q238 WeakPolarHBondContact O-CG 3.28Å; N234-Q238 PolarHBondContact O-N 3.12Å; N234-F333 HydrophobicContact CB-CE1 4.32Å; N234-F333 HydrophobicContact CB-CZ 3.8Å
235	M	95.2	Very high	92.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.3	-46.6	172.7	-75.7	177.1	68.4	0	0	111.9	W126 I231 L232 G239 V258 A259 I285 N308 L309 F333	W126-M235 HydrophobicContact CE3-CB 4.44Å; W126-M235 HydrophobicContact CH2-CE 4.3Å; W126-M235 HydrophobicContact CZ3-CB 4.15Å; W126-M235 HydrophobicContact CZ3-CE 3.88Å; I231-M235 HydrophobicContact CG2-CG 4.23Å; I231-M235 HydrophobicContact CG2-SD 3.75Å; I231-M235 WeakPolarHBondContact O-CB 3.37Å; I231-M235 VanDerWaalsContact O-CG 3.29Å; I231-M235 WeakPolarHBondContact O-CG 3.44Å; I231-M235 PolarHBondContact O-N 3.39Å; L232-M235 HydrophobicContact CD2-SD 4.36Å; L232-M235 PolarHBondContact O-N 2.93Å; M235-G239 WeakPolarHBondContact O-CA 3.37Å; M235-G239 PolarHBondContact O-N 3.14Å; M235-V258 HydrophobicContact CE-CB 4.1Å; M235-V258 HydrophobicContact CE-CG1 4.24Å; M235-V258 HydrophobicContact CG-CG1 4.13Å; M235-A259 HydrophobicContact SD-CB 3.75Å; M235-I285 HydrophobicContact CB-CD1 3.66Å; M235-I285 HydrophobicContact CE-CD1 3.98Å; M235-I285 HydrophobicContact CE-CG1 4.3Å; M235-I285 HydrophobicContact CE-CG2 3.82Å; M235-I285 HydrophobicContact SD-CD1 4.46Å; M235-N308 HydrophobicContact CE-CB 4.25Å; M235-N308 WeakPolarHBondContact CE-O 3.25Å; M235-L309 HydrophobicContact CE-CB 4.37Å; M235-F333 HydrophobicContact CG-CD2 4.04Å; M235-F333 HydrophobicContact CG-CE2 3.68Å
236	I	94.4	Very high	92.1	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-63.1	-47.9	177.9	-73.2	164.9	0	0	0	111.2	W126 T127 H181 I183 V184 L232 N233 N234 G239 I285	W126-I236 WeakPolarHBondContact O-CG2 3.41Å; T127-I236 HydrophobicContact CG2-CG2 4.26Å; H181-I236 HydrophobicContact CB-CG2 4.17Å; H181-I236 WeakPolarHBondContact ND1-CG2 3.44Å; I183-I236 HydrophobicContact CB-CD1 4.23Å; I183-I236 HydrophobicContact CD1-CD1 4.33Å; I183-I236 HydrophobicContact CG2-CD1 4.42Å; V184-I236 HydrophobicContact CG2-CD1 3.74Å; L232-I236 WeakPolarHBondContact O-CB 3.25Å; L232-I236 VanDerWaalsContact O-CG1 3.27Å; L232-I236 WeakPolarHBondContact O-CG1 3.45Å; L232-I236 PolarHBondContact O-N 3.33Å; N233-I236 PolarHBondContact O-N 3.31Å; N234-I236 PolarHBondContact O-N 3.15Å; I236-G239 PolarHBondContact O-N 3.12Å; I236-I285 HydrophobicContact CD1-CD1 4.36Å; I236-I285 HydrophobicContact CG1-CD1 3.67Å
237	K	93.1	Very high	91.6	Very high	99 Å²	99	22.8 Å²	22.8	43%	0.43	13%	0.132	S	C	.	.	H	α-helix	trans	-66	-38	-178.9	-72.8	177.7	179.8	-175.7	0	113.8	S179 N233 N234	S179-K237 VanDerWaalsContact O-CE 3.31Å; S179-K237 WeakPolarHBondContact O-CE 3.04Å; S179-K237 PolarHBondContact O-NZ 3.16Å; S179-K237 PolarHBondContact OG-NZ 3.09Å; N233-K237 WeakPolarHBondContact O-CG 3.39Å; N233-K237 PolarHBondContact O-N 3.39Å; N233-K237 WeakPolarHBondContact OD1-CE 3.43Å; N234-K237 PolarHBondContact O-N 3.41Å
238	Q	92.1	Very high	91.1	Very high	104 Å²	104	24.4 Å²	24.4	49%	0.486	14%	0.141	S	C	.	.	H	α-helix	trans	-88.6	-9.8	-178.6	-63.8	173.9	-3.4	0	0	113	N234	N234-Q238 VanDerWaalsContact O-CB 3.26Å; N234-Q238 WeakPolarHBondContact O-CB 3.46Å; N234-Q238 VanDerWaalsContact O-CG 3.26Å; N234-Q238 WeakPolarHBondContact O-CG 3.28Å; N234-Q238 PolarHBondContact O-N 3.12Å
239	G	90	Very high	90.6	Very high	12 Å²	12	30.4 Å²	30.4	12%	0.124	17%	0.173	C	C	.	.			trans	60.9	-166.4	-174.9	0	0	0	0	0	114.2	M235 I236 R332	M235-G239 WeakPolarHBondContact O-CA 3.37Å; M235-G239 PolarHBondContact O-N 3.14Å; I236-G239 PolarHBondContact O-N 3.12Å; G239-R332 PolarHBondContact O-NH1 3.3Å; G239-R332 PolarHBondContact O-NH2 2.79Å
240	P	86	Confident	90	Very high	27 Å²	27	33.6 Å²	33.6	18%	0.175	19%	0.19	C	C	.	.			trans	-72.9	-28.9	-173.3	25.8	-34	0	0	0	115.5	W126 S243 I244	W126-P240 HydrophobicContact CH2-CB 4.08Å; W126-P240 HydrophobicContact CZ2-CB 3.57Å; W126-P240 HydrophobicContact CZ2-CG 4.45Å; P240-S243 PolarHBondContact O-OG 2.94Å; P240-I244 HydrophobicContact CB-CD1 3.51Å; P240-I244 HydrophobicContact CB-CG1 3.67Å; P240-I244 HydrophobicContact CG-CD1 3.56Å; P240-I244 HydrophobicContact CG-CG1 4.21Å
241	G	86.5	Confident	89.4	Confident	41 Å²	41	39.7 Å²	39.7	42%	0.423	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	-155.5	-159.1	0	0	0	0	0	112.4	S243	G241-S243 PolarHBondContact O-N 2.62Å; G241-S243 VanDerWaalsContact O-N 3.09Å
242	D	87.5	Confident	88.6	Confident	102 Å²	102	44.4 Å²	44.4	55%	0.545	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-3	-176.7	-64.5	-59	0	0	0	115.2	I244 S245 A246 Y330	D242-I244 PolarHBondContact O-N 3.4Å; D242-S245 WeakPolarHBondContact O-CB 3.4Å; D242-S245 PolarHBondContact O-N 3.3Å; D242-A246 WeakPolarHBondContact O-CB 3.36Å; D242-A246 PolarHBondContact O-N 3.41Å; D242-Y330 HydrophobicContact CB-CD1 4.05Å; D242-Y330 HydrophobicContact CB-CE1 3.57Å
243	S	86.4	Confident	88	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.014	27%	0.272	C	S	.	.	H	α-helix	trans	-55.6	-36.4	178.3	64.2	0	0	0	0	113.3	P240 G241 T247 V258	P240-S243 PolarHBondContact O-OG 2.94Å; G241-S243 PolarHBondContact O-N 2.62Å; G241-S243 VanDerWaalsContact O-N 3.09Å; S243-T247 WeakPolarHBondContact O-CB 3.39Å; S243-T247 PolarHBondContact O-N 2.93Å; S243-T247 VanDerWaalsContact O-N 3.08Å; S243-T247 PolarHBondContact O-OG1 2.9Å; S243-V258 WeakPolarHBondContact OG-CG2 3.21Å
244	I	84.1	Confident	87.9	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.046	28%	0.279	C	S	.	.	H	α-helix	trans	-68.2	-49.8	173.7	-68.9	179.5	0	0	0	110.3	W119 E124 P240 D242 A246 T247 I248	W119-I244 HydrophobicContact CZ3-CG2 4.34Å; E124-I244 HydrophobicContact CB-CD1 4.3Å; P240-I244 HydrophobicContact CB-CD1 3.51Å; P240-I244 HydrophobicContact CB-CG1 3.67Å; P240-I244 HydrophobicContact CG-CD1 3.56Å; P240-I244 HydrophobicContact CG-CG1 4.21Å; D242-I244 PolarHBondContact O-N 3.4Å; I244-A246 VanDerWaalsContact C-N 3.34Å; I244-A246 PolarHBondContact O-N 3.36Å; I244-T247 WeakPolarHBondContact O-CB 3.32Å; I244-T247 PolarHBondContact O-N 3Å; I244-T247 VanDerWaalsContact O-N 3.11Å; I244-I248 HydrophobicContact CG2-CD1 3.69Å; I244-I248 HydrophobicContact CG2-CG1 4.31Å; I244-I248 WeakPolarHBondContact O-CG1 3.35Å; I244-I248 PolarHBondContact O-N 3.27Å
245	S	85.4	Confident	87.8	Confident	44 Å²	44	53.6 Å²	53.6	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-56.1	-47.8	179.2	-52	0	0	0	0	111.2	D242 T247 I248 N249	D242-S245 WeakPolarHBondContact O-CB 3.4Å; D242-S245 PolarHBondContact O-N 3.3Å; S245-T247 PolarHBondContact O-N 3.02Å; S245-I248 PolarHBondContact O-N 3.06Å; S245-N249 WeakPolarHBondContact O-CB 3.18Å; S245-N249 PolarHBondContact O-N 3.45Å; S245-N249 PolarHBondContact O-ND2 2.86Å; S245-N249 PolarHBondContact O-OD1 3.35Å
246	A	86.1	Confident	87.9	Confident	8 Å²	8	53.9 Å²	53.9	7%	0.066	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-41.5	175.5	0	0	0	0	0	112.6	D242 I244 N249 N250 F256 Y330	D242-A246 WeakPolarHBondContact O-CB 3.36Å; D242-A246 PolarHBondContact O-N 3.41Å; I244-A246 VanDerWaalsContact C-N 3.34Å; I244-A246 PolarHBondContact O-N 3.36Å; A246-N249 PolarHBondContact O-N 3.29Å; A246-N250 WeakPolarHBondContact O-CB 3.4Å; A246-N250 PolarHBondContact O-N 3.11Å; A246-N250 PolarHBondContact O-ND2 3.47Å; A246-F256 HydrophobicContact CB-CD1 4.33Å; A246-F256 HydrophobicContact CB-CD2 3.74Å; A246-F256 HydrophobicContact CB-CE1 4.26Å; A246-F256 HydrophobicContact CB-CE2 3.72Å; A246-F256 HydrophobicContact CB-CG 4.05Å; A246-F256 HydrophobicContact CB-CZ 3.96Å; A246-F256 WeakPolarHBondContact O-CE2 3.46Å; A246-Y330 HydrophobicContact CB-CD2 4.06Å; A246-Y330 HydrophobicContact CB-CE2 3.32Å
247	T	84.5	Confident	88	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-42.1	176.1	-57.3	0	0	0	0	111.8	W119 S243 I244 S245 N250 R252	W119-T247 HydrophobicContact CH2-CG2 3.56Å; W119-T247 HydrophobicContact CZ2-CG2 4.47Å; W119-T247 HydrophobicContact CZ3-CG2 3.89Å; S243-T247 WeakPolarHBondContact O-CB 3.39Å; S243-T247 PolarHBondContact O-N 2.93Å; S243-T247 VanDerWaalsContact O-N 3.08Å; S243-T247 PolarHBondContact O-OG1 2.9Å; I244-T247 WeakPolarHBondContact O-CB 3.32Å; I244-T247 PolarHBondContact O-N 3Å; I244-T247 VanDerWaalsContact O-N 3.11Å; S245-T247 PolarHBondContact O-N 3.02Å; T247-N250 PolarHBondContact O-N 3.45Å; T247-R252 HydrophobicContact CG2-CB 4.48Å; T247-R252 VanDerWaalsContact O-CA 3.24Å; T247-R252 WeakPolarHBondContact O-CA 3.36Å; T247-R252 PolarHBondContact O-N 3.32Å
248	I	85.3	Confident	88.1	Confident	34 Å²	34	49.2 Å²	49.2	17%	0.174	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-49.1	176.1	-69	171.5	0	0	0	110.3	W119 F122 I244 S245 N250 N251	W119-I248 HydrophobicContact CE3-CD1 4.2Å; W119-I248 HydrophobicContact CE3-CG1 3.8Å; W119-I248 HydrophobicContact CZ3-CG1 4.19Å; F122-I248 HydrophobicContact CD1-CD1 4.1Å; F122-I248 HydrophobicContact CE1-CD1 3.67Å; F122-I248 HydrophobicContact CE1-CG2 4.43Å; F122-I248 HydrophobicContact CZ-CD1 4.22Å; I244-I248 HydrophobicContact CG2-CD1 3.69Å; I244-I248 HydrophobicContact CG2-CG1 4.31Å; I244-I248 WeakPolarHBondContact O-CG1 3.35Å; I244-I248 PolarHBondContact O-N 3.27Å; S245-I248 PolarHBondContact O-N 3.06Å; I248-N250 PolarHBondContact O-N 3.21Å; I248-N251 WeakPolarHBondContact O-CA 3.34Å; I248-N251 PolarHBondContact O-N 3.3Å
249	N	87.4	Confident	88.4	Confident	126 Å²	126	44.3 Å²	44.3	67%	0.674	23%	0.233	S	C	*	.	H	α-helix	trans	-59.9	-31.3	179.4	-68.2	-12.6	0	0	0	112.6	S245 A246 N251	S245-N249 WeakPolarHBondContact O-CB 3.18Å; S245-N249 PolarHBondContact O-N 3.45Å; S245-N249 PolarHBondContact O-ND2 2.86Å; S245-N249 PolarHBondContact O-OD1 3.35Å; A246-N249 PolarHBondContact O-N 3.29Å; N249-N251 PolarHBondContact O-N 2.84Å
250	N	84.4	Confident	88.8	Confident	67 Å²	67	43.7 Å²	43.7	36%	0.358	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	20.8	174.1	-79.3	-94.6	0	0	0	113.7	A246 T247 I248 R252 R253 K254 F256	A246-N250 WeakPolarHBondContact O-CB 3.4Å; A246-N250 PolarHBondContact O-N 3.11Å; A246-N250 PolarHBondContact O-ND2 3.47Å; T247-N250 PolarHBondContact O-N 3.45Å; I248-N250 PolarHBondContact O-N 3.21Å; N250-R252 PolarHBondContact O-N 2.92Å; N250-R252 VanDerWaalsContact O-N 3.08Å; N250-R253 WeakPolarHBondContact O-CB 3.41Å; N250-R253 PolarHBondContact O-N 3.4Å; N250-K254 HydrophobicContact CB-CB 3.84Å; N250-F256 HydrophobicContact CB-CE2 4.32Å; N250-F256 WeakPolarHBondContact ND2-CZ 3.43Å
251	N	83.3	Confident	89.4	Confident	130 Å²	130	42.5 Å²	42.5	70%	0.695	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	31.6	-175.1	-72.8	-58.9	0	0	0	113	I248 N249 R253	I248-N251 WeakPolarHBondContact O-CA 3.34Å; I248-N251 PolarHBondContact O-N 3.3Å; N249-N251 PolarHBondContact O-N 2.84Å; N251-R253 HydrophobicContact CB-CG 4.36Å; N251-R253 PolarHBondContact O-N 2.82Å
252	R	80.1	Confident	89.9	Confident	98 Å²	98	40.5 Å²	40.5	37%	0.37	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	9.9	-174.7	-49.9	171.7	-165.6	155.7	7	114.5	W119 T247 N250 Q255	W119-R252 VanDerWaalsContact CB-CZ 3.4Å; W119-R252 VanDerWaalsContact CG-CZ 3.44Å; T247-R252 HydrophobicContact CG2-CB 4.48Å; T247-R252 VanDerWaalsContact O-CA 3.24Å; T247-R252 WeakPolarHBondContact O-CA 3.36Å; T247-R252 PolarHBondContact O-N 3.32Å; N250-R252 PolarHBondContact O-N 2.92Å; N250-R252 VanDerWaalsContact O-N 3.08Å; R252-Q255 PolarHBondContact O-NE2 2.79Å
253	R	85.1	Confident	90.3	Very high	176 Å²	176	35.7 Å²	35.7	66%	0.664	17%	0.172	S	C	*	.	S	Bend	trans	-79.3	-34.7	-179.3	-63.3	-177.5	176.2	-174.5	-0.4	113.4	N250 N251 R325	N250-R253 WeakPolarHBondContact O-CB 3.41Å; N250-R253 PolarHBondContact O-N 3.4Å; N251-R253 HydrophobicContact CB-CG 4.36Å; N251-R253 PolarHBondContact O-N 2.82Å; R253-R325 VanDerWaalsContact O-CZ 3.32Å; R253-R325 PolarHBondContact O-NE 2.88Å; R253-R325 PolarHBondContact O-NH1 3Å
254	K	93.1	Very high	90.5	Very high	43 Å²	43	35.7 Å²	35.7	19%	0.187	17%	0.172	C	C	.	.	S	Bend	trans	-106.1	131.1	170.3	-171.9	179.7	170.1	-161.3	0	107.6	N250 F256 G324 R325 V326 G327 D329	N250-K254 HydrophobicContact CB-CB 3.84Å; K254-F256 HydrophobicContact CB-CE2 4.18Å; K254-F256 HydrophobicContact CB-CZ 4.42Å; K254-F256 HydrophobicContact CD-CE1 4.07Å; K254-F256 HydrophobicContact CD-CE2 4.18Å; K254-F256 HydrophobicContact CD-CZ 3.58Å; K254-F256 HydrophobicContact CG-CE1 4.49Å; K254-F256 HydrophobicContact CG-CE2 3.97Å; K254-F256 HydrophobicContact CG-CZ 3.88Å; K254-G324 WeakPolarHBondContact CB-O 3.25Å; K254-G324 WeakPolarHBondContact CG-O 3.42Å; K254-R325 WeakPolarHBondContact CA-O 3.16Å; K254-V326 VanDerWaalsContact CE-O 3.25Å; K254-V326 WeakPolarHBondContact CE-O 3.2Å; K254-G327 VanDerWaalsContact CE-N 3.33Å; K254-D329 IonicContact NZ-OD1 3.37Å; K254-D329 PolarHBondContact NZ-OD1 2.82Å; K254-D329 IonicContact NZ-OD2 2.72Å; K254-D329 PolarHBondContact NZ-OD2 2.81Å
255	Q	94.7	Very high	90.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-108.7	147.4	178.9	-62.5	-74.4	-39.3	0	0	110.4	R252 P257 L303 G306 C307 R325 V326 G327	R252-Q255 PolarHBondContact O-NE2 2.79Å; Q255-P257 WeakPolarHBondContact O-CD 3.44Å; Q255-L303 HydrophobicContact CB-CD2 3.96Å; Q255-L303 HydrophobicContact CB-CG 4.46Å; Q255-L303 HydrophobicContact CG-CD2 3.61Å; Q255-L303 HydrophobicContact CG-CG 4.15Å; Q255-L303 VanDerWaalsContact CG-O 3.29Å; Q255-L303 WeakPolarHBondContact CG-O 3.35Å; Q255-G306 VanDerWaalsContact OE1-CA 3.32Å; Q255-C307 HydrophobicContact CB-CB 4.01Å; Q255-C307 HydrophobicContact CG-CB 4.37Å; Q255-R325 PolarHBondContact N-O 3.25Å; Q255-V326 CarbonylContact O-C 3.49Å; Q255-V326 WeakPolarHBondContact O-CA 3.28Å; Q255-G327 PolarHBondContact O-N 2.8Å
256	F	96	Very high	90.6	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.026	16%	0.163	C	C	.	.			trans	-122.7	85.7	-175.8	-61.6	-96.4	0	0	0	110.1	A246 N250 K254 G327 D329 Y330	A246-F256 HydrophobicContact CB-CD1 4.33Å; A246-F256 HydrophobicContact CB-CD2 3.74Å; A246-F256 HydrophobicContact CB-CE1 4.26Å; A246-F256 HydrophobicContact CB-CE2 3.72Å; A246-F256 HydrophobicContact CB-CG 4.05Å; A246-F256 HydrophobicContact CB-CZ 3.96Å; A246-F256 WeakPolarHBondContact O-CE2 3.46Å; N250-F256 HydrophobicContact CB-CE2 4.32Å; N250-F256 WeakPolarHBondContact ND2-CZ 3.43Å; K254-F256 HydrophobicContact CB-CE2 4.18Å; K254-F256 HydrophobicContact CB-CZ 4.42Å; K254-F256 HydrophobicContact CD-CE1 4.07Å; K254-F256 HydrophobicContact CD-CE2 4.18Å; K254-F256 HydrophobicContact CD-CZ 3.58Å; K254-F256 HydrophobicContact CG-CE1 4.49Å; K254-F256 HydrophobicContact CG-CE2 3.97Å; K254-F256 HydrophobicContact CG-CZ 3.88Å; F256-G327 WeakPolarHBondContact CA-O 3.24Å; F256-D329 HydrophobicContact CD1-CB 4.01Å; F256-D329 HydrophobicContact CE1-CB 4.06Å; F256-D329 VanDerWaalsContact CE1-OD2 3.3Å; F256-D329 WeakPolarHBondContact CE1-OD2 3.31Å; F256-Y330 HydrophobicContact CB-CD2 3.96Å; F256-Y330 AromaticContact CD1-CD2 3.63Å; F256-Y330 HydrophobicContact CD1-CD2 3.63Å; F256-Y330 AromaticContact CD1-CE2 3.89Å; F256-Y330 HydrophobicContact CD1-CE2 3.89Å; F256-Y330 HydrophobicContact CE1-CD2 4.35Å; F256-Y330 HydrophobicContact CE1-CE2 4.16Å; F256-Y330 AromaticContact CG-CD2 3.98Å; F256-Y330 HydrophobicContact CG-CD2 3.98Å; F256-Y330 HydrophobicContact CG-CE2 4.37Å
257	P	96.3	Very high	90.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.164	C	C	.	.			trans	-61	140.1	175	26	-35.7	0	0	0	111.6	Q255 L310 V326 G327 L328 C331	Q255-P257 WeakPolarHBondContact O-CD 3.44Å; P257-L310 HydrophobicContact CB-CB 3.77Å; P257-L310 HydrophobicContact CG-CB 4.02Å; P257-L310 HydrophobicContact CG-CD2 4.02Å; P257-V326 HydrophobicContact CG-CG1 4.06Å; P257-G327 WeakPolarHBondContact CD-O 3.4Å; P257-L328 HydrophobicContact CG-CD2 4.25Å; P257-C331 WeakPolarHBondContact O-CA 3.02Å
258	V	96.5	Very high	90.5	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	17%	0.165	C	C	.	.	S	Bend	trans	-89	-22.4	177.9	171	0	0	0	0	111.1	W126 M235 S243 N308 R332 F333	W126-V258 HydrophobicContact CH2-CG2 4.38Å; M235-V258 HydrophobicContact CE-CB 4.1Å; M235-V258 HydrophobicContact CE-CG1 4.24Å; M235-V258 HydrophobicContact CG-CG1 4.13Å; S243-V258 WeakPolarHBondContact OG-CG2 3.21Å; V258-N308 PolarHBondContact N-O 3.4Å; V258-R332 HydrophobicContact CG1-CG 4.45Å; V258-R332 PolarHBondContact O-N 3.14Å; V258-F333 PolarHBondContact O-N 3.19Å
259	A	97.9	Very high	90.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.5	169.9	0	0	0	0	0	110.8	I231 M235 N308 L309 L310 F333	I231-A259 HydrophobicContact CG2-CB 3.93Å; M235-A259 HydrophobicContact SD-CB 3.75Å; A259-N308 PolarHBondContact N-O 2.81Å; A259-L309 HydrophobicContact CB-CB 4.48Å; A259-L309 HydrophobicContact CB-CG 4.25Å; A259-L309 WeakPolarHBondContact O-CA 3.19Å; A259-L310 PolarHBondContact O-N 3.31Å; A259-F333 CarbonylContact C-O 3.58Å; A259-F333 WeakPolarHBondContact CA-O 3.37Å; A259-F333 HydrophobicContact CB-CB 3.96Å; A259-F333 HydrophobicContact CB-CD2 4.2Å
260	L	98.3	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.9	174.9	171.9	60.6	0	0	0	109.7	L262 L310 L317 L328 F333 L334 V335 I354	L260-L262 HydrophobicContact CD1-CD2 4.04Å; L260-L262 HydrophobicContact CD2-CD2 4.36Å; L260-L262 HydrophobicContact CG-CD2 4.29Å; L260-L262 HydrophobicContact CG-CG 4.4Å; L260-L310 CarbonylContact C-O 3.59Å; L260-L310 WeakPolarHBondContact CA-O 3.43Å; L260-L310 HydrophobicContact CD1-CB 4.28Å; L260-L310 HydrophobicContact CD1-CD2 4.32Å; L260-L310 HydrophobicContact CD1-CG 4.2Å; L260-L317 HydrophobicContact CD1-CD2 3.62Å; L260-L317 HydrophobicContact CD2-CD2 3.77Å; L260-L317 HydrophobicContact CG-CD2 4.35Å; L260-L328 HydrophobicContact CD2-CD1 4.02Å; L260-L328 HydrophobicContact CD2-CD2 4Å; L260-F333 PolarHBondContact N-O 3.49Å; L260-L334 HydrophobicContact CB-CD1 4.43Å; L260-L334 HydrophobicContact CD2-CD1 4.03Å; L260-L334 HydrophobicContact CG-CD1 4.12Å; L260-L334 CarbonylContact O-C 3.58Å; L260-L334 WeakPolarHBondContact O-CA 3.31Å; L260-V335 PolarHBondContact O-N 2.96Å; L260-I354 HydrophobicContact CD2-CG2 4.02Å
261	I	98.4	Very high	91	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.7	174.9	-58	150.3	0	0	0	108.8	F227 L228 I272 L309 L310 V311 A312 V335	F227-I261 HydrophobicContact CE2-CD1 3.95Å; F227-I261 HydrophobicContact CE2-CG1 4.2Å; F227-I261 HydrophobicContact CE2-CG2 4.16Å; F227-I261 HydrophobicContact CZ-CG2 4.27Å; L228-I261 HydrophobicContact CD2-CD1 3.79Å; I261-I272 HydrophobicContact CD1-CG2 4Å; I261-I272 HydrophobicContact CG2-CD1 4.22Å; I261-I272 HydrophobicContact CG2-CG2 4.01Å; I261-L309 HydrophobicContact CD1-CD1 4.25Å; I261-L309 HydrophobicContact CD1-CD2 3.84Å; I261-L309 HydrophobicContact CD1-CG 4.15Å; I261-L310 PolarHBondContact N-O 3.33Å; I261-V311 HydrophobicContact CB-CG1 4.4Å; I261-V311 HydrophobicContact CD1-CG2 4.2Å; I261-V311 HydrophobicContact CG2-CG1 4.43Å; I261-V311 CarbonylContact O-C 3.48Å; I261-V311 WeakPolarHBondContact O-CA 3.18Å; I261-A312 PolarHBondContact O-N 3.41Å; I261-V335 CarbonylContact C-O 3.56Å; I261-V335 WeakPolarHBondContact CA-O 3.35Å; I261-V335 HydrophobicContact CB-CB 4.23Å; I261-V335 HydrophobicContact CG1-CB 3.86Å; I261-V335 HydrophobicContact CG1-CG2 3.93Å; I261-V335 HydrophobicContact CG2-CB 4.08Å; I261-V335 HydrophobicContact CG2-CG1 4.26Å
262	L	98	Very high	91.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	135.6	175.4	-61.7	179.3	0	0	0	110.5	L260 A312 L317 L334 V335 L336 D337 M342 I351 I354	L260-L262 HydrophobicContact CD1-CD2 4.04Å; L260-L262 HydrophobicContact CD2-CD2 4.36Å; L260-L262 HydrophobicContact CG-CD2 4.29Å; L260-L262 HydrophobicContact CG-CG 4.4Å; L262-A312 WeakPolarHBondContact CA-O 3.4Å; L262-A312 HydrophobicContact CD2-CB 4.44Å; L262-L317 HydrophobicContact CD2-CD2 3.83Å; L262-L334 HydrophobicContact CD1-CD1 4.37Å; L262-V335 PolarHBondContact N-O 2.79Å; L262-L336 HydrophobicContact CB-CG 4.46Å; L262-L336 HydrophobicContact CD1-CG 4.45Å; L262-D337 PolarHBondContact O-N 2.85Å; L262-M342 HydrophobicContact CB-CE 4.18Å; L262-M342 HydrophobicContact CB-SD 4.07Å; L262-I351 HydrophobicContact CD1-CG1 4.34Å; L262-I351 HydrophobicContact CD1-CG2 4.45Å; L262-I354 HydrophobicContact CD1-CG2 4.4Å
263	A	94.6	Very high	92.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.081	C	C	.	.			trans	-138.5	145.3	176.7	0	0	0	0	0	111.7	T265 L268 A269 I272 A312 T313	A263-T265 VanDerWaalsContact C-N 3.27Å; A263-T265 PolarHBondContact O-N 3.24Å; A263-L268 HydrophobicContact CB-CB 4.42Å; A263-L268 HydrophobicContact CB-CD2 4.21Å; A263-L268 HydrophobicContact CB-CG 4.07Å; A263-A269 HydrophobicContact CB-CB 4.38Å; A263-I272 HydrophobicContact CB-CD1 4.13Å; A263-A312 PolarHBondContact N-O 3.18Å; A263-T313 WeakPolarHBondContact O-CA 3.15Å
264	P	90.2	Very high	92.6	Very high	2 Å²	2	13.1 Å²	13.1	1%	0.013	7%	0.066	C	C	.	.	S	Bend	trans	-67.2	-17.7	-176.1	22.5	-33.5	0	0	0	115.4	L268 D337 E338 R341 M342 M345 F347	P264-L268 HydrophobicContact CG-CD2 4.31Å; P264-D337 WeakPolarHBondContact CD-O 3.35Å; P264-E338 HydrophobicContact CG-CB 3.66Å; P264-R341 HydrophobicContact CB-CG 4.48Å; P264-R341 HydrophobicContact CG-CB 4.31Å; P264-R341 HydrophobicContact CG-CG 4.45Å; P264-M342 HydrophobicContact CB-CG 3.61Å; P264-M342 HydrophobicContact CG-CG 4.06Å; P264-M345 HydrophobicContact CB-SD 3.87Å; P264-M345 WeakPolarHBondContact O-CE 3.46Å; P264-F347 WeakPolarHBondContact O-CE2 3.25Å
265	T	86.5	Confident	92.6	Very high	12 Å²	12	11.8 Å²	11.8	7%	0.074	6%	0.061	C	C	.	.	S	Bend	trans	-142.7	151.2	-176.1	26	0	0	0	0	113.2	A263 E267 L268 A269 R341 M345	A263-T265 VanDerWaalsContact C-N 3.27Å; A263-T265 PolarHBondContact O-N 3.24Å; T265-E267 VanDerWaalsContact C-N 3.28Å; T265-E267 PolarHBondContact O-N 3.43Å; T265-L268 PolarHBondContact O-N 3.48Å; T265-A269 WeakPolarHBondContact O-CB 3.45Å; T265-A269 PolarHBondContact O-N 3.26Å; T265-R341 PolarHBondContact OG1-NH1 2.72Å; T265-R341 PolarHBondContact OG1-NH2 3.19Å; T265-M345 HydrophobicContact CG2-CE 4.24Å
266	R	86.3	Confident	92.6	Very high	23 Å²	23	11.8 Å²	11.8	9%	0.087	6%	0.061	C	C	.	.	H	α-helix	trans	-47.2	-49.2	171.4	168.9	166.7	-172.2	140.3	-6.5	112.7	L268 A269 S270 Y291 G292 G293 Q467 E471	R266-L268 PolarHBondContact O-N 2.87Å; R266-A269 CarbonylContact O-C 3.58Å; R266-A269 WeakPolarHBondContact O-CB 3.4Å; R266-A269 PolarHBondContact O-N 2.9Å; R266-S270 PolarHBondContact O-N 2.67Å; R266-S270 PolarHBondContact O-OG 2.65Å; R266-S270 VanDerWaalsContact O-OG 3.11Å; R266-Y291 HydrophobicContact CB-CD1 4.28Å; R266-Y291 HydrophobicContact CB-CG 3.98Å; R266-Y291 HydrophobicContact CG-CD1 3.71Å; R266-Y291 HydrophobicContact CG-CD2 3.85Å; R266-Y291 HydrophobicContact CG-CE1 4.08Å; R266-Y291 HydrophobicContact CG-CE2 4.25Å; R266-Y291 HydrophobicContact CG-CG 3.58Å; R266-Y291 VanDerWaalsContact CZ-CD2 3.43Å; R266-G292 PolarHBondContact NH1-O 2.97Å; R266-G293 PolarHBondContact NH1-O 3.29Å; R266-Q467 VanDerWaalsContact CD-CD 3.44Å; R266-Q467 VanDerWaalsContact CD-NE2 3.34Å; R266-Q467 VanDerWaalsContact CZ-CD 3.42Å; R266-Q467 VanDerWaalsContact NE-CD 3.29Å; R266-Q467 VanDerWaalsContact NE-NE2 3.1Å; R266-E471 IonicContact CZ-OE1 3.7Å; R266-E471 IonicContact NE-OE1 3.99Å; R266-E471 PolarHBondContact NE-OE1 3.13Å; R266-E471 IonicContact NH2-OE1 2.78Å; R266-E471 PolarHBondContact NH2-OE1 3.08Å; R266-E471 IonicContact NH2-OE2 2.81Å
267	E	81.2	Confident	92.6	Very high	17 Å²	17	14.4 Å²	14.4	8%	0.079	7%	0.07	C	C	.	.	H	α-helix	trans	-70.6	-35.1	-171.2	-64.7	88.8	165.1	0	0	112.5	T265 Q271 R470 L474 L495	T265-E267 VanDerWaalsContact C-N 3.28Å; T265-E267 PolarHBondContact O-N 3.43Å; E267-Q271 WeakPolarHBondContact O-CB 3.39Å; E267-Q271 PolarHBondContact O-N 3.49Å; E267-R470 IonicContact OE1-CZ 2.9Å; E267-R470 IonicContact OE1-NE 2.68Å; E267-R470 PolarHBondContact OE1-NE 2.96Å; E267-R470 IonicContact OE1-NH2 2.85Å; E267-R470 PolarHBondContact OE1-NH2 2.89Å; E267-R470 IonicContact OE2-NH2 3.27Å; E267-L474 HydrophobicContact CG-CD1 4.09Å; E267-L495 HydrophobicContact CB-CD2 3.62Å; E267-L495 HydrophobicContact CG-CD2 3.51Å
268	L	86.5	Confident	92.5	Very high	7 Å²	7	16.9 Å²	16.9	4%	0.037	8%	0.081	C	C	.	.	H	α-helix	trans	-70.5	-39.8	170.2	-178.7	55.4	0	0	0	111.1	A263 P264 T265 R266 S270 Q271 I272 E338 G494	A263-L268 HydrophobicContact CB-CB 4.42Å; A263-L268 HydrophobicContact CB-CD2 4.21Å; A263-L268 HydrophobicContact CB-CG 4.07Å; P264-L268 HydrophobicContact CG-CD2 4.31Å; T265-L268 PolarHBondContact O-N 3.48Å; R266-L268 PolarHBondContact O-N 2.87Å; L268-S270 PolarHBondContact O-N 3.09Å; L268-Q271 PolarHBondContact O-N 3.31Å; L268-I272 HydrophobicContact CD1-CD1 3.93Å; L268-I272 HydrophobicContact CD1-CG1 4.08Å; L268-I272 HydrophobicContact CG-CD1 3.86Å; L268-I272 HydrophobicContact CG-CG1 4.45Å; L268-I272 VanDerWaalsContact O-CG1 3.27Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 3.48Å; L268-E338 HydrophobicContact CD2-CB 4.1Å; L268-E338 HydrophobicContact CD2-CG 3.82Å; L268-G494 PolarHBondContact N-O 2.89Å
269	A	92.1	Very high	92.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.6	-41.4	173.9	0	0	0	0	0	112.1	A263 T265 R266 F273 V289 Y291 V311	A263-A269 HydrophobicContact CB-CB 4.38Å; T265-A269 WeakPolarHBondContact O-CB 3.45Å; T265-A269 PolarHBondContact O-N 3.26Å; R266-A269 CarbonylContact O-C 3.58Å; R266-A269 WeakPolarHBondContact O-CB 3.4Å; R266-A269 PolarHBondContact O-N 2.9Å; A269-F273 VanDerWaalsContact O-CB 3.24Å; A269-F273 WeakPolarHBondContact O-CB 3.29Å; A269-F273 PolarHBondContact O-N 2.77Å; A269-V289 HydrophobicContact CB-CG2 4.02Å; A269-Y291 HydrophobicContact CB-CD1 4.39Å; A269-V311 HydrophobicContact CB-CG1 3.92Å; A269-V311 WeakPolarHBondContact O-CG1 3.23Å
270	S	89.5	Confident	92.2	Very high	27 Å²	27	17.2 Å²	17.2	19%	0.189	8%	0.084	C	C	.	.	H	α-helix	trans	-64.5	-41.6	173.3	-61	0	0	0	0	112.3	R266 L268 F273 D274 Y291	R266-S270 PolarHBondContact O-N 2.67Å; R266-S270 PolarHBondContact O-OG 2.65Å; R266-S270 VanDerWaalsContact O-OG 3.11Å; L268-S270 PolarHBondContact O-N 3.09Å; S270-F273 WeakPolarHBondContact O-CB 3.46Å; S270-F273 PolarHBondContact O-N 3.19Å; S270-D274 PolarHBondContact O-N 2.72Å; S270-Y291 VanDerWaalsContact OG-CE1 3.22Å; S270-Y291 WeakPolarHBondContact OG-CE1 3.35Å
271	Q	86.6	Confident	92.1	Very high	42 Å²	42	18 Å²	18	20%	0.196	9%	0.087	C	C	.	.	H	α-helix	trans	-61.3	-50.6	175.8	-178.5	-164.7	-7.3	0	0	111.5	E267 L268 F273 D274 D275 D496	E267-Q271 WeakPolarHBondContact O-CB 3.39Å; E267-Q271 PolarHBondContact O-N 3.49Å; L268-Q271 PolarHBondContact O-N 3.31Å; Q271-F273 PolarHBondContact O-N 3.35Å; Q271-D274 PolarHBondContact O-N 2.89Å; Q271-D275 PolarHBondContact O-N 3.06Å; Q271-D496 HydrophobicContact CG-CB 4.27Å
272	I	93.5	Very high	91.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-35.7	178.4	-65.2	166.3	0	0	0	110.4	T224 F227 I261 A263 L268 A276 V311 D337	T224-I272 HydrophobicContact CG2-CB 4.36Å; T224-I272 HydrophobicContact CG2-CG1 3.9Å; T224-I272 HydrophobicContact CG2-CG2 4.45Å; F227-I272 HydrophobicContact CE2-CG2 4.18Å; F227-I272 HydrophobicContact CZ-CD1 4.39Å; F227-I272 HydrophobicContact CZ-CG2 4.27Å; I261-I272 HydrophobicContact CD1-CG2 4Å; I261-I272 HydrophobicContact CG2-CD1 4.22Å; I261-I272 HydrophobicContact CG2-CG2 4.01Å; A263-I272 HydrophobicContact CB-CD1 4.13Å; L268-I272 HydrophobicContact CD1-CD1 3.93Å; L268-I272 HydrophobicContact CD1-CG1 4.08Å; L268-I272 HydrophobicContact CG-CD1 3.86Å; L268-I272 HydrophobicContact CG-CG1 4.45Å; L268-I272 VanDerWaalsContact O-CG1 3.27Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 3.48Å; I272-A276 VanDerWaalsContact O-CB 3.25Å; I272-A276 WeakPolarHBondContact O-CB 3.31Å; I272-A276 PolarHBondContact O-N 2.86Å; I272-V311 HydrophobicContact CB-CG1 3.99Å; I272-V311 HydrophobicContact CG2-CG1 3.91Å; I272-V311 HydrophobicContact CG2-CG2 3.89Å; I272-D337 HydrophobicContact CD1-CB 4.35Å
273	F	95.4	Very high	91.7	Very high	28 Å²	28	20.9 Å²	20.9	12%	0.123	10%	0.099	C	C	.	.	H	α-helix	trans	-65.6	-45	173.7	168.1	-104.4	0	0	0	112.8	A269 S270 Q271 A276 R277 P287 V289 V311	A269-F273 VanDerWaalsContact O-CB 3.24Å; A269-F273 WeakPolarHBondContact O-CB 3.29Å; A269-F273 PolarHBondContact O-N 2.77Å; S270-F273 WeakPolarHBondContact O-CB 3.46Å; S270-F273 PolarHBondContact O-N 3.19Å; Q271-F273 PolarHBondContact O-N 3.35Å; F273-A276 WeakPolarHBondContact O-CB 3.03Å; F273-A276 PolarHBondContact O-N 2.95Å; F273-R277 HydrophobicContact CE2-CG 4.38Å; F273-R277 HydrophobicContact CZ-CG 4.35Å; F273-R277 VanDerWaalsContact O-CG 3.32Å; F273-R277 WeakPolarHBondContact O-CG 3.28Å; F273-R277 PolarHBondContact O-N 2.9Å; F273-P287 HydrophobicContact CD2-CB 4.1Å; F273-P287 HydrophobicContact CD2-CG 4.48Å; F273-P287 HydrophobicContact CE2-CB 4.24Å; F273-P287 HydrophobicContact CE2-CG 4.3Å; F273-V289 HydrophobicContact CB-CB 3.92Å; F273-V289 HydrophobicContact CB-CG2 4.15Å; F273-V289 HydrophobicContact CD1-CB 4.28Å; F273-V289 HydrophobicContact CD1-CG1 4.06Å; F273-V289 HydrophobicContact CD2-CB 3.84Å; F273-V289 HydrophobicContact CD2-CG1 4.25Å; F273-V289 HydrophobicContact CE1-CG1 4.19Å; F273-V289 HydrophobicContact CE2-CB 4.37Å; F273-V289 HydrophobicContact CE2-CG1 4.4Å; F273-V289 HydrophobicContact CG-CB 3.77Å; F273-V289 HydrophobicContact CG-CG1 4.06Å; F273-V289 HydrophobicContact CG-CG2 4.5Å; F273-V289 HydrophobicContact CZ-CG1 4.34Å; F273-V311 HydrophobicContact CB-CG2 4.22Å
274	D	92.1	Very high	91.5	Very high	65 Å²	65	23 Å²	23	35%	0.348	11%	0.109	S	C	.	.	H	α-helix	trans	-67.2	-36.1	176.1	-82.3	-32.5	0	0	0	112.5	S270 Q271 R277 K278	S270-D274 PolarHBondContact O-N 2.72Å; Q271-D274 PolarHBondContact O-N 2.89Å; D274-R277 WeakPolarHBondContact O-CB 3.5Å; D274-R277 PolarHBondContact O-N 2.69Å; D274-R277 IonicContact OD1-CZ 2.71Å; D274-R277 IonicContact OD1-NH1 3.87Å; D274-R277 PolarHBondContact OD1-NH1 3.07Å; D274-K278 WeakPolarHBondContact O-CG 3.48Å; D274-K278 PolarHBondContact O-N 3.1Å
275	D	93	Very high	91.7	Very high	16 Å²	16	23 Å²	23	9%	0.086	11%	0.109	C	C	.	.	H	α-helix	trans	-67	-39.1	170.6	-77.6	-15.1	0	0	0	111.7	T224 L228 Q271 R277 K278 F279	T224-D275 HydrophobicContact CG2-CB 4Å; T224-D275 WeakPolarHBondContact CG2-OD2 3.16Å; L228-D275 HydrophobicContact CD1-CB 3.72Å; Q271-D275 PolarHBondContact O-N 3.06Å; D275-R277 VanDerWaalsContact C-N 3.32Å; D275-R277 PolarHBondContact O-N 3.43Å; D275-K278 WeakPolarHBondContact O-CB 3.48Å; D275-K278 PolarHBondContact O-N 3.4Å; D275-K278 WeakPolarHBondContact OD1-CE 3.44Å; D275-K278 IonicContact OD1-NZ 2.72Å; D275-K278 PolarHBondContact OD1-NZ 3.07Å; D275-F279 HydrophobicContact CB-CE2 4.22Å; D275-F279 WeakPolarHBondContact O-CD2 3.23Å; D275-F279 PolarHBondContact O-N 2.87Å
276	A	96.3	Very high	92.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-39.3	173	0	0	0	0	0	111.5	L228 I272 F273 K278 F279 S280 P287 L309	L228-A276 HydrophobicContact CD1-CB 4.26Å; L228-A276 HydrophobicContact CD2-CB 4.02Å; I272-A276 VanDerWaalsContact O-CB 3.25Å; I272-A276 WeakPolarHBondContact O-CB 3.31Å; I272-A276 PolarHBondContact O-N 2.86Å; F273-A276 WeakPolarHBondContact O-CB 3.03Å; F273-A276 PolarHBondContact O-N 2.95Å; A276-K278 PolarHBondContact O-N 3.39Å; A276-F279 PolarHBondContact O-N 2.96Å; A276-S280 VanDerWaalsContact O-CB 3.24Å; A276-S280 WeakPolarHBondContact O-CB 3.26Å; A276-S280 PolarHBondContact O-N 2.84Å; A276-S280 PolarHBondContact O-OG 2.76Å; A276-P287 HydrophobicContact CB-CB 4.08Å; A276-L309 HydrophobicContact CB-CD1 4.26Å; A276-L309 HydrophobicContact CB-CD2 4Å
277	R	95.3	Very high	92.6	Very high	60 Å²	60	22.8 Å²	22.8	23%	0.226	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-36.7	173.5	-70.7	170.5	68.1	-143.3	0.9	112.8	E139 L140 F273 D274 D275 Y281 P287	E139-R277 IonicContact OE1-CZ 3.76Å; E139-R277 IonicContact OE1-NH1 3.29Å; E139-R277 IonicContact OE1-NH2 2.77Å; E139-R277 PolarHBondContact OE1-NH2 3.33Å; L140-R277 HydrophobicContact CD2-CB 3.72Å; F273-R277 HydrophobicContact CE2-CG 4.38Å; F273-R277 HydrophobicContact CZ-CG 4.35Å; F273-R277 VanDerWaalsContact O-CG 3.32Å; F273-R277 WeakPolarHBondContact O-CG 3.28Å; F273-R277 PolarHBondContact O-N 2.9Å; D274-R277 WeakPolarHBondContact O-CB 3.5Å; D274-R277 PolarHBondContact O-N 2.69Å; D274-R277 IonicContact OD1-CZ 2.71Å; D274-R277 IonicContact OD1-NH1 3.87Å; D274-R277 PolarHBondContact OD1-NH1 3.07Å; D275-R277 VanDerWaalsContact C-N 3.32Å; D275-R277 PolarHBondContact O-N 3.43Å; R277-Y281 PolarHBondContact O-N 2.83Å; R277-Y281 VanDerWaalsContact O-N 3.14Å; R277-P287 HydrophobicContact CG-CG 3.71Å
278	K	93.6	Very high	93.4	Very high	52 Å²	52	22.1 Å²	22.1	23%	0.226	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-56.2	172.9	-67.2	165.5	-158.9	165.6	0	110.5	L140 F141 N187 D274 D275 A276 S280 Y281	L140-K278 HydrophobicContact CB-CG 4.05Å; L140-K278 HydrophobicContact CD2-CG 4.39Å; L140-K278 VanDerWaalsContact O-CE 3.3Å; L140-K278 WeakPolarHBondContact O-CE 3.41Å; F141-K278 HydrophobicContact CE1-CB 3.89Å; F141-K278 HydrophobicContact CE1-CG 4.3Å; F141-K278 HydrophobicContact CZ-CB 4.21Å; F141-K278 WeakPolarHBondContact CZ-O 3.44Å; N187-K278 PolarHBondContact ND2-O 3.07Å; D274-K278 WeakPolarHBondContact O-CG 3.48Å; D274-K278 PolarHBondContact O-N 3.1Å; D275-K278 WeakPolarHBondContact O-CB 3.48Å; D275-K278 PolarHBondContact O-N 3.4Å; D275-K278 WeakPolarHBondContact OD1-CE 3.44Å; D275-K278 IonicContact OD1-NZ 2.72Å; D275-K278 PolarHBondContact OD1-NZ 3.07Å; A276-K278 PolarHBondContact O-N 3.39Å; K278-S280 VanDerWaalsContact C-N 3.33Å; K278-S280 PolarHBondContact O-N 3.26Å; K278-Y281 VanDerWaalsContact O-CB 3.23Å; K278-Y281 WeakPolarHBondContact O-CB 3.32Å; K278-Y281 PolarHBondContact O-N 3.07Å
279	F	94.8	Very high	93.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-72.7	-22.9	-174.6	-59.5	-57.2	0	0	0	113.7	N187 V188 A191 Y193 A225 L228 I229 L232 D275 A276	N187-F279 PolarHBondContact ND2-O 2.72Å; V188-F279 HydrophobicContact CG2-CD1 4.2Å; V188-F279 HydrophobicContact CG2-CE1 4.18Å; A191-F279 HydrophobicContact CB-CE1 4.32Å; Y193-F279 HydrophobicContact CD2-CE1 4.48Å; Y193-F279 HydrophobicContact CD2-CZ 4.42Å; Y193-F279 HydrophobicContact CE2-CE1 4.1Å; Y193-F279 AromaticContact CE2-CZ 3.62Å; Y193-F279 HydrophobicContact CE2-CZ 3.62Å; Y193-F279 AromaticContact CZ-CZ 4Å; A225-F279 HydrophobicContact CB-CE2 3.94Å; A225-F279 HydrophobicContact CB-CZ 3.89Å; L228-F279 HydrophobicContact CB-CD2 3.94Å; L228-F279 HydrophobicContact CD1-CD2 3.98Å; L228-F279 HydrophobicContact CD1-CE2 4.33Å; I229-F279 HydrophobicContact CD1-CE1 4.35Å; I229-F279 HydrophobicContact CG1-CD1 4.21Å; I229-F279 HydrophobicContact CG1-CE1 4.28Å; I229-F279 HydrophobicContact CG1-CG 4.44Å; L232-F279 HydrophobicContact CD1-CB 3.45Å; L232-F279 VanDerWaalsContact CD1-CB 3.45Å; D275-F279 HydrophobicContact CB-CE2 4.22Å; D275-F279 WeakPolarHBondContact O-CD2 3.23Å; D275-F279 PolarHBondContact O-N 2.87Å; A276-F279 PolarHBondContact O-N 2.96Å
280	S	95	Very high	94.1	Very high	10 Å²	10	22.2 Å²	22.2	7%	0.07	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	3.1	172.5	91.2	0	0	0	0	114.4	A276 K278 R282 S283 I285	A276-S280 VanDerWaalsContact O-CB 3.24Å; A276-S280 WeakPolarHBondContact O-CB 3.26Å; A276-S280 PolarHBondContact O-N 2.84Å; A276-S280 PolarHBondContact O-OG 2.76Å; K278-S280 VanDerWaalsContact C-N 3.33Å; K278-S280 PolarHBondContact O-N 3.26Å; S280-R282 PolarHBondContact O-N 3.16Å; S280-S283 VanDerWaalsContact O-CB 3.32Å; S280-S283 WeakPolarHBondContact O-CB 3.46Å; S280-S283 PolarHBondContact O-N 3.18Å; S280-S283 PolarHBondContact O-OG 3.28Å; S280-I285 PolarHBondContact OG-O 2.81Å
281	Y	95.3	Very high	94.3	Very high	15 Å²	15	22.7 Å²	22.7	6%	0.059	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	137.2	176.6	178.4	-118.1	0	0	0	111	N133 T136 E137 L140 F141 I183 N187 L190 R277 K278 S283	N133-Y281 PolarHBondContact N-OH 3.33Å; N133-Y281 PolarHBondContact O-OH 2.93Å; T136-Y281 HydrophobicContact CG2-CD2 4.12Å; T136-Y281 HydrophobicContact CG2-CE2 3.91Å; E137-Y281 HydrophobicContact CB-CE1 4.29Å; E137-Y281 HydrophobicContact CG-CE1 3.85Å; E137-Y281 PolarHBondContact OE2-OH 3.06Å; L140-Y281 HydrophobicContact CD1-CD2 3.91Å; L140-Y281 HydrophobicContact CD1-CG 4.3Å; F141-Y281 AromaticContact CE2-CD1 3.61Å; F141-Y281 HydrophobicContact CE2-CD1 3.61Å; F141-Y281 HydrophobicContact CE2-CE1 4.18Å; F141-Y281 AromaticContact CE2-CG 3.91Å; F141-Y281 HydrophobicContact CE2-CG 3.91Å; F141-Y281 HydrophobicContact CZ-CD1 4.14Å; F141-Y281 HydrophobicContact CZ-CG 4.35Å; I183-Y281 WeakPolarHBondContact CG2-O 3.18Å; N187-Y281 PolarHBondContact ND2-N 3.08Å; N187-Y281 PolarHBondContact ND2-O 3.2Å; L190-Y281 HydrophobicContact CD1-CD1 4.07Å; L190-Y281 HydrophobicContact CD1-CE1 4.1Å; R277-Y281 PolarHBondContact O-N 2.83Å; R277-Y281 VanDerWaalsContact O-N 3.14Å; K278-Y281 VanDerWaalsContact O-CB 3.23Å; K278-Y281 WeakPolarHBondContact O-CB 3.32Å; K278-Y281 PolarHBondContact O-N 3.07Å; Y281-S283 PolarHBondContact O-N 2.96Å; Y281-S283 VanDerWaalsContact O-N 3.12Å
282	R	93.2	Very high	94.4	Very high	57 Å²	57	22.2 Å²	22.2	22%	0.215	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	19.5	-175.3	-57.5	172.1	64.5	-152.9	-7.3	115.6	Q129 L130 S280	Q129-R282 WeakPolarHBondContact CA-O 3.37Å; Q129-R282 VanDerWaalsContact CD-CZ 3.48Å; Q129-R282 VanDerWaalsContact CD-NH2 3.29Å; Q129-R282 HydrophobicContact CG-CB 4.04Å; L130-R282 HydrophobicContact CB-CB 4.33Å; L130-R282 PolarHBondContact N-O 3.49Å; L130-R282 PolarHBondContact O-NE 3Å; L130-R282 PolarHBondContact O-NH2 2.92Å; S280-R282 PolarHBondContact O-N 3.16Å
283	S	93.6	Very high	93.9	Very high	6 Å²	6	24.9 Å²	24.9	4%	0.042	14%	0.138	C	C	.	.	S	Bend	trans	-102.7	168.8	165.5	79.2	0	0	0	0	111.9	L130 S280 Y281 I285	L130-S283 VanDerWaalsContact CD1-O 3.24Å; L130-S283 WeakPolarHBondContact CD1-O 3.35Å; S280-S283 VanDerWaalsContact O-CB 3.32Å; S280-S283 WeakPolarHBondContact O-CB 3.46Å; S280-S283 PolarHBondContact O-N 3.18Å; S280-S283 PolarHBondContact O-OG 3.28Å; Y281-S283 PolarHBondContact O-N 2.96Å; Y281-S283 VanDerWaalsContact O-N 3.12Å; S283-I285 VanDerWaalsContact C-N 3.26Å; S283-I285 WeakPolarHBondContact OG-CB 3.33Å; S283-I285 PolarHBondContact OG-N 3.02Å; S283-I285 VanDerWaalsContact OG-N 3.11Å
284	L	91.9	Very high	93.4	Very high	43 Å²	43	24.8 Å²	24.8	23%	0.225	14%	0.143	C	C	.	.	S	Bend	trans	-80.3	-0.6	169	-70.2	171.6	0	0	0	113.8	E124 W126 L130 R286 N308	E124-L284 HydrophobicContact CB-CD1 4.03Å; E124-L284 HydrophobicContact CG-CD1 4.15Å; W126-L284 HydrophobicContact CG-CB 4.34Å; L130-L284 HydrophobicContact CD1-CD2 4.35Å; L130-L284 HydrophobicContact CD2-CD2 4.02Å; L130-L284 HydrophobicContact CD2-CG 4.48Å; L284-R286 PolarHBondContact O-N 3.29Å; L284-N308 PolarHBondContact O-OD1 3.45Å
285	I	94.2	Very high	93.4	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	15%	0.147	C	C	.	.			trans	-80	111.4	178.7	-61.7	174.4	0	0	0	109.2	W126 L232 M235 I236 S280 S283 P287 N308 L309	W126-I285 HydrophobicContact CD2-CG1 4.12Å; W126-I285 HydrophobicContact CE3-CD1 3.94Å; W126-I285 HydrophobicContact CE3-CG1 3.62Å; W126-I285 HydrophobicContact CH2-CG1 4.4Å; W126-I285 HydrophobicContact CZ3-CD1 4.13Å; W126-I285 HydrophobicContact CZ3-CG1 3.8Å; L232-I285 HydrophobicContact CD2-CD1 3.85Å; L232-I285 HydrophobicContact CD2-CG2 3.91Å; M235-I285 HydrophobicContact CB-CD1 3.66Å; M235-I285 HydrophobicContact CE-CD1 3.98Å; M235-I285 HydrophobicContact CE-CG1 4.3Å; M235-I285 HydrophobicContact CE-CG2 3.82Å; M235-I285 HydrophobicContact SD-CD1 4.46Å; I236-I285 HydrophobicContact CD1-CD1 4.36Å; I236-I285 HydrophobicContact CG1-CD1 3.67Å; S280-I285 PolarHBondContact OG-O 2.81Å; S283-I285 VanDerWaalsContact C-N 3.26Å; S283-I285 WeakPolarHBondContact OG-CB 3.33Å; S283-I285 PolarHBondContact OG-N 3.02Å; S283-I285 VanDerWaalsContact OG-N 3.11Å; I285-P287 VanDerWaalsContact O-CD 3.23Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å; I285-N308 HydrophobicContact CG2-CB 3.99Å; I285-L309 HydrophobicContact CG2-CB 4.34Å
286	R	94.4	Very high	93.4	Very high	23 Å²	23	26.3 Å²	26.3	9%	0.087	15%	0.15	C	C	.	.			trans	-89.7	108.8	171.3	-168.7	166.9	-177	-70.6	3.8	110.1	V114 L284 C288 E302 E305 G306 N308 L309	V114-R286 HydrophobicContact CG1-CG 4.26Å; L284-R286 PolarHBondContact O-N 3.29Å; R286-C288 PolarHBondContact NH1-SG 3.44Å; R286-E302 PolarHBondContact NH1-O 3.05Å; R286-E302 PolarHBondContact NH2-O 2.87Å; R286-E305 IonicContact CZ-OE2 3.2Å; R286-E305 IonicContact NE-OE2 2.82Å; R286-E305 IonicContact NH2-OE2 2.72Å; R286-E305 PolarHBondContact NH2-OE2 3.37Å; R286-G306 VanDerWaalsContact CD-O 3.24Å; R286-G306 WeakPolarHBondContact CD-O 3.32Å; R286-G306 WeakPolarHBondContact CG-O 3.32Å; R286-G306 PolarHBondContact NH1-O 3.33Å; R286-N308 PolarHBondContact N-OD1 2.66Å; R286-N308 PolarHBondContact O-N 2.92Å; R286-L309 PolarHBondContact O-N 3.28Å
287	P	96.9	Very high	93.2	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.058	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	154.5	166.7	32.2	-35.1	0	0	0	110.4	F273 A276 R277 I285 L309	F273-P287 HydrophobicContact CD2-CB 4.1Å; F273-P287 HydrophobicContact CD2-CG 4.48Å; F273-P287 HydrophobicContact CE2-CB 4.24Å; F273-P287 HydrophobicContact CE2-CG 4.3Å; A276-P287 HydrophobicContact CB-CB 4.08Å; R277-P287 HydrophobicContact CG-CG 3.71Å; I285-P287 VanDerWaalsContact O-CD 3.23Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å; P287-L309 CarbonylContact C-O 3.58Å; P287-L309 VanDerWaalsContact CA-O 3.24Å; P287-L309 WeakPolarHBondContact CA-O 3.48Å; P287-L309 HydrophobicContact CB-CD2 4.08Å
288	C	97.1	Very high	93.1	Very high	3 Å²	3	35 Å²	35	2%	0.02	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.7	173.1	-69.6	0	0	0	0	110.2	R286 G306 C307 L309 L310 V311	R286-C288 PolarHBondContact NH1-SG 3.44Å; C288-G306 PolarHBondContact SG-O 3.44Å; C288-G306 VanDerWaalsContact SG-O 3.34Å; C288-C307 HydrophobicContact CB-CB 4.41Å; C288-L309 PolarHBondContact N-O 3.31Å; C288-L310 HydrophobicContact CB-CD1 4Å; C288-V311 PolarHBondContact O-N 3.46Å
289	V	96.9	Very high	93.1	Very high	8 Å²	8	33 Å²	33	5%	0.048	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139	175.2	70.2	0	0	0	0	113	A269 F273 Y291 V311	A269-V289 HydrophobicContact CB-CG2 4.02Å; F273-V289 HydrophobicContact CB-CB 3.92Å; F273-V289 HydrophobicContact CB-CG2 4.15Å; F273-V289 HydrophobicContact CD1-CB 4.28Å; F273-V289 HydrophobicContact CD1-CG1 4.06Å; F273-V289 HydrophobicContact CD2-CB 3.84Å; F273-V289 HydrophobicContact CD2-CG1 4.25Å; F273-V289 HydrophobicContact CE1-CG1 4.19Å; F273-V289 HydrophobicContact CE2-CB 4.37Å; F273-V289 HydrophobicContact CE2-CG1 4.4Å; F273-V289 HydrophobicContact CG-CB 3.77Å; F273-V289 HydrophobicContact CG-CG1 4.06Å; F273-V289 HydrophobicContact CG-CG2 4.5Å; F273-V289 HydrophobicContact CZ-CG1 4.34Å; V289-Y291 HydrophobicContact CB-CE1 4.26Å; V289-Y291 HydrophobicContact CG1-CD1 4.4Å; V289-Y291 HydrophobicContact CG1-CE1 3.68Å; V289-Y291 HydrophobicContact CG2-CD1 3.51Å; V289-Y291 HydrophobicContact CG2-CE1 3.55Å; V289-V311 CarbonylContact C-O 3.58Å; V289-V311 VanDerWaalsContact CA-O 3.29Å; V289-V311 WeakPolarHBondContact CA-O 3.34Å; V289-V311 HydrophobicContact CG2-CB 4.34Å
290	L	96.9	Very high	93	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.8	178.2	-73.2	-179.4	0	0	0	111.8	Q299 L303 L310 V311 A312 T313 R316 L317 V320	L290-Q299 HydrophobicContact CD2-CB 3.8Å; L290-Q299 HydrophobicContact CD2-CG 4.14Å; L290-L303 HydrophobicContact CD1-CD1 3.97Å; L290-L303 HydrophobicContact CD2-CD1 4.35Å; L290-L303 HydrophobicContact CG-CD1 4.3Å; L290-L310 HydrophobicContact CB-CD1 4.5Å; L290-L310 HydrophobicContact CD1-CD1 3.86Å; L290-L310 HydrophobicContact CD1-CD2 4.15Å; L290-L310 HydrophobicContact CD1-CG 4.5Å; L290-L310 HydrophobicContact CG-CD1 3.89Å; L290-V311 PolarHBondContact N-O 3.11Å; L290-A312 HydrophobicContact CB-CB 3.97Å; L290-A312 CarbonylContact O-C 3.57Å; L290-A312 WeakPolarHBondContact O-CA 3.4Å; L290-T313 PolarHBondContact O-N 2.76Å; L290-R316 HydrophobicContact CB-CG 4.11Å; L290-L317 HydrophobicContact CD1-CD1 4.15Å; L290-V320 HydrophobicContact CD1-CB 4.15Å; L290-V320 HydrophobicContact CD1-CG1 3.89Å; L290-V320 HydrophobicContact CD1-CG2 4.14Å; L290-V320 HydrophobicContact CD2-CG2 4.39Å
291	Y	94.2	Very high	92.9	Very high	36 Å²	36	37.5 Å²	37.5	14%	0.141	21%	0.205	C	C	.	.			trans	-143.4	157.4	178.1	43.9	-121.7	0	0	0	113.9	R266 A269 S270 V289 A294 Q299 T313 R316	R266-Y291 HydrophobicContact CB-CD1 4.28Å; R266-Y291 HydrophobicContact CB-CG 3.98Å; R266-Y291 HydrophobicContact CG-CD1 3.71Å; R266-Y291 HydrophobicContact CG-CD2 3.85Å; R266-Y291 HydrophobicContact CG-CE1 4.08Å; R266-Y291 HydrophobicContact CG-CE2 4.25Å; R266-Y291 HydrophobicContact CG-CG 3.58Å; R266-Y291 VanDerWaalsContact CZ-CD2 3.43Å; A269-Y291 HydrophobicContact CB-CD1 4.39Å; S270-Y291 VanDerWaalsContact OG-CE1 3.22Å; S270-Y291 WeakPolarHBondContact OG-CE1 3.35Å; V289-Y291 HydrophobicContact CB-CE1 4.26Å; V289-Y291 HydrophobicContact CG1-CD1 4.4Å; V289-Y291 HydrophobicContact CG1-CE1 3.68Å; V289-Y291 HydrophobicContact CG2-CD1 3.51Å; V289-Y291 HydrophobicContact CG2-CE1 3.55Å; Y291-A294 HydrophobicContact CD2-CB 4.08Å; Y291-A294 HydrophobicContact CE2-CB 3.77Å; Y291-Q299 VanDerWaalsContact CE2-NE2 3.34Å; Y291-Q299 PolarHBondContact O-NE2 2.96Å; Y291-T313 WeakPolarHBondContact CA-OG1 3.44Å; Y291-R316 PolarHBondContact O-NH1 2.75Å; Y291-R316 VanDerWaalsContact O-NH1 3.11Å
292	G	88.6	Confident	92.7	Very high	33 Å²	33	40 Å²	40	34%	0.34	22%	0.217	S	C	.	.	S	Bend	trans	-62.6	167.5	171.5	0	0	0	0	0	113.6	R266 A294	R266-G292 PolarHBondContact NH1-O 2.97Å; G292-A294 PolarHBondContact O-N 2.99Å
293	G	83.5	Confident	92.7	Very high	55 Å²	55	37.3 Å²	37.3	57%	0.567	21%	0.207	S	C	*	.	S	Bend	trans	67.2	16.8	178.3	0	0	0	0	0	115.2	R266 Q467	R266-G293 PolarHBondContact NH1-O 3.29Å; G293-Q467 VanDerWaalsContact O-CB 3.27Å; G293-Q467 WeakPolarHBondContact O-CB 3.34Å; G293-Q467 WeakPolarHBondContact O-CG 3.35Å
294	A	85.5	Confident	92.5	Very high	27 Å²	27	39 Å²	39	22%	0.223	22%	0.219	C	C	.	.	S	Bend	trans	-129.5	155.6	170.1	0	0	0	0	0	111	Y291 G292 M296 R316	Y291-A294 HydrophobicContact CD2-CB 4.08Å; Y291-A294 HydrophobicContact CE2-CB 3.77Å; G292-A294 PolarHBondContact O-N 2.99Å; A294-M296 PolarHBondContact O-N 3.43Å; A294-M296 VanDerWaalsContact O-N 3.12Å; A294-R316 PolarHBondContact O-NH1 3.3Å; A294-R316 PolarHBondContact O-NH2 2.99Å; A294-R316 VanDerWaalsContact O-NH2 3.13Å
295	D	90.7	Very high	92.3	Very high	83 Å²	83	38.8 Å²	38.8	44%	0.444	22%	0.217	S	C	.	.			trans	-51.9	115.5	172.3	170.7	36.6	0	0	0	111.3	R297 T298 Q299	D295-R297 PolarHBondContact O-N 2.91Å; D295-R297 VanDerWaalsContact OD1-CB 3.29Å; D295-R297 WeakPolarHBondContact OD1-CB 3.32Å; D295-R297 PolarHBondContact OD1-N 3.25Å; D295-R297 WeakPolarHBondContact OD2-CB 3.36Å; D295-T298 PolarHBondContact O-N 3.29Å; D295-T298 VanDerWaalsContact OD2-CB 3.27Å; D295-T298 WeakPolarHBondContact OD2-CB 3.5Å; D295-T298 PolarHBondContact OD2-N 3.08Å; D295-T298 PolarHBondContact OD2-OG1 2.72Å; D295-Q299 PolarHBondContact O-N 3.43Å
296	M	92.5	Very high	92.2	Very high	30 Å²	30	38.8 Å²	38.8	15%	0.148	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-35.9	174.4	179.2	67.6	79.3	0	0	111.4	A294 T298 Q299 L300 D319 V320	A294-M296 PolarHBondContact O-N 3.43Å; A294-M296 VanDerWaalsContact O-N 3.12Å; M296-T298 PolarHBondContact O-N 2.72Å; M296-Q299 PolarHBondContact O-N 3.39Å; M296-L300 HydrophobicContact CG-CD1 3.73Å; M296-L300 HydrophobicContact CG-CG 4.07Å; M296-L300 VanDerWaalsContact O-CB 3.28Å; M296-L300 WeakPolarHBondContact O-CB 3.38Å; M296-L300 VanDerWaalsContact O-CG 3.23Å; M296-L300 WeakPolarHBondContact O-CG 3.26Å; M296-L300 PolarHBondContact O-N 2.94Å; M296-L300 HydrophobicContact SD-CD1 3.96Å; M296-L300 HydrophobicContact SD-CD2 4.36Å; M296-L300 HydrophobicContact SD-CG 3.89Å; M296-D319 HydrophobicContact CE-CB 3.58Å; M296-V320 HydrophobicContact CE-CG2 4.14Å; M296-V320 HydrophobicContact SD-CG2 3.71Å
297	R	93.2	Very high	92.2	Very high	165 Å²	165	37.7 Å²	37.7	62%	0.623	21%	0.213	S	C	*	.	H	α-helix	trans	-66.1	-42.4	-176.2	-160.3	-173.8	77.4	91.8	0.4	111.3	D295 L300 M301	D295-R297 PolarHBondContact O-N 2.91Å; D295-R297 VanDerWaalsContact OD1-CB 3.29Å; D295-R297 WeakPolarHBondContact OD1-CB 3.32Å; D295-R297 PolarHBondContact OD1-N 3.25Å; D295-R297 WeakPolarHBondContact OD2-CB 3.36Å; R297-L300 PolarHBondContact O-N 3.03Å; R297-M301 PolarHBondContact NH1-SD 3.2Å; R297-M301 VanDerWaalsContact NH1-SD 3.39Å; R297-M301 VanDerWaalsContact O-CG 3.3Å; R297-M301 WeakPolarHBondContact O-CG 3.45Å; R297-M301 PolarHBondContact O-N 2.67Å
298	T	92.9	Very high	92.1	Very high	76 Å²	76	37.5 Å²	37.5	47%	0.466	21%	0.211	S	C	.	.	H	α-helix	trans	-63.7	-50	176.7	-62.7	0	0	0	0	111.4	D295 M296 L300 M301 E302	D295-T298 PolarHBondContact O-N 3.29Å; D295-T298 VanDerWaalsContact OD2-CB 3.27Å; D295-T298 WeakPolarHBondContact OD2-CB 3.5Å; D295-T298 PolarHBondContact OD2-N 3.08Å; D295-T298 PolarHBondContact OD2-OG1 2.72Å; M296-T298 PolarHBondContact O-N 2.72Å; T298-L300 VanDerWaalsContact C-N 3.33Å; T298-L300 PolarHBondContact O-N 3.11Å; T298-M301 PolarHBondContact O-N 2.9Å; T298-M301 VanDerWaalsContact O-N 3.17Å; T298-E302 PolarHBondContact O-N 2.96Å
299	Q	93.3	Very high	92.1	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.047	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-43.2	173.4	-81.2	176.2	1.6	0	0	112.4	L290 Y291 D295 M296 M301 E302 L303	L290-Q299 HydrophobicContact CD2-CB 3.8Å; L290-Q299 HydrophobicContact CD2-CG 4.14Å; Y291-Q299 VanDerWaalsContact CE2-NE2 3.34Å; Y291-Q299 PolarHBondContact O-NE2 2.96Å; D295-Q299 PolarHBondContact O-N 3.43Å; M296-Q299 PolarHBondContact O-N 3.39Å; Q299-M301 VanDerWaalsContact C-N 3.33Å; Q299-M301 PolarHBondContact O-N 2.73Å; Q299-E302 PolarHBondContact O-N 3.46Å; Q299-L303 VanDerWaalsContact O-CB 3.23Å; Q299-L303 WeakPolarHBondContact O-CB 3.3Å; Q299-L303 PolarHBondContact O-N 3.32Å
300	L	93.5	Very high	92.2	Very high	26 Å²	26	37 Å²	37	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-72	-21.3	179.2	-72.4	-176.5	0	0	0	114.5	M296 R297 T298 S304 V320 R325	M296-L300 HydrophobicContact CG-CD1 3.73Å; M296-L300 HydrophobicContact CG-CG 4.07Å; M296-L300 VanDerWaalsContact O-CB 3.28Å; M296-L300 WeakPolarHBondContact O-CB 3.38Å; M296-L300 VanDerWaalsContact O-CG 3.23Å; M296-L300 WeakPolarHBondContact O-CG 3.26Å; M296-L300 PolarHBondContact O-N 2.94Å; M296-L300 HydrophobicContact SD-CD1 3.96Å; M296-L300 HydrophobicContact SD-CD2 4.36Å; M296-L300 HydrophobicContact SD-CG 3.89Å; R297-L300 PolarHBondContact O-N 3.03Å; T298-L300 VanDerWaalsContact C-N 3.33Å; T298-L300 PolarHBondContact O-N 3.11Å; L300-S304 WeakPolarHBondContact O-CB 3.29Å; L300-S304 PolarHBondContact O-OG 2.96Å; L300-V320 HydrophobicContact CD2-CG1 3.99Å; L300-V320 HydrophobicContact CD2-CG2 4.11Å; L300-R325 HydrophobicContact CD1-CG 4.3Å; L300-R325 HydrophobicContact CD2-CB 3.75Å; L300-R325 HydrophobicContact CD2-CG 3.71Å; L300-R325 PolarHBondContact O-NH2 2.95Å
301	M	92.3	Very high	92.2	Very high	80 Å²	80	36.9 Å²	36.9	39%	0.394	21%	0.208	S	C	.	.	H	α-helix	trans	-76.8	-50.8	169.4	-74.6	-175.8	-58.6	0	0	110.3	R297 T298 Q299 L303 S304 E305	R297-M301 PolarHBondContact NH1-SD 3.2Å; R297-M301 VanDerWaalsContact NH1-SD 3.39Å; R297-M301 VanDerWaalsContact O-CG 3.3Å; R297-M301 WeakPolarHBondContact O-CG 3.45Å; R297-M301 PolarHBondContact O-N 2.67Å; T298-M301 PolarHBondContact O-N 2.9Å; T298-M301 VanDerWaalsContact O-N 3.17Å; Q299-M301 VanDerWaalsContact C-N 3.33Å; Q299-M301 PolarHBondContact O-N 2.73Å; M301-L303 VanDerWaalsContact C-N 3.32Å; M301-L303 PolarHBondContact O-N 2.68Å; M301-S304 PolarHBondContact O-N 2.76Å; M301-S304 PolarHBondContact O-OG 2.86Å; M301-E305 PolarHBondContact O-N 3.17Å
302	E	91.2	Very high	92.4	Very high	66 Å²	66	35.2 Å²	35.2	31%	0.308	20%	0.201	S	C	.	.	H	α-helix	trans	-58.2	-43.6	178.5	-175.1	-177.1	175.7	0	0	111.9	R286 T298 Q299 S304 E305	R286-E302 PolarHBondContact NH1-O 3.05Å; R286-E302 PolarHBondContact NH2-O 2.87Å; T298-E302 PolarHBondContact O-N 2.96Å; Q299-E302 PolarHBondContact O-N 3.46Å; E302-S304 VanDerWaalsContact C-N 3.28Å; E302-S304 PolarHBondContact O-N 3.04Å; E302-E305 PolarHBondContact O-N 3.42Å
303	L	92.8	Very high	92.8	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-36.9	176.4	-174.3	130.5	0	0	0	111.5	Q255 L290 Q299 M301 E305 G306 C307 L310 R325 V326	Q255-L303 HydrophobicContact CB-CD2 3.96Å; Q255-L303 HydrophobicContact CB-CG 4.46Å; Q255-L303 HydrophobicContact CG-CD2 3.61Å; Q255-L303 HydrophobicContact CG-CG 4.15Å; Q255-L303 VanDerWaalsContact CG-O 3.29Å; Q255-L303 WeakPolarHBondContact CG-O 3.35Å; L290-L303 HydrophobicContact CD1-CD1 3.97Å; L290-L303 HydrophobicContact CD2-CD1 4.35Å; L290-L303 HydrophobicContact CG-CD1 4.3Å; Q299-L303 VanDerWaalsContact O-CB 3.23Å; Q299-L303 WeakPolarHBondContact O-CB 3.3Å; Q299-L303 PolarHBondContact O-N 3.32Å; M301-L303 VanDerWaalsContact C-N 3.32Å; M301-L303 PolarHBondContact O-N 2.68Å; L303-E305 VanDerWaalsContact C-N 3.26Å; L303-E305 PolarHBondContact O-N 2.81Å; L303-G306 CarbonylContact O-C 3.58Å; L303-G306 PolarHBondContact O-N 3.1Å; L303-G306 VanDerWaalsContact O-N 3.13Å; L303-C307 HydrophobicContact CG-CB 4.39Å; L303-L310 HydrophobicContact CD1-CD1 4.25Å; L303-R325 WeakPolarHBondContact CD2-O 3.26Å; L303-V326 HydrophobicContact CD1-CG2 3.68Å; L303-V326 HydrophobicContact CD2-CG2 3.96Å; L303-V326 HydrophobicContact CG-CG2 4.43Å
304	S	90.2	Very high	93.4	Very high	42 Å²	42	31.6 Å²	31.6	29%	0.294	16%	0.161	S	C	.	.	H	α-helix	trans	-72.2	-11.5	-179.3	70.8	0	0	0	0	115.4	L300 M301 E302 G306	L300-S304 WeakPolarHBondContact O-CB 3.29Å; L300-S304 PolarHBondContact O-OG 2.96Å; M301-S304 PolarHBondContact O-N 2.76Å; M301-S304 PolarHBondContact O-OG 2.86Å; E302-S304 VanDerWaalsContact C-N 3.28Å; E302-S304 PolarHBondContact O-N 3.04Å; S304-G306 VanDerWaalsContact C-N 3.28Å
305	E	88.6	Confident	93.8	Very high	38 Å²	38	31.4 Å²	31.4	18%	0.178	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-22.6	169.4	-61.5	-161.3	131.9	0	0	112.7	S112 R116 R286 M301 E302 L303	S112-E305 WeakPolarHBondContact CB-OE2 3.46Å; S112-E305 PolarHBondContact OG-OE2 2.9Å; R116-E305 IonicContact CZ-OE1 2.83Å; R116-E305 IonicContact NE-OE1 3.91Å; R116-E305 PolarHBondContact NE-OE1 3.33Å; R116-E305 IonicContact NH2-OE1 3.2Å; R116-E305 PolarHBondContact NH2-OE1 3.23Å; R286-E305 IonicContact CZ-OE2 3.2Å; R286-E305 IonicContact NE-OE2 2.82Å; R286-E305 IonicContact NH2-OE2 2.72Å; R286-E305 PolarHBondContact NH2-OE2 3.37Å; M301-E305 PolarHBondContact O-N 3.17Å; E302-E305 PolarHBondContact O-N 3.42Å; L303-E305 VanDerWaalsContact C-N 3.26Å; L303-E305 PolarHBondContact O-N 2.81Å
306	G	90.6	Very high	94.1	Very high	1 Å²	1	29 Å²	29	1%	0.01	15%	0.146	C	C	.	.			trans	144.9	132.3	-179.8	0	0	0	0	0	112.1	Q255 R286 C288 L303 S304	Q255-G306 VanDerWaalsContact OE1-CA 3.32Å; R286-G306 VanDerWaalsContact CD-O 3.24Å; R286-G306 WeakPolarHBondContact CD-O 3.32Å; R286-G306 WeakPolarHBondContact CG-O 3.32Å; R286-G306 PolarHBondContact NH1-O 3.33Å; C288-G306 PolarHBondContact SG-O 3.44Å; C288-G306 VanDerWaalsContact SG-O 3.34Å; L303-G306 CarbonylContact O-C 3.58Å; L303-G306 PolarHBondContact O-N 3.1Å; L303-G306 VanDerWaalsContact O-N 3.13Å; S304-G306 VanDerWaalsContact C-N 3.28Å
307	C	94.5	Very high	94.3	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	14%	0.139	C	C	.	.			trans	-130.7	128.7	173.6	-172	0	0	0	0	110.8	Q255 C288 L303	Q255-C307 HydrophobicContact CB-CB 4.01Å; Q255-C307 HydrophobicContact CG-CB 4.37Å; C288-C307 HydrophobicContact CB-CB 4.41Å; L303-C307 HydrophobicContact CG-CB 4.39Å
308	N	95.2	Very high	94.4	Very high	4 Å²	4	20 Å²	20	2%	0.021	11%	0.112	C	C	.	.	S	Bend	trans	-124.4	-34.4	176.4	-50.6	125	0	0	0	112.5	R117 W126 M235 V258 A259 L284 I285 R286	R117-N308 PolarHBondContact NH1-ND2 3.4Å; R117-N308 VanDerWaalsContact NH1-ND2 3.12Å; W126-N308 HydrophobicContact CH2-CB 3.91Å; W126-N308 HydrophobicContact CZ2-CB 4.32Å; M235-N308 HydrophobicContact CE-CB 4.25Å; M235-N308 WeakPolarHBondContact CE-O 3.25Å; V258-N308 PolarHBondContact N-O 3.4Å; A259-N308 PolarHBondContact N-O 2.81Å; L284-N308 PolarHBondContact O-OD1 3.45Å; I285-N308 HydrophobicContact CG2-CB 3.99Å; R286-N308 PolarHBondContact N-OD1 2.66Å; R286-N308 PolarHBondContact O-N 2.92Å
309	L	97.6	Very high	94.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123	169.9	178.1	161.2	0	0	0	107.3	L228 L232 M235 A259 I261 A276 I285 R286 P287 C288 V311	L228-L309 HydrophobicContact CD2-CD1 4.07Å; L232-L309 HydrophobicContact CD2-CD1 3.86Å; L232-L309 HydrophobicContact CG-CD1 4.38Å; M235-L309 HydrophobicContact CE-CB 4.37Å; A259-L309 HydrophobicContact CB-CB 4.48Å; A259-L309 HydrophobicContact CB-CG 4.25Å; A259-L309 WeakPolarHBondContact O-CA 3.19Å; I261-L309 HydrophobicContact CD1-CD1 4.25Å; I261-L309 HydrophobicContact CD1-CD2 3.84Å; I261-L309 HydrophobicContact CD1-CG 4.15Å; A276-L309 HydrophobicContact CB-CD1 4.26Å; A276-L309 HydrophobicContact CB-CD2 4Å; I285-L309 HydrophobicContact CG2-CB 4.34Å; R286-L309 PolarHBondContact O-N 3.28Å; P287-L309 CarbonylContact C-O 3.58Å; P287-L309 VanDerWaalsContact CA-O 3.24Å; P287-L309 WeakPolarHBondContact CA-O 3.48Å; P287-L309 HydrophobicContact CB-CD2 4.08Å; C288-L309 PolarHBondContact N-O 3.31Å; L309-V311 HydrophobicContact CD2-CG2 3.69Å
310	L	98.1	Very high	94.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.4	-178.1	-177	55.4	0	0	0	110.1	P257 A259 L260 I261 C288 L290 L303 L317 V326	P257-L310 HydrophobicContact CB-CB 3.77Å; P257-L310 HydrophobicContact CG-CB 4.02Å; P257-L310 HydrophobicContact CG-CD2 4.02Å; A259-L310 PolarHBondContact O-N 3.31Å; L260-L310 CarbonylContact C-O 3.59Å; L260-L310 WeakPolarHBondContact CA-O 3.43Å; L260-L310 HydrophobicContact CD1-CB 4.28Å; L260-L310 HydrophobicContact CD1-CD2 4.32Å; L260-L310 HydrophobicContact CD1-CG 4.2Å; I261-L310 PolarHBondContact N-O 3.33Å; C288-L310 HydrophobicContact CB-CD1 4Å; L290-L310 HydrophobicContact CB-CD1 4.5Å; L290-L310 HydrophobicContact CD1-CD1 3.86Å; L290-L310 HydrophobicContact CD1-CD2 4.15Å; L290-L310 HydrophobicContact CD1-CG 4.5Å; L290-L310 HydrophobicContact CG-CD1 3.89Å; L303-L310 HydrophobicContact CD1-CD1 4.25Å; L310-L317 HydrophobicContact CD2-CD1 3.76Å; L310-V326 HydrophobicContact CD2-CG1 4.05Å; L310-V326 HydrophobicContact CD2-CG2 4.08Å
311	V	98.4	Very high	94.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.1	168.1	-166.5	0	0	0	0	108.5	I261 A269 I272 F273 C288 V289 L290 L309	I261-V311 HydrophobicContact CB-CG1 4.4Å; I261-V311 HydrophobicContact CD1-CG2 4.2Å; I261-V311 HydrophobicContact CG2-CG1 4.43Å; I261-V311 CarbonylContact O-C 3.48Å; I261-V311 WeakPolarHBondContact O-CA 3.18Å; A269-V311 HydrophobicContact CB-CG1 3.92Å; A269-V311 WeakPolarHBondContact O-CG1 3.23Å; I272-V311 HydrophobicContact CB-CG1 3.99Å; I272-V311 HydrophobicContact CG2-CG1 3.91Å; I272-V311 HydrophobicContact CG2-CG2 3.89Å; F273-V311 HydrophobicContact CB-CG2 4.22Å; C288-V311 PolarHBondContact O-N 3.46Å; V289-V311 CarbonylContact C-O 3.58Å; V289-V311 VanDerWaalsContact CA-O 3.29Å; V289-V311 WeakPolarHBondContact CA-O 3.34Å; V289-V311 HydrophobicContact CG2-CB 4.34Å; L290-V311 PolarHBondContact N-O 3.11Å; L309-V311 HydrophobicContact CD2-CG2 3.69Å
312	A	97.7	Very high	94.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	151	-176.8	0	0	0	0	0	115.3	I261 L262 A263 L290 L317	I261-A312 PolarHBondContact O-N 3.41Å; L262-A312 WeakPolarHBondContact CA-O 3.4Å; L262-A312 HydrophobicContact CD2-CB 4.44Å; A263-A312 PolarHBondContact N-O 3.18Å; L290-A312 HydrophobicContact CB-CB 3.97Å; L290-A312 CarbonylContact O-C 3.57Å; L290-A312 WeakPolarHBondContact O-CA 3.4Å; A312-L317 HydrophobicContact CB-CB 3.94Å; A312-L317 HydrophobicContact CB-CD2 4.28Å; A312-L317 HydrophobicContact CB-CG 4.48Å
313	T	96.2	Very high	94.9	Very high	13 Å²	13	24.2 Å²	24.2	8%	0.08	12%	0.12	C	C	.	.			trans	-82.7	134.5	158.6	61.7	0	0	0	0	109.5	A263 L290 Y291 G315 R316 L317	A263-T313 WeakPolarHBondContact O-CA 3.15Å; L290-T313 PolarHBondContact O-N 2.76Å; Y291-T313 WeakPolarHBondContact CA-OG1 3.44Å; T313-G315 PolarHBondContact O-N 3.12Å; T313-R316 PolarHBondContact O-N 3.12Å; T313-L317 PolarHBondContact O-N 3Å; T313-L317 VanDerWaalsContact O-N 3.16Å
314	P	96.2	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-47.9	-51.5	-171.8	-32	35.9	0	0	0	115.2	R316 L317 S318 M342 F347 Q350 I351 I354	P314-R316 PolarHBondContact O-N 3.2Å; P314-L317 WeakPolarHBondContact O-CB 3.12Å; P314-L317 PolarHBondContact O-N 3.02Å; P314-S318 PolarHBondContact O-N 3.25Å; P314-S318 PolarHBondContact O-OG 2.71Å; P314-M342 HydrophobicContact CG-SD 3.91Å; P314-F347 HydrophobicContact CB-CB 4.18Å; P314-F347 HydrophobicContact CB-CD1 4.09Å; P314-F347 HydrophobicContact CB-CG 4.17Å; P314-F347 HydrophobicContact CG-CB 4.07Å; P314-F347 HydrophobicContact CG-CD1 4.44Å; P314-F347 HydrophobicContact CG-CD2 4.38Å; P314-F347 HydrophobicContact CG-CG 4.08Å; P314-Q350 HydrophobicContact CB-CB 3.9Å; P314-I351 HydrophobicContact CB-CG1 4.03Å; P314-I351 HydrophobicContact CG-CD1 4.12Å; P314-I351 HydrophobicContact CG-CG1 3.77Å; P314-I354 HydrophobicContact CB-CD1 4.15Å
315	G	94.9	Very high	95.2	Very high	22 Å²	22	26.7 Å²	26.7	23%	0.227	14%	0.135	C	C	.	.	H	α-helix	trans	-57	-49.5	-179	0	0	0	0	0	114.1	T313 L317 S318 D319	T313-G315 PolarHBondContact O-N 3.12Å; G315-L317 PolarHBondContact O-N 3.47Å; G315-S318 WeakPolarHBondContact O-CB 3.11Å; G315-S318 PolarHBondContact O-N 3.28Å; G315-S318 VanDerWaalsContact O-N 3.16Å; G315-D319 PolarHBondContact O-N 3.03Å
316	R	95.4	Very high	95.5	Very high	32 Å²	32	25 Å²	25	12%	0.121	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-23.9	177.3	-179.8	56.5	63.8	96.4	-6.6	112.6	L290 Y291 A294 T313 P314 D319 V320	L290-R316 HydrophobicContact CB-CG 4.11Å; Y291-R316 PolarHBondContact O-NH1 2.75Å; Y291-R316 VanDerWaalsContact O-NH1 3.11Å; A294-R316 PolarHBondContact O-NH1 3.3Å; A294-R316 PolarHBondContact O-NH2 2.99Å; A294-R316 VanDerWaalsContact O-NH2 3.13Å; T313-R316 PolarHBondContact O-N 3.12Å; P314-R316 PolarHBondContact O-N 3.2Å; R316-D319 IonicContact NE-OD2 2.71Å; R316-D319 PolarHBondContact NE-OD2 3.08Å; R316-V320 WeakPolarHBondContact O-CG2 3.25Å
317	L	97.3	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-72.2	-45.6	171.3	-175.3	57.4	0	0	0	111.3	L260 L262 L290 L310 A312 T313 P314 G315 D319 V320 L321 V326 I354	L260-L317 HydrophobicContact CD1-CD2 3.62Å; L260-L317 HydrophobicContact CD2-CD2 3.77Å; L260-L317 HydrophobicContact CG-CD2 4.35Å; L262-L317 HydrophobicContact CD2-CD2 3.83Å; L290-L317 HydrophobicContact CD1-CD1 4.15Å; L310-L317 HydrophobicContact CD2-CD1 3.76Å; A312-L317 HydrophobicContact CB-CB 3.94Å; A312-L317 HydrophobicContact CB-CD2 4.28Å; A312-L317 HydrophobicContact CB-CG 4.48Å; T313-L317 PolarHBondContact O-N 3Å; T313-L317 VanDerWaalsContact O-N 3.16Å; P314-L317 WeakPolarHBondContact O-CB 3.12Å; P314-L317 PolarHBondContact O-N 3.02Å; G315-L317 PolarHBondContact O-N 3.47Å; L317-D319 VanDerWaalsContact C-N 3.31Å; L317-D319 PolarHBondContact O-N 3.41Å; L317-V320 PolarHBondContact O-N 3Å; L317-L321 HydrophobicContact CD1-CD1 4.34Å; L317-L321 HydrophobicContact CD1-CG 4.19Å; L317-L321 HydrophobicContact CD2-CD1 4.44Å; L317-L321 HydrophobicContact CG-CD1 3.84Å; L317-L321 HydrophobicContact CG-CG 4.19Å; L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 3.28Å; L317-V326 HydrophobicContact CD1-CG1 4.42Å; L317-I354 HydrophobicContact CB-CD1 4.17Å; L317-I354 HydrophobicContact CD2-CD1 4.08Å; L317-I354 HydrophobicContact CD2-CG1 4.39Å; L317-I354 HydrophobicContact CD2-CG2 4.04Å; L317-I354 HydrophobicContact CG-CD1 4.31Å
318	S	95.9	Very high	95.9	Very high	7 Å²	7	25.1 Å²	25.1	5%	0.049	13%	0.128	C	C	.	.	H	α-helix	trans	-54.8	-46.1	174.7	-56.3	0	0	0	0	111.6	P314 G315 V320 L321 E322	P314-S318 PolarHBondContact O-N 3.25Å; P314-S318 PolarHBondContact O-OG 2.71Å; G315-S318 WeakPolarHBondContact O-CB 3.11Å; G315-S318 PolarHBondContact O-N 3.28Å; G315-S318 VanDerWaalsContact O-N 3.16Å; S318-V320 PolarHBondContact O-N 3.49Å; S318-V320 VanDerWaalsContact O-N 3.09Å; S318-L321 PolarHBondContact O-N 3.3Å; S318-E322 WeakPolarHBondContact O-CG 3.37Å; S318-E322 PolarHBondContact O-N 3.4Å
319	D	94.8	Very high	95.8	Very high	56 Å²	56	28 Å²	28	30%	0.299	14%	0.143	S	C	.	.	H	α-helix	trans	-52.1	-34.3	174.7	-63.3	-21.3	0	0	0	113.3	M296 G315 R316 L317 R323	M296-D319 HydrophobicContact CE-CB 3.58Å; G315-D319 PolarHBondContact O-N 3.03Å; R316-D319 IonicContact NE-OD2 2.71Å; R316-D319 PolarHBondContact NE-OD2 3.08Å; L317-D319 VanDerWaalsContact C-N 3.31Å; L317-D319 PolarHBondContact O-N 3.41Å; D319-R323 WeakPolarHBondContact O-CD 3.46Å; D319-R323 WeakPolarHBondContact O-CG 3.21Å; D319-R323 PolarHBondContact O-NE 2.88Å
320	V	95.5	Very high	95.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-94.1	-29.5	-170.2	171	0	0	0	0	111.5	L290 M296 L300 R316 L317 S318 R325 V326	L290-V320 HydrophobicContact CD1-CB 4.15Å; L290-V320 HydrophobicContact CD1-CG1 3.89Å; L290-V320 HydrophobicContact CD1-CG2 4.14Å; L290-V320 HydrophobicContact CD2-CG2 4.39Å; M296-V320 HydrophobicContact CE-CG2 4.14Å; M296-V320 HydrophobicContact SD-CG2 3.71Å; L300-V320 HydrophobicContact CD2-CG1 3.99Å; L300-V320 HydrophobicContact CD2-CG2 4.11Å; R316-V320 WeakPolarHBondContact O-CG2 3.25Å; L317-V320 PolarHBondContact O-N 3Å; S318-V320 PolarHBondContact O-N 3.49Å; S318-V320 VanDerWaalsContact O-N 3.09Å; V320-R325 HydrophobicContact CG1-CB 3.85Å; V320-R325 PolarHBondContact O-N 3.3Å; V320-R325 VanDerWaalsContact O-N 3.09Å; V320-V326 HydrophobicContact CG1-CB 4.2Å; V320-V326 HydrophobicContact CG1-CG2 3.63Å
321	L	95.8	Very high	95.6	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.089	16%	0.161	C	C	.	.	H	α-helix	trans	-66.3	-48.3	167.6	-68.7	168.1	0	0	0	110.6	L317 S318 R323 G324 V326 L328 I354	L317-L321 HydrophobicContact CD1-CD1 4.34Å; L317-L321 HydrophobicContact CD1-CG 4.19Å; L317-L321 HydrophobicContact CD2-CD1 4.44Å; L317-L321 HydrophobicContact CG-CD1 3.84Å; L317-L321 HydrophobicContact CG-CG 4.19Å; L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 3.28Å; S318-L321 PolarHBondContact O-N 3.3Å; L321-R323 PolarHBondContact O-N 2.89Å; L321-G324 WeakPolarHBondContact O-CA 3.33Å; L321-G324 PolarHBondContact O-N 2.73Å; L321-V326 HydrophobicContact CD2-CB 3.97Å; L321-V326 HydrophobicContact CD2-CG1 3.8Å; L321-L328 HydrophobicContact CD1-CD1 4.25Å; L321-L328 HydrophobicContact CD2-CD1 4.36Å; L321-L328 HydrophobicContact CD2-CD2 4.41Å; L321-L328 HydrophobicContact CD2-CG 4Å; L321-I354 HydrophobicContact CD1-CG1 4.02Å
322	E	94.2	Very high	95.5	Very high	123 Å²	123	35.2 Å²	35.2	58%	0.575	17%	0.172	S	C	*	.	H	α-helix	trans	-55.7	-36.6	175.2	-75.9	-176.3	171.5	0	0	113.3	S318 G324 R353	S318-E322 WeakPolarHBondContact O-CG 3.37Å; S318-E322 PolarHBondContact O-N 3.4Å; E322-G324 PolarHBondContact O-N 3.31Å; E322-R353 IonicContact OE1-CZ 2.96Å; E322-R353 IonicContact OE1-NH1 3.32Å; E322-R353 PolarHBondContact OE1-NH1 3.33Å; E322-R353 IonicContact OE1-NH2 3.78Å; E322-R353 PolarHBondContact OE1-NH2 2.76Å
323	R	93.5	Very high	95.6	Very high	150 Å²	150	35.6 Å²	35.6	57%	0.566	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	0.9	177.5	-67.9	165.8	-160.7	-95.7	-2.3	113.4	D319 L321 R325	D319-R323 WeakPolarHBondContact O-CD 3.46Å; D319-R323 WeakPolarHBondContact O-CG 3.21Å; D319-R323 PolarHBondContact O-NE 2.88Å; L321-R323 PolarHBondContact O-N 2.89Å; R323-R325 HydrophobicContact CB-CG 3.82Å; R323-R325 PolarHBondContact O-N 2.95Å
324	G	93.5	Very high	95.7	Very high	38 Å²	38	35 Å²	35	39%	0.392	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	26.3	-178.1	0	0	0	0	0	113.7	K254 L321 E322	K254-G324 WeakPolarHBondContact CB-O 3.25Å; K254-G324 WeakPolarHBondContact CG-O 3.42Å; L321-G324 WeakPolarHBondContact O-CA 3.33Å; L321-G324 PolarHBondContact O-N 2.73Å; E322-G324 PolarHBondContact O-N 3.31Å
325	R	94.5	Very high	95.8	Very high	58 Å²	58	35 Å²	35	22%	0.219	17%	0.17	C	C	.	.	S	Bend	trans	-95.5	-23.4	-174.5	-61.7	-66.2	-68.7	176	-3.9	112.9	R253 K254 Q255 L300 L303 V320 R323	R253-R325 VanDerWaalsContact O-CZ 3.32Å; R253-R325 PolarHBondContact O-NE 2.88Å; R253-R325 PolarHBondContact O-NH1 3Å; K254-R325 WeakPolarHBondContact CA-O 3.16Å; Q255-R325 PolarHBondContact N-O 3.25Å; L300-R325 HydrophobicContact CD1-CG 4.3Å; L300-R325 HydrophobicContact CD2-CB 3.75Å; L300-R325 HydrophobicContact CD2-CG 3.71Å; L300-R325 PolarHBondContact O-NH2 2.95Å; L303-R325 WeakPolarHBondContact CD2-O 3.26Å; V320-R325 HydrophobicContact CG1-CB 3.85Å; V320-R325 PolarHBondContact O-N 3.3Å; V320-R325 VanDerWaalsContact O-N 3.09Å; R323-R325 HydrophobicContact CB-CG 3.82Å; R323-R325 PolarHBondContact O-N 2.95Å
326	V	96.4	Very high	95.9	Very high	3 Å²	3	34 Å²	34	2%	0.018	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-121.4	151.6	170.4	170.7	0	0	0	0	109	K254 Q255 P257 L303 L310 L317 V320 L321 L328	K254-V326 VanDerWaalsContact CE-O 3.25Å; K254-V326 WeakPolarHBondContact CE-O 3.2Å; Q255-V326 CarbonylContact O-C 3.49Å; Q255-V326 WeakPolarHBondContact O-CA 3.28Å; P257-V326 HydrophobicContact CG-CG1 4.06Å; L303-V326 HydrophobicContact CD1-CG2 3.68Å; L303-V326 HydrophobicContact CD2-CG2 3.96Å; L303-V326 HydrophobicContact CG-CG2 4.43Å; L310-V326 HydrophobicContact CD2-CG1 4.05Å; L310-V326 HydrophobicContact CD2-CG2 4.08Å; L317-V326 HydrophobicContact CD1-CG1 4.42Å; V320-V326 HydrophobicContact CG1-CB 4.2Å; V320-V326 HydrophobicContact CG1-CG2 3.63Å; L321-V326 HydrophobicContact CD2-CB 3.97Å; L321-V326 HydrophobicContact CD2-CG1 3.8Å; V326-L328 HydrophobicContact CG1-CD2 3.88Å
327	G	95.5	Very high	95.9	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.031	15%	0.154	C	C	.	.			trans	-132.7	141.4	162.3	0	0	0	0	0	110.7	K254 Q255 F256 P257 D329	K254-G327 VanDerWaalsContact CE-N 3.33Å; Q255-G327 PolarHBondContact O-N 2.8Å; F256-G327 WeakPolarHBondContact CA-O 3.24Å; P257-G327 WeakPolarHBondContact CD-O 3.4Å; G327-D329 VanDerWaalsContact C-N 3.3Å; G327-D329 WeakPolarHBondContact CA-OD2 3.48Å
328	L	96.5	Very high	95.5	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	16%	0.157	C	C	.	.			trans	-94.9	5.1	-180	-54.7	-177.5	0	0	0	112.3	P257 L260 L321 V326 Y330 C331 I354 A359 L360 P361	P257-L328 HydrophobicContact CG-CD2 4.25Å; L260-L328 HydrophobicContact CD2-CD1 4.02Å; L260-L328 HydrophobicContact CD2-CD2 4Å; L321-L328 HydrophobicContact CD1-CD1 4.25Å; L321-L328 HydrophobicContact CD2-CD1 4.36Å; L321-L328 HydrophobicContact CD2-CD2 4.41Å; L321-L328 HydrophobicContact CD2-CG 4Å; V326-L328 HydrophobicContact CG1-CD2 3.88Å; L328-Y330 PolarHBondContact O-N 2.69Å; L328-C331 HydrophobicContact CB-CB 4.44Å; L328-C331 VanDerWaalsContact O-CB 3.24Å; L328-C331 WeakPolarHBondContact O-CB 3.26Å; L328-C331 PolarHBondContact O-N 2.77Å; L328-I354 HydrophobicContact CD1-CG2 3.87Å; L328-A359 CarbonylContact C-O 3.13Å; L328-L360 HydrophobicContact CB-CB 4.06Å; L328-L360 HydrophobicContact CB-CD1 3.84Å; L328-L360 HydrophobicContact CD1-CB 4.31Å; L328-L360 HydrophobicContact CD1-CD1 4.32Å; L328-P361 VanDerWaalsContact O-CD 3.24Å; L328-P361 WeakPolarHBondContact O-CD 3.48Å
329	D	95	Very high	95.4	Very high	63 Å²	63	33 Å²	33	34%	0.337	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-22.4	-170.4	-40.7	-140	0	0	0	113.8	K254 F256 G327 A359	K254-D329 IonicContact NZ-OD1 3.37Å; K254-D329 PolarHBondContact NZ-OD1 2.82Å; K254-D329 IonicContact NZ-OD2 2.72Å; K254-D329 PolarHBondContact NZ-OD2 2.81Å; F256-D329 HydrophobicContact CD1-CB 4.01Å; F256-D329 HydrophobicContact CE1-CB 4.06Å; F256-D329 VanDerWaalsContact CE1-OD2 3.3Å; F256-D329 WeakPolarHBondContact CE1-OD2 3.31Å; G327-D329 VanDerWaalsContact C-N 3.3Å; G327-D329 WeakPolarHBondContact CA-OD2 3.48Å; D329-A359 VanDerWaalsContact CA-O 3.22Å; D329-A359 WeakPolarHBondContact CA-O 3.46Å; D329-A359 PolarHBondContact N-O 2.71Å; D329-A359 VanDerWaalsContact N-O 3.1Å
330	Y	94.7	Very high	95.1	Very high	91 Å²	91	30.5 Å²	30.5	36%	0.357	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	18.2	-179.2	-56.6	-82.9	0	0	0	113.4	D242 A246 F256 L328 R332	D242-Y330 HydrophobicContact CB-CD1 4.05Å; D242-Y330 HydrophobicContact CB-CE1 3.57Å; A246-Y330 HydrophobicContact CB-CD2 4.06Å; A246-Y330 HydrophobicContact CB-CE2 3.32Å; F256-Y330 HydrophobicContact CB-CD2 3.96Å; F256-Y330 AromaticContact CD1-CD2 3.63Å; F256-Y330 HydrophobicContact CD1-CD2 3.63Å; F256-Y330 AromaticContact CD1-CE2 3.89Å; F256-Y330 HydrophobicContact CD1-CE2 3.89Å; F256-Y330 HydrophobicContact CE1-CD2 4.35Å; F256-Y330 HydrophobicContact CE1-CE2 4.16Å; F256-Y330 AromaticContact CG-CD2 3.98Å; F256-Y330 HydrophobicContact CG-CD2 3.98Å; F256-Y330 HydrophobicContact CG-CE2 4.37Å; L328-Y330 PolarHBondContact O-N 2.69Å; Y330-R332 PolarHBondContact O-N 3.45Å
331	C	96.5	Very high	94.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	14%	0.142	C	C	.	.			trans	-79.2	107.2	-177.6	-177.3	0	0	0	0	111	P257 L328 F333 L360	P257-C331 WeakPolarHBondContact O-CA 3.02Å; L328-C331 HydrophobicContact CB-CB 4.44Å; L328-C331 VanDerWaalsContact O-CB 3.24Å; L328-C331 WeakPolarHBondContact O-CB 3.26Å; L328-C331 PolarHBondContact O-N 2.77Å; C331-F333 PolarHBondContact SG-O 3.48Å; C331-F333 VanDerWaalsContact SG-O 3.34Å; C331-L360 HydrophobicContact CB-CD1 3.7Å
332	R	96.6	Very high	94.4	Very high	61 Å²	61	29.8 Å²	29.8	23%	0.23	14%	0.138	C	C	.	.			trans	-84.8	-23.5	-179	-61.6	-171.7	-62.3	-145.2	-1.7	113.7	G239 V258 Y330 R366 Q367	G239-R332 PolarHBondContact O-NH1 3.3Å; G239-R332 PolarHBondContact O-NH2 2.79Å; V258-R332 HydrophobicContact CG1-CG 4.45Å; V258-R332 PolarHBondContact O-N 3.14Å; Y330-R332 PolarHBondContact O-N 3.45Å; R332-R366 WeakPolarHBondContact O-CA 3.31Å; R332-Q367 PolarHBondContact O-N 3.13Å
333	F	98.2	Very high	94.3	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.035	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	116.6	-175.6	-51.4	-80.2	0	0	0	110.6	I231 N234 M235 V258 A259 L260 C331 Q367	I231-F333 HydrophobicContact CD1-CB 4.24Å; I231-F333 HydrophobicContact CG1-CB 4.34Å; I231-F333 HydrophobicContact CG1-CD1 4.12Å; I231-F333 HydrophobicContact CG1-CG 4.23Å; I231-F333 HydrophobicContact CG2-CB 4.18Å; I231-F333 HydrophobicContact CG2-CD2 3.95Å; I231-F333 HydrophobicContact CG2-CG 3.95Å; N234-F333 HydrophobicContact CB-CE1 4.32Å; N234-F333 HydrophobicContact CB-CZ 3.8Å; M235-F333 HydrophobicContact CG-CD2 4.04Å; M235-F333 HydrophobicContact CG-CE2 3.68Å; V258-F333 PolarHBondContact O-N 3.19Å; A259-F333 CarbonylContact C-O 3.58Å; A259-F333 WeakPolarHBondContact CA-O 3.37Å; A259-F333 HydrophobicContact CB-CB 3.96Å; A259-F333 HydrophobicContact CB-CD2 4.2Å; L260-F333 PolarHBondContact N-O 3.49Å; C331-F333 PolarHBondContact SG-O 3.48Å; C331-F333 VanDerWaalsContact SG-O 3.34Å; F333-Q367 WeakPolarHBondContact CA-O 3.47Å; F333-Q367 HydrophobicContact CD1-CB 4.14Å; F333-Q367 VanDerWaalsContact CE1-OE1 3.31Å
334	L	98.2	Very high	93.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131	169.7	173	63.6	0	0	0	109.4	L260 L262 L336 V355 L360 Q367 T368 L369	L260-L334 HydrophobicContact CB-CD1 4.43Å; L260-L334 HydrophobicContact CD2-CD1 4.03Å; L260-L334 HydrophobicContact CG-CD1 4.12Å; L260-L334 CarbonylContact O-C 3.58Å; L260-L334 WeakPolarHBondContact O-CA 3.31Å; L262-L334 HydrophobicContact CD1-CD1 4.37Å; L334-L336 HydrophobicContact CD1-CD1 3.92Å; L334-L336 HydrophobicContact CD2-CD1 3.95Å; L334-L336 HydrophobicContact CG-CD1 3.74Å; L334-V355 HydrophobicContact CD2-CG1 4.09Å; L334-V355 HydrophobicContact CD2-CG2 3.72Å; L334-L360 HydrophobicContact CD2-CD2 3.93Å; L334-Q367 PolarHBondContact N-O 3.17Å; L334-T368 HydrophobicContact CB-CG2 4.13Å; L334-T368 HydrophobicContact CD2-CG2 3.79Å; L334-T368 HydrophobicContact CG-CG2 4.01Å; L334-T368 CarbonylContact O-C 3.55Å; L334-T368 WeakPolarHBondContact O-CA 3.39Å; L334-L369 PolarHBondContact O-N 3.25Å
335	V	98.3	Very high	93.5	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.4	173.9	-171.2	0	0	0	0	110.1	F227 I231 L260 I261 L262 L369 F371	F227-V335 HydrophobicContact CD1-CG1 4.06Å; F227-V335 HydrophobicContact CD2-CG1 4.09Å; F227-V335 HydrophobicContact CD2-CG2 4.28Å; F227-V335 HydrophobicContact CE1-CG1 4.12Å; F227-V335 HydrophobicContact CE2-CG1 4.19Å; F227-V335 HydrophobicContact CG-CG1 4.04Å; F227-V335 HydrophobicContact CZ-CG1 4.19Å; I231-V335 HydrophobicContact CD1-CG2 3.5Å; I231-V335 VanDerWaalsContact CD1-CG2 3.5Å; L260-V335 PolarHBondContact O-N 2.96Å; I261-V335 CarbonylContact C-O 3.56Å; I261-V335 WeakPolarHBondContact CA-O 3.35Å; I261-V335 HydrophobicContact CB-CB 4.23Å; I261-V335 HydrophobicContact CG1-CB 3.86Å; I261-V335 HydrophobicContact CG1-CG2 3.93Å; I261-V335 HydrophobicContact CG2-CB 4.08Å; I261-V335 HydrophobicContact CG2-CG1 4.26Å; L262-V335 PolarHBondContact N-O 2.79Å; V335-L369 CarbonylContact C-O 3.51Å; V335-L369 VanDerWaalsContact CA-O 3.3Å; V335-L369 WeakPolarHBondContact CA-O 3.3Å; V335-L369 HydrophobicContact CG1-CB 4.38Å; V335-L369 HydrophobicContact CG2-CB 4.33Å; V335-L369 HydrophobicContact CG2-CD1 4.1Å; V335-L369 HydrophobicContact CG2-CG 4.42Å; V335-F371 HydrophobicContact CG1-CD2 4Å; V335-F371 HydrophobicContact CG1-CE2 4.24Å
336	L	97.6	Very high	93.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.6	166.7	-74.6	69.2	0	0	0	107.7	L262 L334 A339 M342 I351 L369 M370 F371 L382 F386	L262-L336 HydrophobicContact CB-CG 4.46Å; L262-L336 HydrophobicContact CD1-CG 4.45Å; L334-L336 HydrophobicContact CD1-CD1 3.92Å; L334-L336 HydrophobicContact CD2-CD1 3.95Å; L334-L336 HydrophobicContact CG-CD1 3.74Å; L336-A339 HydrophobicContact CB-CB 4.12Å; L336-M342 HydrophobicContact CB-CE 3.58Å; L336-M342 HydrophobicContact CD2-CE 4.19Å; L336-M342 HydrophobicContact CG-CE 3.86Å; L336-I351 HydrophobicContact CD2-CG2 4.08Å; L336-L369 PolarHBondContact N-O 3Å; L336-M370 HydrophobicContact CB-CG 4.14Å; L336-M370 HydrophobicContact CD2-CG 4.36Å; L336-F371 PolarHBondContact O-N 2.86Å; L336-L382 HydrophobicContact CD2-CD2 4.11Å; L336-F386 HydrophobicContact CD2-CD2 4.31Å; L336-F386 HydrophobicContact CD2-CE2 4.35Å
337	D	94.9	Very high	93.1	Very high	4 Å²	4	25 Å²	25	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.5	174.8	-165.8	15	0	0	0	111.6	K223 F227 L262 P264 I272 A339 F371	K223-D337 WeakPolarHBondContact CE-OD1 3.41Å; K223-D337 IonicContact NZ-OD1 2.77Å; K223-D337 PolarHBondContact NZ-OD1 3.04Å; F227-D337 HydrophobicContact CE1-CB 4.23Å; F227-D337 HydrophobicContact CZ-CB 4.44Å; L262-D337 PolarHBondContact O-N 2.85Å; P264-D337 WeakPolarHBondContact CD-O 3.35Å; I272-D337 HydrophobicContact CD1-CB 4.35Å; D337-A339 VanDerWaalsContact C-N 3.29Å; D337-F371 HydrophobicContact CB-CB 4.36Å; D337-F371 VanDerWaalsContact OD1-CB 3.31Å; D337-F371 WeakPolarHBondContact OD1-CB 3.23Å
338	E	90.1	Very high	93.1	Very high	13 Å²	13	28.2 Å²	28.2	6%	0.061	15%	0.145	C	C	.	.	S	Bend	trans	45.8	53.7	-158.7	-68.2	-171.4	168.1	0	0	110.9	P264 L268 D340 R341 M342 F371 R521	P264-E338 HydrophobicContact CG-CB 3.66Å; L268-E338 HydrophobicContact CD2-CB 4.1Å; L268-E338 HydrophobicContact CD2-CG 3.82Å; E338-D340 WeakPolarHBondContact CA-OD1 3.41Å; E338-R341 HydrophobicContact CB-CB 4.08Å; E338-R341 WeakPolarHBondContact O-CB 3.44Å; E338-R341 PolarHBondContact O-N 3.2Å; E338-R341 VanDerWaalsContact OE2-CD 3.23Å; E338-R341 WeakPolarHBondContact OE2-CD 3.23Å; E338-R341 IonicContact OE2-CZ 3.64Å; E338-R341 IonicContact OE2-NE 2.75Å; E338-R341 IonicContact OE2-NH1 3.79Å; E338-R341 PolarHBondContact OE2-NH1 2.94Å; E338-M342 PolarHBondContact O-N 3.11Å; E338-F371 PolarHBondContact N-O 3.21Å; E338-F371 VanDerWaalsContact N-O 3.13Å; E338-R521 IonicContact OE1-NH2 3.19Å
339	A	92.4	Very high	93	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-42.3	-175.2	0	0	0	0	0	113.5	L336 D337 R341 M342 L343 M370 F371 I379	L336-A339 HydrophobicContact CB-CB 4.12Å; D337-A339 VanDerWaalsContact C-N 3.29Å; A339-R341 VanDerWaalsContact C-N 3.26Å; A339-R341 PolarHBondContact O-N 2.86Å; A339-M342 HydrophobicContact CB-CE 4.41Å; A339-M342 WeakPolarHBondContact O-CB 3.18Å; A339-M342 PolarHBondContact O-N 2.95Å; A339-M342 VanDerWaalsContact O-N 3.1Å; A339-L343 PolarHBondContact O-N 3.48Å; A339-M370 HydrophobicContact CB-CE 4.39Å; A339-F371 PolarHBondContact N-O 3.13Å; A339-I379 VanDerWaalsContact C-CD1 3.42Å; A339-I379 HydrophobicContact CB-CD1 4.15Å; A339-I379 WeakPolarHBondContact O-CD1 3.33Å
340	D	89.6	Confident	93	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-42.4	-55.6	165.7	39.6	15.9	0	0	0	111.4	E338 M342 L343 D344 S372 A373 T374 I379	E338-D340 WeakPolarHBondContact CA-OD1 3.41Å; D340-M342 VanDerWaalsContact C-N 3.3Å; D340-M342 PolarHBondContact O-N 3.39Å; D340-L343 WeakPolarHBondContact O-CB 3.31Å; D340-L343 PolarHBondContact O-N 3.47Å; D340-D344 PolarHBondContact O-N 2.96Å; D340-D344 VanDerWaalsContact O-N 3.16Å; D340-S372 VanDerWaalsContact CB-OG 3.31Å; D340-S372 WeakPolarHBondContact CB-OG 3.27Å; D340-S372 PolarHBondContact N-OG 3.14Å; D340-S372 PolarHBondContact OD2-OG 2.71Å; D340-A373 WeakPolarHBondContact OD2-CA 3.37Å; D340-A373 PolarHBondContact OD2-N 3.09Å; D340-T374 PolarHBondContact OD2-N 2.83Å; D340-I379 VanDerWaalsContact CA-CD1 3.49Å; D340-I379 HydrophobicContact CB-CG1 4.25Å; D340-I379 VanDerWaalsContact N-CD1 3.33Å
341	R	86.2	Confident	93.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-21.3	-176.3	-162.6	-162.6	145.2	-159.7	3.4	113.8	P264 T265 E338 A339 L343 D344 M345 R493	P264-R341 HydrophobicContact CB-CG 4.48Å; P264-R341 HydrophobicContact CG-CB 4.31Å; P264-R341 HydrophobicContact CG-CG 4.45Å; T265-R341 PolarHBondContact OG1-NH1 2.72Å; T265-R341 PolarHBondContact OG1-NH2 3.19Å; E338-R341 HydrophobicContact CB-CB 4.08Å; E338-R341 WeakPolarHBondContact O-CB 3.44Å; E338-R341 PolarHBondContact O-N 3.2Å; E338-R341 VanDerWaalsContact OE2-CD 3.23Å; E338-R341 WeakPolarHBondContact OE2-CD 3.23Å; E338-R341 IonicContact OE2-CZ 3.64Å; E338-R341 IonicContact OE2-NE 2.75Å; E338-R341 IonicContact OE2-NH1 3.79Å; E338-R341 PolarHBondContact OE2-NH1 2.94Å; A339-R341 VanDerWaalsContact C-N 3.26Å; A339-R341 PolarHBondContact O-N 2.86Å; R341-L343 VanDerWaalsContact C-N 3.31Å; R341-D344 WeakPolarHBondContact O-CB 3.47Å; R341-M345 WeakPolarHBondContact O-CB 3.38Å; R341-M345 WeakPolarHBondContact O-CG 3.43Å; R341-M345 PolarHBondContact O-N 3.23Å; R341-M345 VanDerWaalsContact O-N 3.15Å; R341-R493 VanDerWaalsContact CZ-C 3.41Å; R341-R493 VanDerWaalsContact NE-CD 3.33Å; R341-R493 PolarHBondContact NH1-O 2.88Å; R341-R493 PolarHBondContact NH2-O 2.92Å
342	M	90.9	Very high	93	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-68	-33.9	169.7	-76.1	-167.7	-76.3	0	0	111.7	L262 P264 P314 L336 E338 A339 D340 G346 F347 I351	L262-M342 HydrophobicContact CB-CE 4.18Å; L262-M342 HydrophobicContact CB-SD 4.07Å; P264-M342 HydrophobicContact CB-CG 3.61Å; P264-M342 HydrophobicContact CG-CG 4.06Å; P314-M342 HydrophobicContact CG-SD 3.91Å; L336-M342 HydrophobicContact CB-CE 3.58Å; L336-M342 HydrophobicContact CD2-CE 4.19Å; L336-M342 HydrophobicContact CG-CE 3.86Å; E338-M342 PolarHBondContact O-N 3.11Å; A339-M342 HydrophobicContact CB-CE 4.41Å; A339-M342 WeakPolarHBondContact O-CB 3.18Å; A339-M342 PolarHBondContact O-N 2.95Å; A339-M342 VanDerWaalsContact O-N 3.1Å; D340-M342 VanDerWaalsContact C-N 3.3Å; D340-M342 PolarHBondContact O-N 3.39Å; M342-G346 PolarHBondContact O-N 2.88Å; M342-F347 HydrophobicContact CB-CB 4.44Å; M342-F347 HydrophobicContact CG-CD2 4.47Å; M342-F347 WeakPolarHBondContact O-CB 3.3Å; M342-F347 PolarHBondContact O-N 2.84Å; M342-I351 HydrophobicContact CB-CD1 3.71Å; M342-I351 HydrophobicContact CE-CD1 4.33Å; M342-I351 HydrophobicContact CG-CD1 4.28Å; M342-I351 HydrophobicContact SD-CD1 3.78Å
343	L	90.6	Very high	92.9	Very high	30 Å²	30	31.6 Å²	31.6	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-71.3	-42.8	172.1	-57.7	-172.3	0	0	0	111.4	A339 D340 R341 M345 G346 E348 E378 I379 L382	A339-L343 PolarHBondContact O-N 3.48Å; D340-L343 WeakPolarHBondContact O-CB 3.31Å; D340-L343 PolarHBondContact O-N 3.47Å; R341-L343 VanDerWaalsContact C-N 3.31Å; L343-M345 PolarHBondContact O-N 3.46Å; L343-M345 VanDerWaalsContact O-N 3.15Å; L343-G346 PolarHBondContact O-N 3.22Å; L343-E348 HydrophobicContact CD2-CB 3.65Å; L343-E348 HydrophobicContact CD2-CG 3.74Å; L343-E378 HydrophobicContact CD1-CB 3.84Å; L343-I379 HydrophobicContact CD1-CD1 3.43Å; L343-I379 VanDerWaalsContact CD1-CD1 3.43Å; L343-I379 HydrophobicContact CD1-CG1 3.92Å; L343-I379 HydrophobicContact CG-CD1 3.86Å; L343-L382 HydrophobicContact CD1-CD2 4.39Å; L343-L382 HydrophobicContact CD2-CD1 4.42Å; L343-L382 HydrophobicContact CD2-CD2 4.1Å; L343-L382 HydrophobicContact CG-CD2 4.41Å
344	D	86.1	Confident	92.8	Very high	93 Å²	93	31.2 Å²	31.2	50%	0.497	16%	0.164	S	C	.	.	H	α-helix	trans	-51.7	-38.2	172.7	-73.8	-3.8	0	0	0	113.2	D340 R341 G346 R493	D340-D344 PolarHBondContact O-N 2.96Å; D340-D344 VanDerWaalsContact O-N 3.16Å; R341-D344 WeakPolarHBondContact O-CB 3.47Å; D344-G346 VanDerWaalsContact C-N 3.25Å; D344-G346 PolarHBondContact O-N 2.99Å; D344-R493 IonicContact OD2-CZ 3.77Å; D344-R493 IonicContact OD2-NH1 3.92Å; D344-R493 PolarHBondContact OD2-NH1 3.11Å
345	M	84.6	Confident	92.6	Very high	64 Å²	64	31.6 Å²	31.6	32%	0.315	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	5.6	-178.1	-68.8	-176.6	60.8	0	0	112.9	P264 T265 R341 L343 F347	P264-M345 HydrophobicContact CB-SD 3.87Å; P264-M345 WeakPolarHBondContact O-CE 3.46Å; T265-M345 HydrophobicContact CG2-CE 4.24Å; R341-M345 WeakPolarHBondContact O-CB 3.38Å; R341-M345 WeakPolarHBondContact O-CG 3.43Å; R341-M345 PolarHBondContact O-N 3.23Å; R341-M345 VanDerWaalsContact O-N 3.15Å; L343-M345 PolarHBondContact O-N 3.46Å; L343-M345 VanDerWaalsContact O-N 3.15Å; M345-F347 HydrophobicContact CB-CD2 3.81Å; M345-F347 HydrophobicContact CB-CE2 3.81Å; M345-F347 HydrophobicContact CE-CE2 3.93Å; M345-F347 HydrophobicContact CE-CZ 4.42Å
346	G	90	Very high	92.4	Very high	45 Å²	45	36.2 Å²	36.2	46%	0.464	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	20.5	176.2	0	0	0	0	0	114.6	M342 L343 D344 E348 P349 Q350	M342-G346 PolarHBondContact O-N 2.88Å; L343-G346 PolarHBondContact O-N 3.22Å; D344-G346 VanDerWaalsContact C-N 3.25Å; D344-G346 PolarHBondContact O-N 2.99Å; G346-E348 VanDerWaalsContact C-N 3.31Å; G346-E348 PolarHBondContact O-N 3.29Å; G346-P349 VanDerWaalsContact O-CD 3.32Å; G346-P349 WeakPolarHBondContact O-CD 3.48Å; G346-Q350 PolarHBondContact O-OE1 2.83Å
347	F	93.2	Very high	91.9	Very high	38 Å²	38	43 Å²	43	17%	0.167	22%	0.22	C	C	.	.			trans	-81.5	0.3	-177.6	-69.5	-55.7	0	0	0	114.9	P264 P314 M342 M345 P349 Q350 I351	P264-F347 WeakPolarHBondContact O-CE2 3.25Å; P314-F347 HydrophobicContact CB-CB 4.18Å; P314-F347 HydrophobicContact CB-CD1 4.09Å; P314-F347 HydrophobicContact CB-CG 4.17Å; P314-F347 HydrophobicContact CG-CB 4.07Å; P314-F347 HydrophobicContact CG-CD1 4.44Å; P314-F347 HydrophobicContact CG-CD2 4.38Å; P314-F347 HydrophobicContact CG-CG 4.08Å; M342-F347 HydrophobicContact CB-CB 4.44Å; M342-F347 HydrophobicContact CG-CD2 4.47Å; M342-F347 WeakPolarHBondContact O-CB 3.3Å; M342-F347 PolarHBondContact O-N 2.84Å; M345-F347 HydrophobicContact CB-CD2 3.81Å; M345-F347 HydrophobicContact CB-CE2 3.81Å; M345-F347 HydrophobicContact CE-CE2 3.93Å; M345-F347 HydrophobicContact CE-CZ 4.42Å; F347-P349 VanDerWaalsContact C-CD 3.46Å; F347-Q350 PolarHBondContact O-N 3.41Å; F347-Q350 VanDerWaalsContact O-N 3.17Å; F347-Q350 PolarHBondContact O-OE1 3.19Å; F347-I351 HydrophobicContact CB-CD1 3.96Å; F347-I351 HydrophobicContact CB-CG1 4.3Å; F347-I351 VanDerWaalsContact O-CG1 3.29Å; F347-I351 WeakPolarHBondContact O-CG1 3.4Å; F347-I351 PolarHBondContact O-N 3.16Å
348	E	94.4	Very high	91.8	Very high	72 Å²	72	45 Å²	45	34%	0.336	23%	0.231	S	C	.	.	H	α-helix	trans	-51.2	-45.7	179.5	-158.9	-173.9	165	0	0	113.4	L343 G346 Q350 I351 R352 L382	L343-E348 HydrophobicContact CD2-CB 3.65Å; L343-E348 HydrophobicContact CD2-CG 3.74Å; G346-E348 VanDerWaalsContact C-N 3.31Å; G346-E348 PolarHBondContact O-N 3.29Å; E348-Q350 PolarHBondContact O-N 3.31Å; E348-I351 PolarHBondContact O-N 3.08Å; E348-R352 HydrophobicContact CG-CG 4.35Å; E348-R352 WeakPolarHBondContact O-CB 3.44Å; E348-R352 PolarHBondContact O-N 3.46Å; E348-R352 IonicContact OE1-CZ 2.68Å; E348-R352 VanDerWaalsContact OE1-CZ 3.27Å; E348-R352 IonicContact OE1-NE 3.13Å; E348-R352 PolarHBondContact OE1-NE 2.67Å; E348-R352 IonicContact OE1-NH2 3.85Å; E348-R352 PolarHBondContact OE1-NH2 2.92Å; E348-L382 HydrophobicContact CG-CD1 4.21Å
349	P	95	Very high	91.8	Very high	90 Å²	90	47.2 Å²	47.2	58%	0.584	25%	0.251	S	S	*	.	H	α-helix	trans	-63.7	-39.4	-179.7	-22	35.1	0	0	0	112.9	G346 F347 R353	G346-P349 VanDerWaalsContact O-CD 3.32Å; G346-P349 WeakPolarHBondContact O-CD 3.48Å; F347-P349 VanDerWaalsContact C-CD 3.46Å; P349-R353 VanDerWaalsContact O-CB 3.3Å; P349-R353 WeakPolarHBondContact O-CB 3.42Å; P349-R353 PolarHBondContact O-N 2.93Å
350	Q	95	Very high	91.9	Very high	66 Å²	66	48 Å²	48	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-69.6	-40.6	176.9	-65.1	79.4	4.6	0	0	110.9	P314 G346 F347 E348 R353 I354	P314-Q350 HydrophobicContact CB-CB 3.9Å; G346-Q350 PolarHBondContact O-OE1 2.83Å; F347-Q350 PolarHBondContact O-N 3.41Å; F347-Q350 VanDerWaalsContact O-N 3.17Å; F347-Q350 PolarHBondContact O-OE1 3.19Å; E348-Q350 PolarHBondContact O-N 3.31Å; Q350-R353 PolarHBondContact O-N 3.33Å; Q350-I354 WeakPolarHBondContact O-CB 3.3Å; Q350-I354 VanDerWaalsContact O-CD1 3.25Å; Q350-I354 WeakPolarHBondContact O-CD1 3.23Å; Q350-I354 WeakPolarHBondContact O-CG1 3.5Å; Q350-I354 PolarHBondContact O-N 3.17Å
351	I	96	Very high	92.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-48.6	178.5	-66.1	168.3	0	0	0	110.5	L262 P314 L336 M342 F347 E348 R353 I354 V355 F386	L262-I351 HydrophobicContact CD1-CG1 4.34Å; L262-I351 HydrophobicContact CD1-CG2 4.45Å; P314-I351 HydrophobicContact CB-CG1 4.03Å; P314-I351 HydrophobicContact CG-CD1 4.12Å; P314-I351 HydrophobicContact CG-CG1 3.77Å; L336-I351 HydrophobicContact CD2-CG2 4.08Å; M342-I351 HydrophobicContact CB-CD1 3.71Å; M342-I351 HydrophobicContact CE-CD1 4.33Å; M342-I351 HydrophobicContact CG-CD1 4.28Å; M342-I351 HydrophobicContact SD-CD1 3.78Å; F347-I351 HydrophobicContact CB-CD1 3.96Å; F347-I351 HydrophobicContact CB-CG1 4.3Å; F347-I351 VanDerWaalsContact O-CG1 3.29Å; F347-I351 WeakPolarHBondContact O-CG1 3.4Å; F347-I351 PolarHBondContact O-N 3.16Å; E348-I351 PolarHBondContact O-N 3.08Å; I351-R353 VanDerWaalsContact C-N 3.31Å; I351-R353 PolarHBondContact O-N 2.93Å; I351-I354 PolarHBondContact O-N 3.31Å; I351-I354 VanDerWaalsContact O-N 3.17Å; I351-V355 HydrophobicContact CG2-CG2 4.2Å; I351-V355 WeakPolarHBondContact O-CB 3.5Å; I351-V355 VanDerWaalsContact O-CG2 3.26Å; I351-V355 WeakPolarHBondContact O-CG2 3.22Å; I351-V355 PolarHBondContact O-N 3.25Å; I351-F386 HydrophobicContact CG2-CE2 3.53Å; I351-F386 HydrophobicContact CG2-CZ 3.92Å
352	R	95.4	Very high	92.6	Very high	46 Å²	46	52.2 Å²	52.2	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-42.5	174.7	-76.1	-167.6	-173.3	-86.4	1.3	111.7	E348 I354 V355 E356 D385 F386	E348-R352 HydrophobicContact CG-CG 4.35Å; E348-R352 WeakPolarHBondContact O-CB 3.44Å; E348-R352 PolarHBondContact O-N 3.46Å; E348-R352 IonicContact OE1-CZ 2.68Å; E348-R352 VanDerWaalsContact OE1-CZ 3.27Å; E348-R352 IonicContact OE1-NE 3.13Å; E348-R352 PolarHBondContact OE1-NE 2.67Å; E348-R352 IonicContact OE1-NH2 3.85Å; E348-R352 PolarHBondContact OE1-NH2 2.92Å; R352-I354 PolarHBondContact O-N 3.48Å; R352-V355 PolarHBondContact O-N 2.77Å; R352-E356 HydrophobicContact CB-CG 4.48Å; R352-E356 WeakPolarHBondContact CB-OE2 3.2Å; R352-E356 IonicContact CZ-OE1 2.77Å; R352-E356 IonicContact NH1-OE1 3.25Å; R352-E356 PolarHBondContact NH1-OE1 3.19Å; R352-E356 WeakPolarHBondContact O-CA 3.17Å; R352-E356 WeakPolarHBondContact O-CB 3.46Å; R352-E356 WeakPolarHBondContact O-CG 3.38Å; R352-E356 PolarHBondContact O-N 3.11Å; R352-D385 IonicContact CZ-OD2 2.69Å; R352-D385 VanDerWaalsContact CZ-OD2 3.29Å; R352-D385 IonicContact NH1-OD2 3.18Å; R352-D385 PolarHBondContact NH1-OD2 3.28Å; R352-D385 IonicContact NH2-OD2 3.5Å; R352-D385 PolarHBondContact NH2-OD2 3.21Å; R352-F386 HydrophobicContact CG-CE1 4.36Å; R352-F386 HydrophobicContact CG-CZ 3.95Å
353	R	94.6	Very high	92.7	Very high	87 Å²	87	54.2 Å²	54.2	33%	0.328	30%	0.297	S	S	.	.	I	π-helix	trans	-55.9	-52.4	172.3	-178.1	177.7	178.3	-175.2	1.9	112.4	E322 P349 Q350 I351 V355 Q357 D358	E322-R353 IonicContact OE1-CZ 2.96Å; E322-R353 IonicContact OE1-NH1 3.32Å; E322-R353 PolarHBondContact OE1-NH1 3.33Å; E322-R353 IonicContact OE1-NH2 3.78Å; E322-R353 PolarHBondContact OE1-NH2 2.76Å; P349-R353 VanDerWaalsContact O-CB 3.3Å; P349-R353 WeakPolarHBondContact O-CB 3.42Å; P349-R353 PolarHBondContact O-N 2.93Å; Q350-R353 PolarHBondContact O-N 3.33Å; I351-R353 VanDerWaalsContact C-N 3.31Å; I351-R353 PolarHBondContact O-N 2.93Å; R353-V355 VanDerWaalsContact C-N 3.25Å; R353-V355 PolarHBondContact O-N 3.3Å; R353-Q357 HydrophobicContact CG-CB 4.35Å; R353-Q357 CarbonylContact O-C 3.54Å; R353-Q357 WeakPolarHBondContact O-CA 3.4Å; R353-Q357 WeakPolarHBondContact O-CB 3.23Å; R353-Q357 PolarHBondContact O-N 3.29Å; R353-D358 PolarHBondContact O-N 3.02Å
354	I	95.5	Very high	92.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.315	C	S	.	.	I	π-helix	trans	-61.1	-31.4	-179.9	-70.5	158.9	0	0	0	112.6	L260 L262 P314 L317 L321 L328 Q350 I351 R352	L260-I354 HydrophobicContact CD2-CG2 4.02Å; L262-I354 HydrophobicContact CD1-CG2 4.4Å; P314-I354 HydrophobicContact CB-CD1 4.15Å; L317-I354 HydrophobicContact CB-CD1 4.17Å; L317-I354 HydrophobicContact CD2-CD1 4.08Å; L317-I354 HydrophobicContact CD2-CG1 4.39Å; L317-I354 HydrophobicContact CD2-CG2 4.04Å; L317-I354 HydrophobicContact CG-CD1 4.31Å; L321-I354 HydrophobicContact CD1-CG1 4.02Å; L328-I354 HydrophobicContact CD1-CG2 3.87Å; Q350-I354 WeakPolarHBondContact O-CB 3.3Å; Q350-I354 VanDerWaalsContact O-CD1 3.25Å; Q350-I354 WeakPolarHBondContact O-CD1 3.23Å; Q350-I354 WeakPolarHBondContact O-CG1 3.5Å; Q350-I354 PolarHBondContact O-N 3.17Å; I351-I354 PolarHBondContact O-N 3.31Å; I351-I354 VanDerWaalsContact O-N 3.17Å; R352-I354 PolarHBondContact O-N 3.48Å
355	V	94.8	Very high	93.1	Very high	8 Å²	8	58 Å²	58	5%	0.048	33%	0.325	C	S	.	.	I	π-helix	trans	-103	-26	-169.6	178.3	0	0	0	0	114.1	L334 I351 R352 R353 L360 F386	L334-V355 HydrophobicContact CD2-CG1 4.09Å; L334-V355 HydrophobicContact CD2-CG2 3.72Å; I351-V355 HydrophobicContact CG2-CG2 4.2Å; I351-V355 WeakPolarHBondContact O-CB 3.5Å; I351-V355 VanDerWaalsContact O-CG2 3.26Å; I351-V355 WeakPolarHBondContact O-CG2 3.22Å; I351-V355 PolarHBondContact O-N 3.25Å; R352-V355 PolarHBondContact O-N 2.77Å; R353-V355 VanDerWaalsContact C-N 3.25Å; R353-V355 PolarHBondContact O-N 3.3Å; V355-L360 HydrophobicContact CB-CD2 4.29Å; V355-L360 HydrophobicContact CG1-CD2 4.17Å; V355-L360 HydrophobicContact CG2-CD2 4.24Å; V355-F386 HydrophobicContact CB-CD1 4.41Å; V355-F386 HydrophobicContact CB-CE1 4.03Å; V355-F386 HydrophobicContact CB-CZ 4.11Å; V355-F386 HydrophobicContact CG1-CD1 3.56Å; V355-F386 HydrophobicContact CG1-CD2 4.33Å; V355-F386 HydrophobicContact CG1-CE1 3.67Å; V355-F386 HydrophobicContact CG1-CE2 4.42Å; V355-F386 HydrophobicContact CG1-CG 3.92Å; V355-F386 HydrophobicContact CG1-CZ 4.11Å; V355-F386 HydrophobicContact CG2-CE2 4.49Å; V355-F386 HydrophobicContact CG2-CZ 4.48Å
356	E	92.7	Very high	93.6	Very high	97 Å²	97	55.4 Å²	55.4	45%	0.453	31%	0.311	S	S	.	.	I	π-helix	trans	-117.7	-23.2	-173.8	-51.7	170.8	168.9	0	0	113.7	R352 F386	R352-E356 HydrophobicContact CB-CG 4.48Å; R352-E356 WeakPolarHBondContact CB-OE2 3.2Å; R352-E356 IonicContact CZ-OE1 2.77Å; R352-E356 IonicContact NH1-OE1 3.25Å; R352-E356 PolarHBondContact NH1-OE1 3.19Å; R352-E356 WeakPolarHBondContact O-CA 3.17Å; R352-E356 WeakPolarHBondContact O-CB 3.46Å; R352-E356 WeakPolarHBondContact O-CG 3.38Å; R352-E356 PolarHBondContact O-N 3.11Å; E356-F386 HydrophobicContact CG-CE1 4.01Å; E356-F386 WeakPolarHBondContact OE1-CE1 3.43Å
357	Q	89.1	Confident	94	Very high	142 Å²	142	54 Å²	54	66%	0.664	29%	0.292	S	S	*	.	I	π-helix	trans	-119.4	-29.1	-168.5	-52.6	175.6	6	0	0	113.5	R353	R353-Q357 HydrophobicContact CG-CB 4.35Å; R353-Q357 CarbonylContact O-C 3.54Å; R353-Q357 WeakPolarHBondContact O-CA 3.4Å; R353-Q357 WeakPolarHBondContact O-CB 3.23Å; R353-Q357 PolarHBondContact O-N 3.29Å
358	D	91.1	Very high	94.2	Very high	48 Å²	48	52.1 Å²	52.1	26%	0.257	29%	0.285	S	S	.	.	S	Bend	trans	-80.4	167.9	167.7	-90.1	-71.3	0	0	0	111.7	R353 L360	R353-D358 PolarHBondContact O-N 3.02Å; D358-L360 PolarHBondContact O-N 3.39Å
359	A	91.7	Very high	94.4	Very high	58 Å²	58	48.8 Å²	48.8	48%	0.479	27%	0.269	S	S	.	.	S	Bend	trans	-74.3	47.2	-175.7	0	0	0	0	0	114.4	L328 D329	L328-A359 CarbonylContact C-O 3.13Å; D329-A359 VanDerWaalsContact CA-O 3.22Å; D329-A359 WeakPolarHBondContact CA-O 3.46Å; D329-A359 PolarHBondContact N-O 2.71Å; D329-A359 VanDerWaalsContact N-O 3.1Å
360	L	94.4	Very high	94.5	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.084	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-87.9	130.7	174.6	-176.5	72.5	0	0	0	110.2	L328 C331 L334 V355 D358	L328-L360 HydrophobicContact CB-CB 4.06Å; L328-L360 HydrophobicContact CB-CD1 3.84Å; L328-L360 HydrophobicContact CD1-CB 4.31Å; L328-L360 HydrophobicContact CD1-CD1 4.32Å; C331-L360 HydrophobicContact CB-CD1 3.7Å; L334-L360 HydrophobicContact CD2-CD2 3.93Å; V355-L360 HydrophobicContact CB-CD2 4.29Å; V355-L360 HydrophobicContact CG1-CD2 4.17Å; V355-L360 HydrophobicContact CG2-CD2 4.24Å; D358-L360 PolarHBondContact O-N 3.39Å
361	P	95.6	Very high	94.5	Very high	27 Å²	27	41.4 Å²	41.4	18%	0.175	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-54.6	142.1	174.6	-27.9	35.2	0	0	0	112.7	L328 E365 R366	L328-P361 VanDerWaalsContact O-CD 3.24Å; L328-P361 WeakPolarHBondContact O-CD 3.48Å; P361-E365 HydrophobicContact CB-CB 4.2Å; P361-R366 VanDerWaalsContact O-CD 3.23Å; P361-R366 WeakPolarHBondContact O-CD 3.47Å; P361-R366 WeakPolarHBondContact O-CG 3.44Å; P361-R366 PolarHBondContact O-NH1 3.03Å
362	P	94.3	Very high	94.2	Very high	68 Å²	68	41.4 Å²	41.4	44%	0.442	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-68.3	162.9	-174.1	28.4	-36	0	0	0	113.2	G364 E365 R366	P362-G364 PolarHBondContact O-N 3.2Å; P362-E365 HydrophobicContact CG-CB 4.31Å; P362-E365 HydrophobicContact CG-CG 4.06Å; P362-E365 WeakPolarHBondContact CG-OE1 3.06Å; P362-E365 PolarHBondContact O-N 3.43Å; P362-R366 PolarHBondContact O-N 2.9Å; P362-R366 VanDerWaalsContact O-N 3.13Å
363	S	92.1	Very high	93.6	Very high	44 Å²	44	39.7 Å²	39.7	31%	0.308	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-62.6	118.3	-179	49.9	0	0	0	0	111.9	F386 N388	S363-F386 VanDerWaalsContact CB-O 3.29Å; S363-F386 WeakPolarHBondContact CB-O 3.11Å; S363-N388 PolarHBondContact O-ND2 2.79Å; S363-N388 VanDerWaalsContact O-ND2 3.13Å
364	G	91.8	Very high	93	Very high	51 Å²	51	35.9 Å²	35.9	53%	0.526	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	106.4	-20	-171.1	0	0	0	0	0	114.4	P362 R366 N388	P362-G364 PolarHBondContact O-N 3.2Å; G364-R366 PolarHBondContact N-O 3.44Å; G364-N388 WeakPolarHBondContact CA-ND2 3.4Å
365	E	94.3	Very high	92.7	Very high	151 Å²	151	36.5 Å²	36.5	71%	0.706	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-41	161.6	-68	179.4	-150.9	0	0	110.4	P361 P362	P361-E365 HydrophobicContact CB-CB 4.2Å; P362-E365 HydrophobicContact CG-CB 4.31Å; P362-E365 HydrophobicContact CG-CG 4.06Å; P362-E365 WeakPolarHBondContact CG-OE1 3.06Å; P362-E365 PolarHBondContact O-N 3.43Å
366	R	95.7	Very high	92.3	Very high	10 Å²	10	38 Å²	38	4%	0.038	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-88.2	152.9	160.8	70.7	175.3	-171.2	-107.8	-1	111	R332 P361 P362 G364 T368 F386	R332-R366 WeakPolarHBondContact O-CA 3.31Å; P361-R366 VanDerWaalsContact O-CD 3.23Å; P361-R366 WeakPolarHBondContact O-CD 3.47Å; P361-R366 WeakPolarHBondContact O-CG 3.44Å; P361-R366 PolarHBondContact O-NH1 3.03Å; P362-R366 PolarHBondContact O-N 2.9Å; P362-R366 VanDerWaalsContact O-N 3.13Å; G364-R366 PolarHBondContact N-O 3.44Å; R366-T368 PolarHBondContact NE-OG1 2.98Å; R366-F386 PolarHBondContact NH2-O 2.89Å
367	Q	97.5	Very high	92.1	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.065	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.7	160.4	-172.7	178.4	19.4	0	0	109.3	I207 R211 D212 R332 F333 L334 L369	I207-Q367 PolarHBondContact O-NE2 2.94Å; R211-Q367 PolarHBondContact O-NE2 3.42Å; D212-Q367 WeakPolarHBondContact OD1-CA 3.38Å; R332-Q367 PolarHBondContact O-N 3.13Å; F333-Q367 WeakPolarHBondContact CA-O 3.47Å; F333-Q367 HydrophobicContact CD1-CB 4.14Å; F333-Q367 VanDerWaalsContact CE1-OE1 3.31Å; L334-Q367 PolarHBondContact N-O 3.17Å; Q367-L369 HydrophobicContact CG-CD2 4.05Å
368	T	98	Very high	92.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.4	-179.6	-44.6	0	0	0	0	111.4	D212 L213 L334 R366 F386 L387	D212-T368 VanDerWaalsContact CA-O 3.24Å; D212-T368 WeakPolarHBondContact CA-O 3.45Å; D212-T368 VanDerWaalsContact CB-O 3.24Å; D212-T368 WeakPolarHBondContact CB-O 3.41Å; D212-T368 VanDerWaalsContact CG-N 3.34Å; D212-T368 VanDerWaalsContact CG-O 3.26Å; D212-T368 PolarHBondContact OD1-N 3.47Å; L213-T368 PolarHBondContact N-O 3.06Å; L334-T368 HydrophobicContact CB-CG2 4.13Å; L334-T368 HydrophobicContact CD2-CG2 3.79Å; L334-T368 HydrophobicContact CG-CG2 4.01Å; L334-T368 CarbonylContact O-C 3.55Å; L334-T368 WeakPolarHBondContact O-CA 3.39Å; R366-T368 PolarHBondContact NE-OG1 2.98Å; T368-F386 HydrophobicContact CG2-CB 4.48Å; T368-F386 PolarHBondContact OG1-O 2.81Å; T368-L387 HydrophobicContact CG2-CD2 3.5Å; T368-L387 WeakPolarHBondContact O-CD2 3.39Å
369	L	97.8	Very high	92.2	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.3	179.6	-43.5	-179.1	0	0	0	110.3	I207 L213 F227 I231 L334 V335 L336 Q367 F371	I207-L369 HydrophobicContact CD1-CD1 3.71Å; I207-L369 HydrophobicContact CD1-CD2 4.49Å; I207-L369 HydrophobicContact CG1-CD1 3.85Å; I207-L369 HydrophobicContact CG1-CD2 3.85Å; I207-L369 HydrophobicContact CG2-CD1 3.9Å; I207-L369 HydrophobicContact CG2-CD2 4.36Å; L213-L369 HydrophobicContact CB-CD2 3.87Å; L213-L369 CarbonylContact O-C 3.53Å; L213-L369 WeakPolarHBondContact O-CA 3.25Å; F227-L369 HydrophobicContact CB-CD1 3.86Å; I231-L369 HydrophobicContact CD1-CD1 3.92Å; I231-L369 HydrophobicContact CG1-CD1 4.48Å; L334-L369 PolarHBondContact O-N 3.25Å; V335-L369 CarbonylContact C-O 3.51Å; V335-L369 VanDerWaalsContact CA-O 3.3Å; V335-L369 WeakPolarHBondContact CA-O 3.3Å; V335-L369 HydrophobicContact CG1-CB 4.38Å; V335-L369 HydrophobicContact CG2-CB 4.33Å; V335-L369 HydrophobicContact CG2-CD1 4.1Å; V335-L369 HydrophobicContact CG2-CG 4.42Å; L336-L369 PolarHBondContact N-O 3Å; Q367-L369 HydrophobicContact CG-CD2 4.05Å; L369-F371 HydrophobicContact CB-CD2 4.41Å; L369-F371 HydrophobicContact CB-CE2 3.84Å; L369-F371 HydrophobicContact CD1-CE2 4.25Å
370	M	97.2	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.8	175.7	-75.4	175.6	60	0	0	110.2	L213 M214 A215 L336 A339 I379 L382 A383 L387	L213-M370 PolarHBondContact O-N 2.71Å; M214-M370 HydrophobicContact CE-CB 4.5Å; M214-M370 HydrophobicContact SD-CB 3.5Å; M214-M370 WeakPolarHBondContact SD-CB 3.31Å; M214-M370 HydrophobicContact SD-CE 4.06Å; A215-M370 PolarHBondContact N-O 3.23Å; L336-M370 HydrophobicContact CB-CG 4.14Å; L336-M370 HydrophobicContact CD2-CG 4.36Å; A339-M370 HydrophobicContact CB-CE 4.39Å; M370-I379 HydrophobicContact CE-CG2 4.32Å; M370-L382 HydrophobicContact CE-CB 4.16Å; M370-L382 HydrophobicContact CE-CD2 3.94Å; M370-L382 HydrophobicContact CE-CG 4.23Å; M370-A383 HydrophobicContact CE-CB 3.93Å; M370-A383 HydrophobicContact SD-CB 4.05Å; M370-L387 HydrophobicContact CG-CD2 4.01Å; M370-L387 HydrophobicContact SD-CD1 4.1Å; M370-L387 HydrophobicContact SD-CD2 3.95Å; M370-L387 HydrophobicContact SD-CG 3.93Å
371	F	94.9	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.2	-179.6	-71.3	-90.8	0	0	0	110.1	I207 L213 A215 K223 F227 V335 L336 D337 E338 A339 L369	I207-F371 HydrophobicContact CD1-CZ 4.28Å; L213-F371 HydrophobicContact CD2-CE1 4.27Å; L213-F371 HydrophobicContact CD2-CZ 3.89Å; A215-F371 HydrophobicContact CB-CD1 3.56Å; A215-F371 HydrophobicContact CB-CE1 3.61Å; A215-F371 HydrophobicContact CB-CG 4.37Å; A215-F371 HydrophobicContact CB-CZ 4.43Å; A215-F371 WeakPolarHBondContact O-CA 3.28Å; K223-F371 HydrophobicContact CB-CD1 3.98Å; K223-F371 HydrophobicContact CB-CE1 4.47Å; K223-F371 HydrophobicContact CD-CB 4.23Å; K223-F371 HydrophobicContact CD-CD1 4.05Å; K223-F371 HydrophobicContact CG-CD1 4.25Å; F227-F371 HydrophobicContact CB-CE2 3.73Å; F227-F371 HydrophobicContact CB-CZ 3.93Å; F227-F371 AromaticContact CD1-CD2 3.73Å; F227-F371 HydrophobicContact CD1-CD2 3.73Å; F227-F371 HydrophobicContact CD1-CE1 4.44Å; F227-F371 AromaticContact CD1-CE2 3.47Å; F227-F371 HydrophobicContact CD1-CE2 3.47Å; F227-F371 VanDerWaalsContact CD1-CE2 3.47Å; F227-F371 HydrophobicContact CD1-CG 4.34Å; F227-F371 AromaticContact CD1-CZ 3.86Å; F227-F371 HydrophobicContact CD1-CZ 3.86Å; F227-F371 HydrophobicContact CE1-CD2 4.24Å; F227-F371 HydrophobicContact CE1-CE2 4.41Å; F227-F371 AromaticContact CG-CE2 3.98Å; F227-F371 HydrophobicContact CG-CE2 3.98Å; F227-F371 HydrophobicContact CG-CZ 4.39Å; V335-F371 HydrophobicContact CG1-CD2 4Å; V335-F371 HydrophobicContact CG1-CE2 4.24Å; L336-F371 PolarHBondContact O-N 2.86Å; D337-F371 HydrophobicContact CB-CB 4.36Å; D337-F371 VanDerWaalsContact OD1-CB 3.31Å; D337-F371 WeakPolarHBondContact OD1-CB 3.23Å; E338-F371 PolarHBondContact N-O 3.21Å; E338-F371 VanDerWaalsContact N-O 3.13Å; A339-F371 PolarHBondContact N-O 3.13Å; L369-F371 HydrophobicContact CB-CD2 4.41Å; L369-F371 HydrophobicContact CB-CE2 3.84Å; L369-F371 HydrophobicContact CD1-CE2 4.25Å
372	S	90.3	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	162.3	-170.8	-147.5	0	0	0	0	109.7	A215 C216 A217 K223 D340 T374	A215-S372 PolarHBondContact O-N 3.31Å; C216-S372 WeakPolarHBondContact CA-O 3.42Å; A217-S372 PolarHBondContact N-O 3.44Å; A217-S372 VanDerWaalsContact O-O 3.09Å; K223-S372 PolarHBondContact NZ-O 2.93Å; D340-S372 VanDerWaalsContact CB-OG 3.31Å; D340-S372 WeakPolarHBondContact CB-OG 3.27Å; D340-S372 PolarHBondContact N-OG 3.14Å; D340-S372 PolarHBondContact OD2-OG 2.71Å; S372-T374 VanDerWaalsContact CB-O 3.26Å; S372-T374 WeakPolarHBondContact CB-O 2.92Å; S372-T374 PolarHBondContact OG-O 3.03Å
373	A	82.6	Confident	92.1	Very high	11 Å²	11	31.3 Å²	31.3	9%	0.091	18%	0.175	C	C	.	.	S	Bend	trans	-102	-39.2	167.6	0	0	0	0	0	110.9	D340 G399 H517	D340-A373 WeakPolarHBondContact OD2-CA 3.37Å; D340-A373 PolarHBondContact OD2-N 3.09Å; A373-G399 PolarHBondContact O-N 2.88Å; A373-H517 WeakPolarHBondContact CB-NE2 3.41Å
374	T	82.5	Confident	92.1	Very high	6 Å²	6	35.2 Å²	35.2	4%	0.037	19%	0.186	C	C	.	.			trans	-107.6	169.9	173	74.2	0	0	0	0	111	D340 S372 P376 E513	D340-T374 PolarHBondContact OD2-N 2.83Å; S372-T374 VanDerWaalsContact CB-O 3.26Å; S372-T374 WeakPolarHBondContact CB-O 2.92Å; S372-T374 PolarHBondContact OG-O 3.03Å; T374-P376 WeakPolarHBondContact OG1-CD 3.09Å; T374-E513 VanDerWaalsContact CB-OE2 3.25Å; T374-E513 WeakPolarHBondContact CB-OE2 3.48Å; T374-E513 HydrophobicContact CG2-CB 4.44Å; T374-E513 HydrophobicContact CG2-CG 4.22Å; T374-E513 WeakPolarHBondContact CG2-OE2 3.24Å; T374-E513 PolarHBondContact OG1-OE2 3.36Å
375	F	88.2	Confident	92.3	Very high	13 Å²	13	35.7 Å²	35.7	6%	0.057	18%	0.177	C	C	.	.			trans	-139.3	57.2	-179.5	-161.4	-129.1	0	0	0	112.5	M214 I379 Q380 F392 V398	M214-F375 HydrophobicContact CE-CD2 3.67Å; M214-F375 HydrophobicContact CE-CE2 3.68Å; M214-F375 HydrophobicContact CG-CD2 4.44Å; M214-F375 HydrophobicContact CG-CE2 3.62Å; M214-F375 HydrophobicContact CG-CZ 4.07Å; M214-F375 HydrophobicContact SD-CD2 4.47Å; M214-F375 HydrophobicContact SD-CE2 3.87Å; F375-I379 HydrophobicContact CD2-CB 4.41Å; F375-I379 HydrophobicContact CD2-CG2 3.62Å; F375-I379 HydrophobicContact CE2-CG2 3.86Å; F375-Q380 HydrophobicContact CD1-CG 3.75Å; F375-Q380 HydrophobicContact CD2-CG 4.31Å; F375-Q380 HydrophobicContact CE1-CG 3.36Å; F375-Q380 HydrophobicContact CE2-CG 3.95Å; F375-Q380 HydrophobicContact CG-CG 4.22Å; F375-Q380 HydrophobicContact CZ-CB 4.45Å; F375-Q380 HydrophobicContact CZ-CG 3.48Å; F375-Q380 VanDerWaalsContact CZ-CG 3.48Å; F375-Q380 PolarHBondContact O-NE2 3.43Å; F375-F392 AromaticContact CD1-CE2 3.68Å; F375-F392 HydrophobicContact CD1-CE2 3.68Å; F375-F392 AromaticContact CD1-CZ 3.53Å; F375-F392 HydrophobicContact CD1-CZ 3.53Å; F375-F392 HydrophobicContact CD2-CE2 4.17Å; F375-F392 HydrophobicContact CE1-CD2 4.13Å; F375-F392 HydrophobicContact CE1-CE1 4.33Å; F375-F392 AromaticContact CE1-CE2 3.31Å; F375-F392 HydrophobicContact CE1-CE2 3.31Å; F375-F392 AromaticContact CE1-CZ 3.43Å; F375-F392 HydrophobicContact CE1-CZ 3.43Å; F375-F392 VanDerWaalsContact CE1-CZ 3.43Å; F375-F392 AromaticContact CE2-CE2 3.87Å; F375-F392 HydrophobicContact CE2-CE2 3.87Å; F375-F392 HydrophobicContact CG-CE2 4.09Å; F375-F392 HydrophobicContact CG-CZ 4.21Å; F375-F392 AromaticContact CZ-CD2 3.97Å; F375-F392 HydrophobicContact CZ-CD2 3.97Å; F375-F392 AromaticContact CZ-CE2 3.42Å; F375-F392 HydrophobicContact CZ-CE2 3.42Å; F375-F392 VanDerWaalsContact CZ-CE2 3.42Å; F375-F392 HydrophobicContact CZ-CZ 4.06Å; F375-V398 HydrophobicContact CB-CG1 3.84Å
376	P	86.3	Confident	92.3	Very high	40 Å²	40	28.6 Å²	28.6	26%	0.26	14%	0.143	S	C	.	.			trans	-64.9	171.2	178.1	31.9	-38.2	0	0	0	111.5	T374 E378 I379 Q380	T374-P376 WeakPolarHBondContact OG1-CD 3.09Å; P376-E378 PolarHBondContact O-N 3.19Å; P376-I379 HydrophobicContact CG-CB 4.23Å; P376-I379 HydrophobicContact CG-CG1 3.93Å; P376-I379 PolarHBondContact O-N 3.49Å; P376-Q380 PolarHBondContact O-N 3.07Å
377	N	89.4	Confident	92.3	Very high	92 Å²	92	28.7 Å²	28.7	49%	0.492	14%	0.144	S	C	.	.	H	α-helix	trans	-61.8	-32.2	-175.1	171.9	71.9	0	0	0	112.2	Q380 I381	N377-Q380 WeakPolarHBondContact O-CB 3.45Å; N377-Q380 PolarHBondContact O-N 3.36Å; N377-I381 WeakPolarHBondContact O-CG1 3.47Å; N377-I381 PolarHBondContact O-N 3.22Å
378	E	90.9	Very high	92.1	Very high	103 Å²	103	31.7 Å²	31.7	48%	0.481	16%	0.161	S	C	.	.	H	α-helix	trans	-67	-39.7	-179.8	-63.1	58.1	-126.7	0	0	110.2	L343 P376 I381 L382	L343-E378 HydrophobicContact CD1-CB 3.84Å; P376-E378 PolarHBondContact O-N 3.19Å; E378-I381 PolarHBondContact O-N 3.44Å; E378-L382 WeakPolarHBondContact O-CB 3.31Å; E378-L382 PolarHBondContact O-N 2.91Å
379	I	91.9	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-74.3	-30.9	172.8	-67	-68.1	0	0	0	112.1	M214 A339 D340 L343 M370 F375 P376 I381 L382 A383	M214-I379 HydrophobicContact CE-CG2 3.9Å; M214-I379 HydrophobicContact SD-CG2 4.43Å; A339-I379 VanDerWaalsContact C-CD1 3.42Å; A339-I379 HydrophobicContact CB-CD1 4.15Å; A339-I379 WeakPolarHBondContact O-CD1 3.33Å; D340-I379 VanDerWaalsContact CA-CD1 3.49Å; D340-I379 HydrophobicContact CB-CG1 4.25Å; D340-I379 VanDerWaalsContact N-CD1 3.33Å; L343-I379 HydrophobicContact CD1-CD1 3.43Å; L343-I379 VanDerWaalsContact CD1-CD1 3.43Å; L343-I379 HydrophobicContact CD1-CG1 3.92Å; L343-I379 HydrophobicContact CG-CD1 3.86Å; M370-I379 HydrophobicContact CE-CG2 4.32Å; F375-I379 HydrophobicContact CD2-CB 4.41Å; F375-I379 HydrophobicContact CD2-CG2 3.62Å; F375-I379 HydrophobicContact CE2-CG2 3.86Å; P376-I379 HydrophobicContact CG-CB 4.23Å; P376-I379 HydrophobicContact CG-CG1 3.93Å; P376-I379 PolarHBondContact O-N 3.49Å; I379-I381 VanDerWaalsContact C-N 3.33Å; I379-L382 HydrophobicContact CD1-CD2 4.23Å; I379-L382 PolarHBondContact O-N 3.36Å; I379-A383 WeakPolarHBondContact O-CB 3.22Å; I379-A383 PolarHBondContact O-N 3Å
380	Q	92.6	Very high	91.6	Very high	46 Å²	46	35.8 Å²	35.8	22%	0.215	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-36.7	171.7	-72.7	170.3	57.2	0	0	112.1	F375 P376 N377 K384	F375-Q380 HydrophobicContact CD1-CG 3.75Å; F375-Q380 HydrophobicContact CD2-CG 4.31Å; F375-Q380 HydrophobicContact CE1-CG 3.36Å; F375-Q380 HydrophobicContact CE2-CG 3.95Å; F375-Q380 HydrophobicContact CG-CG 4.22Å; F375-Q380 HydrophobicContact CZ-CB 4.45Å; F375-Q380 HydrophobicContact CZ-CG 3.48Å; F375-Q380 VanDerWaalsContact CZ-CG 3.48Å; F375-Q380 PolarHBondContact O-NE2 3.43Å; P376-Q380 PolarHBondContact O-N 3.07Å; N377-Q380 WeakPolarHBondContact O-CB 3.45Å; N377-Q380 PolarHBondContact O-N 3.36Å; Q380-K384 VanDerWaalsContact O-CB 3.3Å; Q380-K384 WeakPolarHBondContact O-CB 3.32Å; Q380-K384 PolarHBondContact O-N 2.68Å; Q380-K384 VanDerWaalsContact O-N 3.08Å
381	I	93.7	Very high	91.5	Very high	73 Å²	73	35.9 Å²	35.9	37%	0.374	18%	0.183	S	C	.	.	H	α-helix	trans	-67.1	-51.7	172.3	-67.3	161.9	0	0	0	110	N377 E378 I379 A383 K384 D385	N377-I381 WeakPolarHBondContact O-CG1 3.47Å; N377-I381 PolarHBondContact O-N 3.22Å; E378-I381 PolarHBondContact O-N 3.44Å; I379-I381 VanDerWaalsContact C-N 3.33Å; I381-A383 VanDerWaalsContact C-N 3.29Å; I381-A383 PolarHBondContact O-N 3.34Å; I381-K384 WeakPolarHBondContact O-CB 3.31Å; I381-K384 PolarHBondContact O-N 3.15Å; I381-D385 VanDerWaalsContact O-CG 3.23Å; I381-D385 PolarHBondContact O-N 3.13Å
382	L	93.2	Very high	91.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-57.6	-40.9	179.5	-158.6	77.4	0	0	0	112.6	L336 L343 E348 M370 E378 I379 D385 F386	L336-L382 HydrophobicContact CD2-CD2 4.11Å; L343-L382 HydrophobicContact CD1-CD2 4.39Å; L343-L382 HydrophobicContact CD2-CD1 4.42Å; L343-L382 HydrophobicContact CD2-CD2 4.1Å; L343-L382 HydrophobicContact CG-CD2 4.41Å; E348-L382 HydrophobicContact CG-CD1 4.21Å; M370-L382 HydrophobicContact CE-CB 4.16Å; M370-L382 HydrophobicContact CE-CD2 3.94Å; M370-L382 HydrophobicContact CE-CG 4.23Å; E378-L382 WeakPolarHBondContact O-CB 3.31Å; E378-L382 PolarHBondContact O-N 2.91Å; I379-L382 HydrophobicContact CD1-CD2 4.23Å; I379-L382 PolarHBondContact O-N 3.36Å; L382-D385 PolarHBondContact O-N 3.26Å; L382-F386 HydrophobicContact CD1-CD2 4.15Å; L382-F386 HydrophobicContact CD1-CE2 3.41Å; L382-F386 VanDerWaalsContact CD1-CE2 3.41Å; L382-F386 HydrophobicContact CD1-CZ 3.72Å; L382-F386 HydrophobicContact CD2-CD2 4.49Å; L382-F386 HydrophobicContact CD2-CE2 4.16Å; L382-F386 HydrophobicContact CG-CD2 3.84Å; L382-F386 HydrophobicContact CG-CE2 3.57Å; L382-F386 HydrophobicContact CG-CZ 4.33Å; L382-F386 PolarHBondContact O-N 3.03Å; L382-F386 VanDerWaalsContact O-N 3.08Å
383	A	93.5	Very high	91.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-36.7	175.9	0	0	0	0	0	112.8	M214 M370 I379 I381 L387	M214-A383 HydrophobicContact CG-CB 4.43Å; M214-A383 HydrophobicContact SD-CB 4.05Å; M370-A383 HydrophobicContact CE-CB 3.93Å; M370-A383 HydrophobicContact SD-CB 4.05Å; I379-A383 WeakPolarHBondContact O-CB 3.22Å; I379-A383 PolarHBondContact O-N 3Å; I381-A383 VanDerWaalsContact C-N 3.29Å; I381-A383 PolarHBondContact O-N 3.34Å; A383-L387 HydrophobicContact CB-CD1 3.92Å; A383-L387 HydrophobicContact CB-CG 4.47Å; A383-L387 WeakPolarHBondContact O-CB 3.46Å; A383-L387 WeakPolarHBondContact O-CG 3.37Å; A383-L387 PolarHBondContact O-N 3.23Å; A383-L387 VanDerWaalsContact O-N 3.13Å
384	K	92.9	Very high	92	Very high	127 Å²	127	36.3 Å²	36.3	55%	0.552	18%	0.184	S	C	*	.	H	α-helix	trans	-67.5	-36.3	174.7	175.4	-173.4	167.6	-126.9	0	112.3	Q380 I381 Y589	Q380-K384 VanDerWaalsContact O-CB 3.3Å; Q380-K384 WeakPolarHBondContact O-CB 3.32Å; Q380-K384 PolarHBondContact O-N 2.68Å; Q380-K384 VanDerWaalsContact O-N 3.08Å; I381-K384 WeakPolarHBondContact O-CB 3.31Å; I381-K384 PolarHBondContact O-N 3.15Å; K384-Y589 HydrophobicContact CB-CE1 4.06Å; K384-Y589 WeakPolarHBondContact CB-OH 3.3Å; K384-Y589 HydrophobicContact CD-CE2 4.48Å; K384-Y589 WeakPolarHBondContact CG-OH 3.42Å
385	D	94.3	Very high	92.1	Very high	61 Å²	61	36.6 Å²	36.6	33%	0.326	19%	0.186	S	C	.	.	H	α-helix	trans	-77.5	-37.1	-176.8	-63.6	-14.7	0	0	0	111.9	R352 I381 L382	R352-D385 IonicContact CZ-OD2 2.69Å; R352-D385 VanDerWaalsContact CZ-OD2 3.29Å; R352-D385 IonicContact NH1-OD2 3.18Å; R352-D385 PolarHBondContact NH1-OD2 3.28Å; R352-D385 IonicContact NH2-OD2 3.5Å; R352-D385 PolarHBondContact NH2-OD2 3.21Å; I381-D385 VanDerWaalsContact O-CG 3.23Å; I381-D385 PolarHBondContact O-N 3.13Å; L382-D385 PolarHBondContact O-N 3.26Å
386	F	94.9	Very high	91.7	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-100.7	-20.9	-172.5	-62.4	-18.6	0	0	0	116.2	L336 I351 R352 V355 E356 S363 R366 T368 L382	L336-F386 HydrophobicContact CD2-CD2 4.31Å; L336-F386 HydrophobicContact CD2-CE2 4.35Å; I351-F386 HydrophobicContact CG2-CE2 3.53Å; I351-F386 HydrophobicContact CG2-CZ 3.92Å; R352-F386 HydrophobicContact CG-CE1 4.36Å; R352-F386 HydrophobicContact CG-CZ 3.95Å; V355-F386 HydrophobicContact CB-CD1 4.41Å; V355-F386 HydrophobicContact CB-CE1 4.03Å; V355-F386 HydrophobicContact CB-CZ 4.11Å; V355-F386 HydrophobicContact CG1-CD1 3.56Å; V355-F386 HydrophobicContact CG1-CD2 4.33Å; V355-F386 HydrophobicContact CG1-CE1 3.67Å; V355-F386 HydrophobicContact CG1-CE2 4.42Å; V355-F386 HydrophobicContact CG1-CG 3.92Å; V355-F386 HydrophobicContact CG1-CZ 4.11Å; V355-F386 HydrophobicContact CG2-CE2 4.49Å; V355-F386 HydrophobicContact CG2-CZ 4.48Å; E356-F386 HydrophobicContact CG-CE1 4.01Å; E356-F386 WeakPolarHBondContact OE1-CE1 3.43Å; S363-F386 VanDerWaalsContact CB-O 3.29Å; S363-F386 WeakPolarHBondContact CB-O 3.11Å; R366-F386 PolarHBondContact NH2-O 2.89Å; T368-F386 HydrophobicContact CG2-CB 4.48Å; T368-F386 PolarHBondContact OG1-O 2.81Å; L382-F386 HydrophobicContact CD1-CD2 4.15Å; L382-F386 HydrophobicContact CD1-CE2 3.41Å; L382-F386 VanDerWaalsContact CD1-CE2 3.41Å; L382-F386 HydrophobicContact CD1-CZ 3.72Å; L382-F386 HydrophobicContact CD2-CD2 4.49Å; L382-F386 HydrophobicContact CD2-CE2 4.16Å; L382-F386 HydrophobicContact CG-CD2 3.84Å; L382-F386 HydrophobicContact CG-CE2 3.57Å; L382-F386 HydrophobicContact CG-CZ 4.33Å; L382-F386 PolarHBondContact O-N 3.03Å; L382-F386 VanDerWaalsContact O-N 3.08Å
387	L	95	Very high	91.1	Very high	11 Å²	11	42 Å²	42	6%	0.058	21%	0.205	C	C	.	.			trans	-104.5	131.9	-173.9	-50.9	179.8	0	0	0	112.4	D212 M214 T368 M370 A383 Y390	D212-L387 HydrophobicContact CB-CB 4.33Å; D212-L387 HydrophobicContact CB-CD2 4.49Å; D212-L387 WeakPolarHBondContact OD2-CA 3.46Å; M214-L387 HydrophobicContact CB-CD1 3.74Å; T368-L387 HydrophobicContact CG2-CD2 3.5Å; T368-L387 WeakPolarHBondContact O-CD2 3.39Å; M370-L387 HydrophobicContact CG-CD2 4.01Å; M370-L387 HydrophobicContact SD-CD1 4.1Å; M370-L387 HydrophobicContact SD-CD2 3.95Å; M370-L387 HydrophobicContact SD-CG 3.93Å; A383-L387 HydrophobicContact CB-CD1 3.92Å; A383-L387 HydrophobicContact CB-CG 4.47Å; A383-L387 WeakPolarHBondContact O-CB 3.46Å; A383-L387 WeakPolarHBondContact O-CG 3.37Å; A383-L387 PolarHBondContact O-N 3.23Å; A383-L387 VanDerWaalsContact O-N 3.13Å; L387-Y390 HydrophobicContact CB-CD1 3.66Å; L387-Y390 HydrophobicContact CB-CE1 4.48Å; L387-Y390 HydrophobicContact CB-CG 3.91Å; L387-Y390 HydrophobicContact CD1-CD1 4.08Å; L387-Y390 HydrophobicContact CD1-CD2 3.97Å; L387-Y390 HydrophobicContact CD1-CE2 4.49Å; L387-Y390 HydrophobicContact CD1-CG 3.77Å
388	N	93.9	Very high	90.2	Very high	78 Å²	78	38.7 Å²	38.7	42%	0.417	19%	0.188	S	C	.	.	S	Bend	trans	-100.1	125.9	174.6	-172.6	-1.9	0	0	0	111.4	D212 S363 G364 Y390	D212-N388 WeakPolarHBondContact CB-O 3.31Å; D212-N388 PolarHBondContact OD2-N 3.36Å; S363-N388 PolarHBondContact O-ND2 2.79Å; S363-N388 VanDerWaalsContact O-ND2 3.13Å; G364-N388 WeakPolarHBondContact CA-ND2 3.4Å; N388-Y390 PolarHBondContact O-N 2.93Å
389	N	91.6	Very high	89.1	Confident	84 Å²	84	35.1 Å²	35.1	45%	0.449	18%	0.18	S	C	.	.	S	Bend	trans	54.1	32.5	169	-160.4	40.2	0	0	0	114.3	P163 R211	P163-N389 WeakPolarHBondContact CG-OD1 3.49Å; R211-N389 PolarHBondContact NE-O 3.04Å; R211-N389 PolarHBondContact NH2-O 3.45Å
390	Y	93.9	Very high	88	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.016	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-73.6	161.8	-162.8	68.6	-86.7	0	0	0	115.8	D212 M214 L387 N388 F392 Y589 R590	D212-Y390 CarbonylContact O-C 3.52Å; D212-Y390 VanDerWaalsContact O-CA 3.27Å; D212-Y390 WeakPolarHBondContact O-CA 3.22Å; D212-Y390 WeakPolarHBondContact O-CB 3.41Å; M214-Y390 HydrophobicContact CB-CD2 3.77Å; M214-Y390 HydrophobicContact CB-CE2 3.86Å; L387-Y390 HydrophobicContact CB-CD1 3.66Å; L387-Y390 HydrophobicContact CB-CE1 4.48Å; L387-Y390 HydrophobicContact CB-CG 3.91Å; L387-Y390 HydrophobicContact CD1-CD1 4.08Å; L387-Y390 HydrophobicContact CD1-CD2 3.97Å; L387-Y390 HydrophobicContact CD1-CE2 4.49Å; L387-Y390 HydrophobicContact CD1-CG 3.77Å; N388-Y390 PolarHBondContact O-N 2.93Å; Y390-F392 HydrophobicContact CE2-CB 4.03Å; Y390-Y589 VanDerWaalsContact OH-CE1 3.26Å; Y390-Y589 WeakPolarHBondContact OH-CE1 3.46Å; Y390-R590 PolarHBondContact O-NH1 3.02Å; Y390-R590 PolarHBondContact O-NH2 3.45Å; Y390-R590 VanDerWaalsContact O-NH2 3.07Å
391	I	94.5	Very high	86.9	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	131.2	165.7	-50.9	-51.1	0	0	0	109.5	A160 F165 I206 D212 L213 M214	A160-I391 HydrophobicContact CB-CG2 4.37Å; F165-I391 HydrophobicContact CB-CD1 3.83Å; F165-I391 HydrophobicContact CD2-CD1 3.88Å; F165-I391 HydrophobicContact CD2-CG1 4.04Å; F165-I391 HydrophobicContact CD2-CG2 4.02Å; F165-I391 HydrophobicContact CE2-CG2 4.22Å; F165-I391 HydrophobicContact CG-CD1 4.15Å; F165-I391 HydrophobicContact CG-CG2 4.36Å; I206-I391 HydrophobicContact CD1-CB 4.23Å; I206-I391 HydrophobicContact CD1-CG2 3.81Å; I206-I391 HydrophobicContact CG2-CB 4.13Å; I206-I391 HydrophobicContact CG2-CG1 3.87Å; D212-I391 PolarHBondContact O-N 2.96Å; L213-I391 WeakPolarHBondContact CA-O 3.39Å; L213-I391 HydrophobicContact CD1-CB 4.34Å; M214-I391 PolarHBondContact N-O 3.49Å
392	F	94	Very high	85.9	Confident	6 Å²	6	32 Å²	32	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.1	171.1	-177.1	-120.6	0	0	0	109.4	A160 T161 M214 F375 Y390 T394 D588	A160-F392 CarbonylContact C-O 3.45Å; A160-F392 WeakPolarHBondContact CA-O 3.5Å; T161-F392 PolarHBondContact N-O 2.91Å; T161-F392 PolarHBondContact O-N 3.42Å; M214-F392 HydrophobicContact CB-CD2 4.01Å; M214-F392 HydrophobicContact CG-CD2 3.71Å; M214-F392 HydrophobicContact CG-CE2 3.98Å; M214-F392 WeakPolarHBondContact O-CA 3.17Å; F375-F392 AromaticContact CD1-CE2 3.68Å; F375-F392 HydrophobicContact CD1-CE2 3.68Å; F375-F392 AromaticContact CD1-CZ 3.53Å; F375-F392 HydrophobicContact CD1-CZ 3.53Å; F375-F392 HydrophobicContact CD2-CE2 4.17Å; F375-F392 HydrophobicContact CE1-CD2 4.13Å; F375-F392 HydrophobicContact CE1-CE1 4.33Å; F375-F392 AromaticContact CE1-CE2 3.31Å; F375-F392 HydrophobicContact CE1-CE2 3.31Å; F375-F392 AromaticContact CE1-CZ 3.43Å; F375-F392 HydrophobicContact CE1-CZ 3.43Å; F375-F392 VanDerWaalsContact CE1-CZ 3.43Å; F375-F392 AromaticContact CE2-CE2 3.87Å; F375-F392 HydrophobicContact CE2-CE2 3.87Å; F375-F392 HydrophobicContact CG-CE2 4.09Å; F375-F392 HydrophobicContact CG-CZ 4.21Å; F375-F392 AromaticContact CZ-CD2 3.97Å; F375-F392 HydrophobicContact CZ-CD2 3.97Å; F375-F392 AromaticContact CZ-CE2 3.42Å; F375-F392 HydrophobicContact CZ-CE2 3.42Å; F375-F392 VanDerWaalsContact CZ-CE2 3.42Å; F375-F392 HydrophobicContact CZ-CZ 4.06Å; Y390-F392 HydrophobicContact CE2-CB 4.03Å; F392-T394 HydrophobicContact CD1-CG2 4.16Å; F392-T394 HydrophobicContact CE1-CG2 3.38Å; F392-T394 HydrophobicContact CE2-CG2 4.3Å; F392-T394 HydrophobicContact CZ-CG2 3.47Å; F392-T394 VanDerWaalsContact CZ-CG2 3.47Å; F392-D588 HydrophobicContact CD1-CB 3.86Å; F392-D588 HydrophobicContact CE1-CB 4.38Å; F392-D588 HydrophobicContact CG-CB 4.33Å
393	L	93	Very high	85.2	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	121	-177.4	177.8	68.5	0	0	0	109.7	V158 A160 V199 H202 A203 L213 M214 A215 C216 V395	V158-L393 HydrophobicContact CG1-CD1 3.48Å; V158-L393 VanDerWaalsContact CG1-CD1 3.48Å; A160-L393 HydrophobicContact CB-CD1 3.84Å; V199-L393 HydrophobicContact CG2-CD2 4.12Å; H202-L393 HydrophobicContact CB-CD1 3.61Å; H202-L393 HydrophobicContact CB-CD2 4.1Å; A203-L393 HydrophobicContact CB-CD2 4.03Å; L213-L393 HydrophobicContact CD1-CB 3.8Å; L213-L393 HydrophobicContact CD1-CD2 4.3Å; M214-L393 PolarHBondContact O-N 3.47Å; A215-L393 CarbonylContact C-O 3.56Å; A215-L393 WeakPolarHBondContact CA-O 3.3Å; A215-L393 HydrophobicContact CB-CB 4.37Å; A215-L393 HydrophobicContact CB-CD2 4.26Å; C216-L393 PolarHBondContact N-O 3.42Å; L393-V395 HydrophobicContact CD2-CG2 4.48Å; L393-V395 HydrophobicContact CG-CG2 4.24Å
394	T	91.3	Very high	84.6	Confident	14 Å²	14	39 Å²	39	9%	0.086	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.6	171.4	59.4	0	0	0	0	109.9	V158 N159 C216 F392 V398	V158-T394 WeakPolarHBondContact CA-O 3.38Å; N159-T394 PolarHBondContact N-O 3.08Å; N159-T394 PolarHBondContact O-N 2.64Å; N159-T394 PolarHBondContact O-OG1 3.48Å; C216-T394 HydrophobicContact CB-CG2 4.41Å; F392-T394 HydrophobicContact CD1-CG2 4.16Å; F392-T394 HydrophobicContact CE1-CG2 3.38Å; F392-T394 HydrophobicContact CE2-CG2 4.3Å; F392-T394 HydrophobicContact CZ-CG2 3.47Å; F392-T394 VanDerWaalsContact CZ-CG2 3.47Å; T394-V398 HydrophobicContact CG2-CG2 3.69Å
395	V	86	Confident	84.3	Confident	12 Å²	12	33.1 Å²	33.1	7%	0.073	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.4	177.3	177.4	0	0	0	0	109.2	I156 V158 P198 V199 C216 A217 L393	I156-V395 HydrophobicContact CG2-CG1 3.99Å; V158-V395 HydrophobicContact CG1-CG2 4.06Å; V158-V395 HydrophobicContact CG2-CG1 4.24Å; V158-V395 HydrophobicContact CG2-CG2 4.16Å; P198-V395 HydrophobicContact CB-CG1 4.02Å; V199-V395 HydrophobicContact CB-CG2 3.92Å; V199-V395 HydrophobicContact CG2-CG2 4.05Å; C216-V395 PolarHBondContact O-N 3.33Å; A217-V395 HydrophobicContact CB-CB 3.86Å; A217-V395 HydrophobicContact CB-CG2 4.24Å; L393-V395 HydrophobicContact CD2-CG2 4.48Å; L393-V395 HydrophobicContact CG-CG2 4.24Å
396	G	80.1	Confident	84.2	Confident	15 Å²	15	33.4 Å²	33.4	16%	0.155	18%	0.18	C	C	.	.	S	Bend	trans	69.8	-162.9	-164.6	0	0	0	0	0	111.2	I156 P157	I156-G396 VanDerWaalsContact CG2-N 3.33Å; P157-G396 WeakPolarHBondContact O-CA 3.48Å; P157-G396 PolarHBondContact O-N 2.89Å
397	R	73.5	Confident	84.2	Confident	151 Å²	151	33.5 Å²	33.5	57%	0.57	18%	0.181	S	C	*	.	S	Bend	trans	-86.2	135.1	169.2	-179.5	169.9	165.8	-152.1	-15.1	109.7	S400 E552	R397-S400 VanDerWaalsContact CB-OG 3.29Å; R397-S400 WeakPolarHBondContact CB-OG 3.49Å; R397-S400 WeakPolarHBondContact CG-OG 3.24Å; R397-S400 WeakPolarHBondContact O-CB 3.27Å; R397-S400 PolarHBondContact O-N 3.27Å; R397-S400 PolarHBondContact O-OG 3.22Å; R397-E552 VanDerWaalsContact CD-OE1 3.31Å; R397-E552 WeakPolarHBondContact CD-OE1 3.42Å; R397-E552 VanDerWaalsContact CZ-CD 3.5Å; R397-E552 IonicContact CZ-OE1 2.71Å; R397-E552 IonicContact CZ-OE2 3.16Å; R397-E552 IonicContact NE-OE1 3.38Å; R397-E552 IonicContact NE-OE2 3.68Å; R397-E552 IonicContact NH1-OE1 3.34Å; R397-E552 PolarHBondContact NH1-OE1 3.39Å; R397-E552 IonicContact NH1-OE2 3.62Å; R397-E552 PolarHBondContact NH1-OE2 3.45Å; R397-E552 IonicContact NH2-OE2 3.54Å; R397-E552 PolarHBondContact NH2-OE2 2.8Å
398	V	70.6	Confident	84.1	Confident	22 Å²	22	35.8 Å²	35.8	13%	0.133	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	134.1	-177.2	-178.1	0	0	0	0	109.9	C216 F375 T394 S400 A586	C216-V398 HydrophobicContact CB-CG1 4.18Å; C216-V398 HydrophobicContact CB-CG2 3.83Å; F375-V398 HydrophobicContact CB-CG1 3.84Å; T394-V398 HydrophobicContact CG2-CG2 3.69Å; V398-S400 VanDerWaalsContact C-N 3.26Å; V398-S400 PolarHBondContact O-N 3.45Å; V398-A586 HydrophobicContact CG2-CB 4.43Å
399	G	66.2	Low	84.2	Confident	29 Å²	29	32.3 Å²	32.3	30%	0.299	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	-5.8	-176.8	0	0	0	0	0	116.2	A373	A373-G399 PolarHBondContact O-N 2.88Å
400	S	68.5	Low	84.4	Confident	16 Å²	16	31 Å²	31	11%	0.112	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-76.6	161.8	-177.9	-51.7	0	0	0	0	113.3	Q218 R397 V398 E552	Q218-S400 PolarHBondContact NE2-O 3.1Å; R397-S400 VanDerWaalsContact CB-OG 3.29Å; R397-S400 WeakPolarHBondContact CB-OG 3.49Å; R397-S400 WeakPolarHBondContact CG-OG 3.24Å; R397-S400 WeakPolarHBondContact O-CB 3.27Å; R397-S400 PolarHBondContact O-N 3.27Å; R397-S400 PolarHBondContact O-OG 3.22Å; V398-S400 VanDerWaalsContact C-N 3.26Å; V398-S400 PolarHBondContact O-N 3.45Å; S400-E552 VanDerWaalsContact CB-OE1 3.26Å; S400-E552 WeakPolarHBondContact CB-OE1 3.22Å; S400-E552 PolarHBondContact OG-OE1 3.5Å
401	T	71.2	Confident	84.5	Confident	16 Å²	16	35.4 Å²	35.4	10%	0.098	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-87	169.5	174.5	59.6	0	0	0	0	111.9	Q218 Q407 V516 I519 L549	Q218-T401 PolarHBondContact NE2-O 2.73Å; T401-Q407 PolarHBondContact OG1-NE2 3.19Å; T401-V516 HydrophobicContact CG2-CB 4.31Å; T401-V516 HydrophobicContact CG2-CG1 4.09Å; T401-V516 HydrophobicContact CG2-CG2 3.82Å; T401-I519 HydrophobicContact CG2-CD1 3.69Å; T401-I519 HydrophobicContact CG2-CG1 4.32Å; T401-L549 HydrophobicContact CG2-CD1 3.79Å; T401-L549 HydrophobicContact CG2-CD2 3.86Å; T401-L549 HydrophobicContact CG2-CG 3.92Å
402	S	71.8	Confident	84.6	Confident	21 Å²	21	35.6 Å²	35.6	15%	0.147	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-89.5	132.1	174.7	-168.7	0	0	0	0	110.8	N404 I405	S402-N404 PolarHBondContact O-N 3.12Å; S402-N404 VanDerWaalsContact O-N 3.12Å; S402-I405 WeakPolarHBondContact O-CB 3.5Å; S402-I405 PolarHBondContact O-N 3.42Å
403	E	77.7	Confident	84.6	Confident	139 Å²	139	40 Å²	40	65%	0.65	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.8	177.4	-61.3	177.4	173.1	0	0	113.1	I405	E403-I405 PolarHBondContact O-N 3.47Å
404	N	81.4	Confident	84.6	Confident	9 Å²	9	42.7 Å²	42.7	5%	0.048	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-4.4	173.6	-68.7	-67.9	0	0	0	114.1	N149 S402 L528 G529	N149-N404 WeakPolarHBondContact CB-OD1 3.47Å; N149-N404 PolarHBondContact ND2-OD1 2.74Å; S402-N404 PolarHBondContact O-N 3.12Å; S402-N404 VanDerWaalsContact O-N 3.12Å; N404-L528 WeakPolarHBondContact O-CA 3.38Å; N404-G529 PolarHBondContact O-N 2.91Å
405	I	87.3	Confident	84.7	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.2	-178.7	-54.1	171	0	0	0	109.4	S402 E403 Q407 I519 T522 G529 A531 Q555	S402-I405 WeakPolarHBondContact O-CB 3.5Å; S402-I405 PolarHBondContact O-N 3.42Å; E403-I405 PolarHBondContact O-N 3.47Å; I405-Q407 HydrophobicContact CG2-CG 4Å; I405-Q407 PolarHBondContact O-N 2.86Å; I405-I519 HydrophobicContact CD1-CD1 4.46Å; I405-I519 HydrophobicContact CD1-CG1 4.19Å; I405-I519 HydrophobicContact CG2-CB 4.46Å; I405-I519 HydrophobicContact CG2-CD1 4.29Å; I405-T522 HydrophobicContact CG1-CG2 4.35Å; I405-T522 HydrophobicContact CG2-CG2 4.1Å; I405-G529 CarbonylContact C-O 3.3Å; I405-G529 WeakPolarHBondContact CA-O 3.41Å; I405-A531 HydrophobicContact CG2-CB 3.54Å; I405-Q555 PolarHBondContact O-OE1 2.96Å
406	T	92.3	Very high	85.1	Confident	68 Å²	68	50.5 Å²	50.5	42%	0.417	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.3	169.5	-51.8	0	0	0	0	109.6	G529 A531	T406-G529 PolarHBondContact N-O 3.17Å; T406-A531 PolarHBondContact O-N 3.25Å
407	Q	93.9	Very high	85.8	Confident	3 Å²	3	50 Å²	50	1%	0.014	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.1	-172.7	-63.2	177.1	62.2	0	0	111.4	T401 I405 Y515 I519 A531 L549 L550 Q555	T401-Q407 PolarHBondContact OG1-NE2 3.19Å; I405-Q407 HydrophobicContact CG2-CG 4Å; I405-Q407 PolarHBondContact O-N 2.86Å; Q407-Y515 PolarHBondContact OE1-OH 3.27Å; Q407-I519 HydrophobicContact CG-CD1 3.95Å; Q407-I519 VanDerWaalsContact OE1-CD1 3.28Å; Q407-A531 WeakPolarHBondContact CA-O 3.44Å; Q407-A531 HydrophobicContact CG-CB 4.24Å; Q407-L549 VanDerWaalsContact OE1-CD2 3.24Å; Q407-L550 HydrophobicContact CB-CD2 3.59Å; Q407-L550 HydrophobicContact CG-CD2 4.38Å; Q407-Q555 HydrophobicContact CB-CB 4.49Å; Q407-Q555 HydrophobicContact CB-CG 4.08Å; Q407-Q555 HydrophobicContact CG-CG 4.35Å
408	T	94.3	Very high	86.8	Confident	59 Å²	59	47.9 Å²	47.9	36%	0.362	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	111.9	-178.7	-54.8	0	0	0	0	110	L410 A531 T532 S533	T408-L410 HydrophobicContact CG2-CD2 3.82Å; T408-L410 HydrophobicContact CG2-CG 4.15Å; T408-A531 PolarHBondContact N-O 3.4Å; T408-T532 CarbonylContact O-C 3.57Å; T408-T532 VanDerWaalsContact O-CA 3.32Å; T408-T532 WeakPolarHBondContact O-CA 3.3Å; T408-S533 PolarHBondContact O-N 3.06Å
409	I	95.2	Very high	88	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.8	174	-44.7	-57.2	0	0	0	109.3	F535 L550 P558 W560 L561	I409-F535 HydrophobicContact CG2-CB 3.75Å; I409-F535 HydrophobicContact CG2-CD2 4.38Å; I409-F535 HydrophobicContact CG2-CG 4.35Å; I409-L550 HydrophobicContact CD1-CD1 4.44Å; I409-L550 HydrophobicContact CG1-CD1 3.76Å; I409-P558 HydrophobicContact CB-CG 4.21Å; I409-P558 WeakPolarHBondContact O-CG 3.41Å; I409-W560 HydrophobicContact CG2-CH2 3.76Å; I409-W560 HydrophobicContact CG2-CZ2 4.19Å; I409-L561 HydrophobicContact CG1-CD2 4.48Å
410	L	95.6	Very high	89.3	Confident	57 Å²	57	50.9 Å²	50.9	30%	0.298	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.8	179.6	-59.9	178.8	0	0	0	110	T408 V412 T532 S533 F534 F535	T408-L410 HydrophobicContact CG2-CD2 3.82Å; T408-L410 HydrophobicContact CG2-CG 4.15Å; L410-V412 HydrophobicContact CB-CG2 3.81Å; L410-V412 PolarHBondContact O-N 2.93Å; L410-T532 HydrophobicContact CD1-CG2 3.67Å; L410-T532 HydrophobicContact CG-CG2 4.1Å; L410-S533 PolarHBondContact N-O 3.36Å; L410-F534 HydrophobicContact CD1-CE1 4.38Å; L410-F535 PolarHBondContact O-N 3Å
411	W	95.8	Very high	90.6	Very high	95 Å²	95	50.2 Å²	50.2	36%	0.36	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	117.5	168.2	-172.2	-82.7	0	0	0	109.3	E413 F535 D537 W560 I564	W411-E413 PolarHBondContact NE1-OE1 3.13Å; W411-F535 WeakPolarHBondContact CA-O 3.41Å; W411-F535 AromaticContact CE3-CD1 3.81Å; W411-F535 HydrophobicContact CE3-CD1 3.81Å; W411-F535 HydrophobicContact CE3-CE1 4.33Å; W411-F535 AromaticContact CZ3-CD1 3.64Å; W411-F535 HydrophobicContact CZ3-CD1 3.64Å; W411-F535 AromaticContact CZ3-CE1 3.72Å; W411-F535 HydrophobicContact CZ3-CE1 3.72Å; W411-D537 WeakPolarHBondContact CH2-OD1 3.45Å; W411-W560 HydrophobicContact CB-CZ2 4.09Å; W411-W560 HydrophobicContact CE3-CD2 4.17Å; W411-W560 AromaticContact CE3-CE3 3.62Å; W411-W560 HydrophobicContact CE3-CE3 3.62Å; W411-W560 HydrophobicContact CE3-CH2 4.09Å; W411-W560 AromaticContact CE3-CZ3 3.59Å; W411-W560 HydrophobicContact CE3-CZ3 3.59Å; W411-W560 HydrophobicContact CZ3-CE3 4.04Å; W411-W560 HydrophobicContact CZ3-CZ3 4.02Å; W411-I564 HydrophobicContact CH2-CD1 4.44Å; W411-I564 HydrophobicContact CZ3-CD1 3.7Å
412	V	95.9	Very high	91.7	Very high	6 Å²	6	49.9 Å²	49.9	4%	0.036	26%	0.255	C	S	.	.			trans	-143.4	111	-176.4	-167.4	0	0	0	0	111.2	L410 A416 K417 T420 F534 F535	L410-V412 HydrophobicContact CB-CG2 3.81Å; L410-V412 PolarHBondContact O-N 2.93Å; V412-A416 HydrophobicContact CG1-CB 4.07Å; V412-K417 HydrophobicContact CB-CG 4.38Å; V412-K417 HydrophobicContact CG1-CB 4.28Å; V412-K417 HydrophobicContact CG1-CG 3.87Å; V412-T420 HydrophobicContact CG1-CG2 4.45Å; V412-T420 HydrophobicContact CG2-CG2 4.13Å; V412-F534 HydrophobicContact CB-CB 4.11Å; V412-F534 HydrophobicContact CB-CD1 4.25Å; V412-F534 HydrophobicContact CB-CG 4.1Å; V412-F534 HydrophobicContact CG2-CB 4.23Å; V412-F534 HydrophobicContact CG2-CD1 3.58Å; V412-F534 HydrophobicContact CG2-CE1 4.1Å; V412-F534 HydrophobicContact CG2-CG 3.95Å; V412-F535 PolarHBondContact N-O 3.16Å
413	E	95.3	Very high	92.7	Very high	97 Å²	97	51 Å²	51	45%	0.453	26%	0.259	S	S	.	.			trans	-59.8	147.6	173.6	-64.2	-54.3	148.2	0	0	111.9	W411 N415 A416 K417	W411-E413 PolarHBondContact NE1-OE1 3.13Å; E413-N415 PolarHBondContact O-N 2.79Å; E413-N415 VanDerWaalsContact O-N 3.08Å; E413-A416 HydrophobicContact CB-CB 4.46Å; E413-A416 WeakPolarHBondContact O-CA 2.94Å; E413-A416 PolarHBondContact O-N 3.05Å; E413-K417 PolarHBondContact O-N 3.23Å
414	E	92.9	Very high	93.5	Very high	58 Å²	58	46.3 Å²	46.3	27%	0.271	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-38.6	-176.3	-67.8	-64.4	171.4	0	0	113.8	A416 K417 N536 K538	E414-A416 VanDerWaalsContact C-N 3.34Å; E414-K417 IonicContact OE1-NZ 3.58Å; E414-K417 PolarHBondContact OE1-NZ 3.36Å; E414-K417 VanDerWaalsContact OE1-NZ 3.09Å; E414-K417 WeakPolarHBondContact OE2-CD 3.26Å; E414-K417 VanDerWaalsContact OE2-CE 3.31Å; E414-K417 WeakPolarHBondContact OE2-CE 3.3Å; E414-K417 IonicContact OE2-NZ 3.7Å; E414-K417 PolarHBondContact OE2-NZ 3.15Å; E414-N536 VanDerWaalsContact CD-ND2 3.32Å; E414-N536 PolarHBondContact OE1-ND2 3.28Å; E414-K538 WeakPolarHBondContact OE1-CD 3.18Å; E414-K538 VanDerWaalsContact OE1-CE 3.22Å; E414-K538 WeakPolarHBondContact OE1-CE 3.49Å; E414-K538 IonicContact OE1-NZ 3.23Å; E414-K538 PolarHBondContact OE1-NZ 3.05Å; E414-K538 IonicContact OE2-NZ 3.55Å
415	N	92.9	Very high	94	Very high	154 Å²	154	46.4 Å²	46.4	82%	0.824	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-28.8	179.2	-62.5	-20.9	0	0	0	112.6	E413	E413-N415 PolarHBondContact O-N 2.79Å; E413-N415 VanDerWaalsContact O-N 3.08Å
416	A	94.7	Very high	94.1	Very high	37 Å²	37	49.1 Å²	49.1	31%	0.306	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-22.3	-177.5	0	0	0	0	0	113.4	V412 E413 E414 R418 D419 T420	V412-A416 HydrophobicContact CG1-CB 4.07Å; E413-A416 HydrophobicContact CB-CB 4.46Å; E413-A416 WeakPolarHBondContact O-CA 2.94Å; E413-A416 PolarHBondContact O-N 3.05Å; E414-A416 VanDerWaalsContact C-N 3.34Å; A416-R418 PolarHBondContact O-N 3.1Å; A416-D419 PolarHBondContact O-N 3.49Å; A416-T420 PolarHBondContact O-N 3.23Å; A416-T420 PolarHBondContact O-OG1 3.34Å
417	K	95.6	Very high	94	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.013	28%	0.277	C	S	.	.	H	α-helix	trans	-47.6	-36.7	-178.7	-73.8	-176.9	172.4	168.5	0	114.1	V412 E413 E414 L421 Y506 D507 F534	V412-K417 HydrophobicContact CB-CG 4.38Å; V412-K417 HydrophobicContact CG1-CB 4.28Å; V412-K417 HydrophobicContact CG1-CG 3.87Å; E413-K417 PolarHBondContact O-N 3.23Å; E414-K417 IonicContact OE1-NZ 3.58Å; E414-K417 PolarHBondContact OE1-NZ 3.36Å; E414-K417 VanDerWaalsContact OE1-NZ 3.09Å; E414-K417 WeakPolarHBondContact OE2-CD 3.26Å; E414-K417 VanDerWaalsContact OE2-CE 3.31Å; E414-K417 WeakPolarHBondContact OE2-CE 3.3Å; E414-K417 IonicContact OE2-NZ 3.7Å; E414-K417 PolarHBondContact OE2-NZ 3.15Å; K417-L421 VanDerWaalsContact O-CB 3.29Å; K417-L421 WeakPolarHBondContact O-CB 3.47Å; K417-L421 PolarHBondContact O-N 2.88Å; K417-Y506 HydrophobicContact CB-CD2 4.26Å; K417-Y506 HydrophobicContact CB-CE1 4.17Å; K417-Y506 HydrophobicContact CB-CE2 3.6Å; K417-Y506 HydrophobicContact CD-CD1 4.1Å; K417-Y506 HydrophobicContact CD-CE1 3.73Å; K417-Y506 WeakPolarHBondContact CD-O 3.48Å; K417-Y506 WeakPolarHBondContact CE-O 3.49Å; K417-Y506 PolarHBondContact NZ-O 3.39Å; K417-D507 IonicContact NZ-OD1 2.67Å; K417-D507 PolarHBondContact NZ-OD1 3.15Å; K417-F534 HydrophobicContact CB-CD2 3.96Å; K417-F534 HydrophobicContact CB-CE2 4.16Å; K417-F534 HydrophobicContact CD-CD2 4.27Å; K417-F534 HydrophobicContact CG-CB 4.44Å; K417-F534 HydrophobicContact CG-CD2 3.76Å; K417-F534 HydrophobicContact CG-CE2 4.44Å; K417-F534 HydrophobicContact CG-CG 4.44Å; K417-F534 WeakPolarHBondContact O-CE2 3.44Å
418	R	94.4	Very high	93.6	Very high	108 Å²	108	54.9 Å²	54.9	41%	0.408	29%	0.287	S	S	.	.	H	α-helix	trans	-67.8	-47.3	179.3	-72.6	-170.6	-179.5	169.3	1.3	113	A416 L421 I422 Y450 Y506	A416-R418 PolarHBondContact O-N 3.1Å; R418-L421 PolarHBondContact O-N 2.82Å; R418-I422 WeakPolarHBondContact O-CG1 3.32Å; R418-I422 PolarHBondContact O-N 3.06Å; R418-I422 VanDerWaalsContact O-N 3.07Å; R418-Y450 HydrophobicContact CB-CD1 4.43Å; R418-Y450 HydrophobicContact CB-CE1 3.68Å; R418-Y450 HydrophobicContact CG-CD1 4.38Å; R418-Y450 HydrophobicContact CG-CE1 4.1Å; R418-Y506 HydrophobicContact CG-CE2 4.5Å; R418-Y506 WeakPolarHBondContact CG-OH 3.41Å
419	D	94.3	Very high	93.1	Very high	77 Å²	77	58.3 Å²	58.3	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-69.5	-42.8	180	-62.1	-31.1	0	0	0	110.1	A416 L421 I422 D423 Y450	A416-D419 PolarHBondContact O-N 3.49Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 2.87Å; D419-I422 WeakPolarHBondContact O-CB 3.49Å; D419-I422 PolarHBondContact O-N 2.75Å; D419-I422 VanDerWaalsContact O-N 3.1Å; D419-D423 PolarHBondContact O-N 2.77Å; D419-Y450 PolarHBondContact OD1-OH 2.65Å
420	T	95.1	Very high	92.3	Very high	37 Å²	37	63.1 Å²	63.1	23%	0.227	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-34.2	174.3	-49	0	0	0	0	112.5	V412 A416 L424 F534	V412-T420 HydrophobicContact CG1-CG2 4.45Å; V412-T420 HydrophobicContact CG2-CG2 4.13Å; A416-T420 PolarHBondContact O-N 3.23Å; A416-T420 PolarHBondContact O-OG1 3.34Å; T420-L424 WeakPolarHBondContact O-CG 3.5Å; T420-L424 PolarHBondContact O-N 2.74Å; T420-F534 HydrophobicContact CG2-CE1 3.7Å; T420-F534 HydrophobicContact CG2-CZ 3.81Å
421	L	95.5	Very high	91.5	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-42.7	172.9	-176.4	68.6	0	0	0	111.7	K417 R418 D419 D423 L424 L425 V436 L447 L451 I504 Y506 F534	K417-L421 VanDerWaalsContact O-CB 3.29Å; K417-L421 WeakPolarHBondContact O-CB 3.47Å; K417-L421 PolarHBondContact O-N 2.88Å; R418-L421 PolarHBondContact O-N 2.82Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 2.87Å; L421-D423 VanDerWaalsContact C-N 3.32Å; L421-D423 PolarHBondContact O-N 3.35Å; L421-L424 PolarHBondContact O-N 3.16Å; L421-L425 HydrophobicContact CD1-CD1 4.32Å; L421-L425 HydrophobicContact CD1-CG 4.27Å; L421-L425 HydrophobicContact CD2-CD1 4.39Å; L421-L425 HydrophobicContact CG-CD1 3.92Å; L421-L425 HydrophobicContact CG-CG 4.27Å; L421-L425 WeakPolarHBondContact O-CB 3.41Å; L421-L425 VanDerWaalsContact O-CG 3.24Å; L421-L425 WeakPolarHBondContact O-CG 3.35Å; L421-L425 PolarHBondContact O-N 3.07Å; L421-V436 HydrophobicContact CD1-CG1 4.18Å; L421-V436 HydrophobicContact CD1-CG2 4.24Å; L421-V436 HydrophobicContact CD2-CG1 4.23Å; L421-L447 HydrophobicContact CD2-CD1 3.83Å; L421-L447 HydrophobicContact CD2-CD2 3.88Å; L421-L447 HydrophobicContact CD2-CG 4.13Å; L421-L451 HydrophobicContact CD2-CD1 4.01Å; L421-L451 HydrophobicContact CD2-CD2 4.08Å; L421-L451 HydrophobicContact CD2-CG 4.41Å; L421-I504 HydrophobicContact CD1-CD1 3.74Å; L421-I504 HydrophobicContact CD1-CG2 3.94Å; L421-Y506 HydrophobicContact CB-CD2 4.31Å; L421-Y506 HydrophobicContact CB-CE2 4.44Å; L421-Y506 HydrophobicContact CD2-CD2 3.91Å; L421-Y506 HydrophobicContact CD2-CE2 4.23Å; L421-F534 HydrophobicContact CB-CE2 4.24Å; L421-F534 HydrophobicContact CB-CZ 4.32Å
422	I	94.2	Very high	91.1	Very high	10 Å²	10	59.6 Å²	59.6	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-46.4	174.9	-69	165.3	0	0	0	110.1	R418 D419 L424 L425 A426 Y450 Q454 F456	R418-I422 WeakPolarHBondContact O-CG1 3.32Å; R418-I422 PolarHBondContact O-N 3.06Å; R418-I422 VanDerWaalsContact O-N 3.07Å; D419-I422 WeakPolarHBondContact O-CB 3.49Å; D419-I422 PolarHBondContact O-N 2.75Å; D419-I422 VanDerWaalsContact O-N 3.1Å; I422-L424 PolarHBondContact O-N 3.48Å; I422-L425 PolarHBondContact O-N 3.05Å; I422-A426 VanDerWaalsContact O-CB 3.22Å; I422-A426 WeakPolarHBondContact O-CB 3.43Å; I422-A426 PolarHBondContact O-N 3.05Å; I422-Y450 HydrophobicContact CD1-CE1 3.63Å; I422-Y450 VanDerWaalsContact CD1-OH 3.24Å; I422-Y450 WeakPolarHBondContact CD1-OH 3.32Å; I422-Y450 HydrophobicContact CG1-CE1 4.19Å; I422-Q454 HydrophobicContact CD1-CG 3.85Å; I422-Q454 HydrophobicContact CG1-CG 4.42Å; I422-F456 HydrophobicContact CG1-CE2 4.47Å; I422-F456 HydrophobicContact CG2-CE2 4.31Å
423	D	93.2	Very high	90.9	Very high	45 Å²	45	60.2 Å²	60.2	24%	0.241	35%	0.347	C	S	.	.	H	α-helix	trans	-60	-44.9	179	-75.4	-28.4	0	0	0	111.3	D419 L421 A426 H427	D419-D423 PolarHBondContact O-N 2.77Å; L421-D423 VanDerWaalsContact C-N 3.32Å; L421-D423 PolarHBondContact O-N 3.35Å; D423-A426 PolarHBondContact O-N 3.21Å; D423-H427 PolarHBondContact O-N 2.86Å; D423-H427 VanDerWaalsContact O-N 3.13Å; D423-H427 PolarHBondContact O-ND1 3.28Å
424	L	93	Very high	90.8	Very high	40 Å²	40	55.9 Å²	55.9	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-43.8	175.3	-72.4	174.7	0	0	0	112.9	T420 L421 I422 A426 S428 I504 T532 F534	T420-L424 WeakPolarHBondContact O-CG 3.5Å; T420-L424 PolarHBondContact O-N 2.74Å; L421-L424 PolarHBondContact O-N 3.16Å; I422-L424 PolarHBondContact O-N 3.48Å; L424-A426 VanDerWaalsContact C-N 3.33Å; L424-A426 PolarHBondContact O-N 3.08Å; L424-S428 PolarHBondContact O-N 3.2Å; L424-S428 PolarHBondContact O-OG 3.44Å; L424-I504 HydrophobicContact CB-CD1 4.31Å; L424-I504 HydrophobicContact CD1-CD1 4.26Å; L424-T532 HydrophobicContact CD1-CG2 3.79Å; L424-F534 HydrophobicContact CD1-CE1 3.7Å; L424-F534 HydrophobicContact CD1-CZ 3.88Å
425	L	92.9	Very high	90.8	Very high	11 Å²	11	53.1 Å²	53.1	6%	0.058	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-32	179.1	-67.4	175.6	0	0	0	112.3	L421 I422 I434 L451 F456 V484 I504	L421-L425 HydrophobicContact CD1-CD1 4.32Å; L421-L425 HydrophobicContact CD1-CG 4.27Å; L421-L425 HydrophobicContact CD2-CD1 4.39Å; L421-L425 HydrophobicContact CG-CD1 3.92Å; L421-L425 HydrophobicContact CG-CG 4.27Å; L421-L425 WeakPolarHBondContact O-CB 3.41Å; L421-L425 VanDerWaalsContact O-CG 3.24Å; L421-L425 WeakPolarHBondContact O-CG 3.35Å; L421-L425 PolarHBondContact O-N 3.07Å; I422-L425 PolarHBondContact O-N 3.05Å; L425-I434 HydrophobicContact CD2-CB 4.31Å; L425-I434 HydrophobicContact CD2-CD1 3.55Å; L425-I434 HydrophobicContact CD2-CG2 3.91Å; L425-L451 HydrophobicContact CD1-CD1 4.12Å; L425-L451 HydrophobicContact CD1-CD2 3.49Å; L425-L451 VanDerWaalsContact CD1-CD2 3.49Å; L425-L451 HydrophobicContact CD1-CG 4.44Å; L425-F456 HydrophobicContact CB-CD1 4.2Å; L425-F456 HydrophobicContact CB-CE1 3.57Å; L425-F456 HydrophobicContact CB-CE2 4.48Å; L425-F456 HydrophobicContact CB-CZ 3.73Å; L425-F456 HydrophobicContact CD1-CD1 4.48Å; L425-F456 HydrophobicContact CD1-CG 4.5Å; L425-V484 HydrophobicContact CD1-CG2 4.49Å; L425-V484 HydrophobicContact CD2-CG1 4.32Å; L425-V484 HydrophobicContact CD2-CG2 3.87Å; L425-I504 HydrophobicContact CD2-CD1 4.47Å
426	A	89.6	Confident	90.9	Very high	60 Å²	60	45.8 Å²	45.8	50%	0.496	28%	0.275	S	S	.	.	H	α-helix	trans	-76.4	-28.3	179	0	0	0	0	0	113.6	I422 D423 L424	I422-A426 VanDerWaalsContact O-CB 3.22Å; I422-A426 WeakPolarHBondContact O-CB 3.43Å; I422-A426 PolarHBondContact O-N 3.05Å; D423-A426 PolarHBondContact O-N 3.21Å; L424-A426 VanDerWaalsContact C-N 3.33Å; L424-A426 PolarHBondContact O-N 3.08Å
427	H	89.3	Confident	90.9	Very high	159 Å²	159	44.1 Å²	44.1	74%	0.736	26%	0.261	S	S	*	.	S	Bend	trans	-91	-0.5	175.3	-66.1	89.1	0	0	0	113.6	D423	D423-H427 PolarHBondContact O-N 2.86Å; D423-H427 VanDerWaalsContact O-N 3.13Å; D423-H427 PolarHBondContact O-ND1 3.28Å
428	S	86.5	Confident	90.9	Very high	33 Å²	33	44 Å²	44	23%	0.231	26%	0.26	C	S	.	.	S	Bend	trans	-77.9	144.6	177.8	-67.7	0	0	0	0	112.2	L424 I434	L424-S428 PolarHBondContact O-N 3.2Å; L424-S428 PolarHBondContact O-OG 3.44Å; S428-I434 WeakPolarHBondContact OG-CD1 3.4Å
429	E	83.6	Confident	90.8	Very high	130 Å²	130	45.4 Å²	45.4	61%	0.607	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-61.1	140.4	178.3	-48.6	174.5	135.9	0	0	111.2	G431 T432 K501	E429-G431 PolarHBondContact O-N 2.93Å; E429-T432 WeakPolarHBondContact CB-OG1 3.27Å; E429-T432 WeakPolarHBondContact O-CB 3.37Å; E429-T432 PolarHBondContact O-N 2.97Å; E429-T432 PolarHBondContact O-OG1 2.97Å; E429-K501 IonicContact OE2-NZ 2.67Å; E429-K501 PolarHBondContact OE2-NZ 3.42Å
430	A	78.8	Confident	90.7	Very high	108 Å²	108	45.1 Å²	45.1	89%	0.893	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	129.8	178.8	0	0	0	0	0	111.8	T432	A430-T432 VanDerWaalsContact C-N 3.34Å
431	G	78.9	Confident	90.6	Very high	65 Å²	65	48.5 Å²	48.5	67%	0.67	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	1.3	-175.9	0	0	0	0	0	115.3	E429 L433	E429-G431 PolarHBondContact O-N 2.93Å; G431-L433 PolarHBondContact O-N 2.86Å
432	T	86.5	Confident	90.5	Very high	13 Å²	13	58.7 Å²	58.7	8%	0.08	32%	0.319	C	S	.	.			trans	-59.7	128.5	169.4	-64.3	0	0	0	0	110.6	E429 A430 I434 P483 K501 H502	E429-T432 WeakPolarHBondContact CB-OG1 3.27Å; E429-T432 WeakPolarHBondContact O-CB 3.37Å; E429-T432 PolarHBondContact O-N 2.97Å; E429-T432 PolarHBondContact O-OG1 2.97Å; A430-T432 VanDerWaalsContact C-N 3.34Å; T432-I434 HydrophobicContact CG2-CD1 4.09Å; T432-I434 HydrophobicContact CG2-CG1 3.65Å; T432-P483 WeakPolarHBondContact O-CB 3.44Å; T432-K501 HydrophobicContact CG2-CB 3.63Å; T432-K501 HydrophobicContact CG2-CD 3.91Å; T432-K501 HydrophobicContact CG2-CG 4.4Å; T432-H502 HydrophobicContact CG2-CB 4.44Å
433	L	91.3	Very high	90.5	Very high	18 Å²	18	59.2 Å²	59.2	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.8	173.4	-66	-172.3	0	0	0	110.2	G431 F477 P483 N499 K501 H502	G431-L433 PolarHBondContact O-N 2.86Å; L433-F477 HydrophobicContact CB-CE1 3.7Å; L433-F477 HydrophobicContact CB-CE2 4.41Å; L433-F477 HydrophobicContact CB-CZ 3.59Å; L433-F477 HydrophobicContact CD1-CD1 4.29Å; L433-F477 HydrophobicContact CD1-CE1 3.92Å; L433-F477 HydrophobicContact CD2-CD1 4.4Å; L433-F477 HydrophobicContact CD2-CE1 4.19Å; L433-F477 HydrophobicContact CD2-CE2 4.49Å; L433-F477 HydrophobicContact CD2-CZ 4.29Å; L433-F477 WeakPolarHBondContact CD2-O 3.47Å; L433-F477 HydrophobicContact CG-CE1 4.15Å; L433-F477 HydrophobicContact CG-CZ 4.36Å; L433-P483 HydrophobicContact CD2-CB 4.35Å; L433-N499 HydrophobicContact CD1-CB 4.39Å; L433-K501 PolarHBondContact O-N 3.48Å; L433-H502 PolarHBondContact O-N 3.16Å
434	I	93.3	Very high	90.6	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	117.9	-170.1	-51.1	179.1	0	0	0	110.8	L425 S428 T432 V436 F477 P483 V484 L485 H502 I504	L425-I434 HydrophobicContact CD2-CB 4.31Å; L425-I434 HydrophobicContact CD2-CD1 3.55Å; L425-I434 HydrophobicContact CD2-CG2 3.91Å; S428-I434 WeakPolarHBondContact OG-CD1 3.4Å; T432-I434 HydrophobicContact CG2-CD1 4.09Å; T432-I434 HydrophobicContact CG2-CG1 3.65Å; I434-V436 HydrophobicContact CG2-CG2 4.16Å; I434-F477 WeakPolarHBondContact O-CE2 3.23Å; I434-P483 PolarHBondContact N-O 3.46Å; I434-V484 WeakPolarHBondContact O-CA 3.26Å; I434-L485 PolarHBondContact O-N 2.92Å; I434-H502 WeakPolarHBondContact CA-O 3.32Å; I434-H502 HydrophobicContact CG1-CB 4.19Å; I434-H502 HydrophobicContact CG2-CB 4.24Å; I434-I504 HydrophobicContact CG2-CD1 3.69Å; I434-I504 HydrophobicContact CG2-CG1 4.04Å
435	L	93.5	Very high	90.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	111.7	179.5	-178.5	63.6	0	0	0	110.4	F437 L485 A487 I497 V500 H502 V503 I504 R521	L435-F437 HydrophobicContact CD2-CD2 4.43Å; L435-F437 HydrophobicContact CD2-CE2 3.52Å; L435-F437 HydrophobicContact CD2-CZ 3.81Å; L435-F437 HydrophobicContact CG-CD2 4.22Å; L435-F437 HydrophobicContact CG-CE2 3.78Å; L435-F437 HydrophobicContact CG-CZ 4.35Å; L435-L485 HydrophobicContact CD1-CB 4.17Å; L435-L485 HydrophobicContact CD1-CD2 3.99Å; L435-L485 HydrophobicContact CD1-CG 4.03Å; L435-A487 HydrophobicContact CD1-CB 4Å; L435-I497 HydrophobicContact CD1-CD1 4.24Å; L435-I497 HydrophobicContact CD2-CD1 4.21Å; L435-V500 HydrophobicContact CB-CG1 3.95Å; L435-H502 PolarHBondContact N-O 2.92Å; L435-V503 WeakPolarHBondContact O-CA 3.24Å; L435-I504 PolarHBondContact O-N 3.35Å; L435-R521 HydrophobicContact CD2-CB 3.75Å; L435-R521 HydrophobicContact CD2-CG 3.93Å
436	V	95.1	Very high	90.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	111.8	-175.9	-173.4	0	0	0	0	110	L421 I434 L447 V484 L485 V486 A487 I504	L421-V436 HydrophobicContact CD1-CG1 4.18Å; L421-V436 HydrophobicContact CD1-CG2 4.24Å; L421-V436 HydrophobicContact CD2-CG1 4.23Å; I434-V436 HydrophobicContact CG2-CG2 4.16Å; V436-L447 HydrophobicContact CG1-CD2 3.99Å; V436-V484 HydrophobicContact CG2-CG1 3.87Å; V436-L485 PolarHBondContact N-O 3.37Å; V436-V486 HydrophobicContact CB-CG2 4.38Å; V436-V486 CarbonylContact O-C 3.55Å; V436-V486 WeakPolarHBondContact O-CA 3.43Å; V436-A487 PolarHBondContact O-N 2.94Å; V436-I504 CarbonylContact C-O 3.5Å; V436-I504 WeakPolarHBondContact CA-O 3.48Å; V436-I504 HydrophobicContact CG2-CB 4.37Å
437	F	95.2	Very high	91.1	Very high	3 Å²	3	56 Å²	56	1%	0.013	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129.2	178.2	-77	-93.4	0	0	0	112.6	L435 A487 A492 V503 I504 Y506 D507 R518 R521	L435-F437 HydrophobicContact CD2-CD2 4.43Å; L435-F437 HydrophobicContact CD2-CE2 3.52Å; L435-F437 HydrophobicContact CD2-CZ 3.81Å; L435-F437 HydrophobicContact CG-CD2 4.22Å; L435-F437 HydrophobicContact CG-CE2 3.78Å; L435-F437 HydrophobicContact CG-CZ 4.35Å; F437-A487 WeakPolarHBondContact CA-O 3.49Å; F437-A492 HydrophobicContact CD1-CB 4.1Å; F437-A492 HydrophobicContact CE1-CB 3.24Å; F437-A492 HydrophobicContact CZ-CB 3.69Å; F437-V503 HydrophobicContact CD2-CG1 3.76Å; F437-V503 HydrophobicContact CE2-CG1 3.74Å; F437-I504 PolarHBondContact N-O 3.13Å; F437-Y506 WeakPolarHBondContact O-CB 3.48Å; F437-Y506 PolarHBondContact O-N 2.93Å; F437-D507 PolarHBondContact O-N 2.84Å; F437-R518 HydrophobicContact CD1-CB 4.39Å; F437-R518 HydrophobicContact CD1-CG 3.72Å; F437-R518 HydrophobicContact CD2-CB 4.13Å; F437-R518 HydrophobicContact CD2-CG 4.33Å; F437-R518 HydrophobicContact CE1-CB 4.04Å; F437-R518 HydrophobicContact CE1-CG 3.48Å; F437-R518 VanDerWaalsContact CE1-CG 3.48Å; F437-R518 HydrophobicContact CE2-CB 3.77Å; F437-R518 HydrophobicContact CE2-CG 4.14Å; F437-R518 HydrophobicContact CG-CB 4.41Å; F437-R518 HydrophobicContact CG-CG 4.12Å; F437-R518 HydrophobicContact CZ-CB 3.72Å; F437-R518 HydrophobicContact CZ-CG 3.71Å; F437-R521 HydrophobicContact CE2-CG 4.48Å; F437-R521 HydrophobicContact CZ-CG 4.09Å
438	V	95.2	Very high	91.4	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156.7	173.7	-64.8	0	0	0	0	111	A444 L447 V486 A487 T488 Y506 D507	V438-A444 HydrophobicContact CG2-CB 3.72Å; V438-L447 HydrophobicContact CG1-CD2 3.65Å; V438-V486 HydrophobicContact CG1-CG1 4.06Å; V438-V486 HydrophobicContact CG2-CG1 3.92Å; V438-A487 PolarHBondContact N-O 2.89Å; V438-T488 HydrophobicContact CG2-CG2 4.11Å; V438-Y506 HydrophobicContact CG1-CD1 3.89Å; V438-Y506 HydrophobicContact CG1-CG 4.17Å; V438-D507 WeakPolarHBondContact CA-OD2 3.24Å
439	E	92.4	Very high	91.8	Very high	136 Å²	136	50.9 Å²	50.9	64%	0.636	28%	0.283	S	S	*	.	S	Bend	trans	-72.7	-50.7	-178.3	-176.5	-176.8	-162.2	0	0	111.9	D507	E439-D507 HydrophobicContact CB-CB 3.91Å; E439-D507 PolarHBondContact N-OD2 3.27Å
440	T	92.5	Very high	92.3	Very high	71 Å²	71	47.1 Å²	47.1	44%	0.436	26%	0.263	S	S	.	.			trans	-109.2	149.1	-166.7	70.2	0	0	0	0	113.4	R442 G443 A444	T440-R442 PolarHBondContact O-N 3.27Å; T440-G443 WeakPolarHBondContact O-CA 3.41Å; T440-G443 PolarHBondContact O-N 2.71Å; T440-G443 PolarHBondContact OG1-N 2.84Å; T440-G443 VanDerWaalsContact OG1-N 3.08Å; T440-A444 PolarHBondContact O-N 3.12Å
441	R	92.5	Very high	93.1	Very high	108 Å²	108	42 Å²	42	41%	0.408	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-47.6	178.6	-52.5	-174.3	-170.2	-179.3	1.9	111.7	G443 A444 D445 H462 D464 T488	R441-G443 VanDerWaalsContact C-N 3.26Å; R441-G443 PolarHBondContact O-N 2.97Å; R441-A444 WeakPolarHBondContact O-CB 3.33Å; R441-A444 PolarHBondContact O-N 2.8Å; R441-D445 PolarHBondContact O-N 3.14Å; R441-H462 HydrophobicContact CB-CB 4.3Å; R441-H462 HydrophobicContact CG-CB 4.29Å; R441-D464 WeakPolarHBondContact CB-OD2 3.22Å; R441-D464 VanDerWaalsContact CD-OD1 3.24Å; R441-D464 WeakPolarHBondContact CD-OD1 3.41Å; R441-D464 WeakPolarHBondContact CD-OD2 3.27Å; R441-D464 IonicContact CZ-OD1 3.53Å; R441-D464 IonicContact NE-OD1 3.67Å; R441-D464 IonicContact NH1-OD1 2.8Å; R441-D464 PolarHBondContact NH1-OD1 2.83Å; R441-T488 HydrophobicContact CG-CG2 4.4Å
442	R	93.8	Very high	93.8	Very high	215 Å²	215	44 Å²	44	81%	0.811	21%	0.209	S	C	*	.	H	α-helix	trans	-61.1	-31.5	172.4	-65.2	-178.3	179.4	179.3	-0.3	113.3	T440 A446	T440-R442 PolarHBondContact O-N 3.27Å; R442-A446 VanDerWaalsContact O-CB 3.26Å; R442-A446 WeakPolarHBondContact O-CB 3.42Å; R442-A446 PolarHBondContact O-N 2.81Å
443	G	93.6	Very high	94.1	Very high	22 Å²	22	46.7 Å²	46.7	23%	0.227	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-40.4	172.5	0	0	0	0	0	112.1	T440 R441 A446 L447	T440-G443 WeakPolarHBondContact O-CA 3.41Å; T440-G443 PolarHBondContact O-N 2.71Å; T440-G443 PolarHBondContact OG1-N 2.84Å; T440-G443 VanDerWaalsContact OG1-N 3.08Å; R441-G443 VanDerWaalsContact C-N 3.26Å; R441-G443 PolarHBondContact O-N 2.97Å; G443-A446 PolarHBondContact O-N 3.43Å; G443-L447 VanDerWaalsContact O-CB 3.25Å; G443-L447 WeakPolarHBondContact O-CB 3.45Å; G443-L447 PolarHBondContact O-N 2.86Å
444	A	94.8	Very high	94.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-49.9	175.9	0	0	0	0	0	111.7	V438 T440 R441 A446 L447 E448 V486 T488	V438-A444 HydrophobicContact CG2-CB 3.72Å; T440-A444 PolarHBondContact O-N 3.12Å; R441-A444 WeakPolarHBondContact O-CB 3.33Å; R441-A444 PolarHBondContact O-N 2.8Å; A444-A446 PolarHBondContact O-N 3.36Å; A444-L447 PolarHBondContact O-N 3.48Å; A444-E448 WeakPolarHBondContact O-CB 3.47Å; A444-E448 PolarHBondContact O-N 3.02Å; A444-V486 HydrophobicContact CB-CG1 3.93Å; A444-T488 HydrophobicContact CB-CG2 4.29Å
445	D	94.9	Very high	94.1	Very high	44 Å²	44	58.9 Å²	58.9	24%	0.235	28%	0.282	C	S	.	.	H	α-helix	trans	-56.8	-49.1	174.5	-67.7	-57.5	0	0	0	111.4	R441 L447 E448 N449 H462 R465	R441-D445 PolarHBondContact O-N 3.14Å; D445-L447 VanDerWaalsContact C-N 3.32Å; D445-L447 PolarHBondContact O-N 2.75Å; D445-E448 PolarHBondContact O-N 3.2Å; D445-N449 WeakPolarHBondContact O-CB 3.25Å; D445-N449 PolarHBondContact O-N 2.99Å; D445-N449 PolarHBondContact O-ND2 2.67Å; D445-H462 IonicContact OD1-CE1 3.51Å; D445-H462 PolarHBondContact OD1-CE1 3.01Å; D445-H462 IonicContact OD1-NE2 2.67Å; D445-H462 PolarHBondContact OD1-NE2 2.84Å; D445-H462 VanDerWaalsContact OD1-NE2 3.15Å; D445-H462 IonicContact OD2-CE1 2.68Å; D445-H462 PolarHBondContact OD2-CE1 2.79Å; D445-H462 VanDerWaalsContact OD2-CE1 3.23Å; D445-H462 IonicContact OD2-NE2 2.96Å; D445-R465 IonicContact OD1-CZ 2.72Å; D445-R465 IonicContact OD1-NE 3.46Å; D445-R465 IonicContact OD1-NH2 3.43Å; D445-R465 PolarHBondContact OD1-NH2 2.84Å
446	A	95.2	Very high	94	Very high	39 Å²	39	61.1 Å²	61.1	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-36	-178.1	0	0	0	0	0	112.7	R442 G443 A444 Y450	R442-A446 VanDerWaalsContact O-CB 3.26Å; R442-A446 WeakPolarHBondContact O-CB 3.42Å; R442-A446 PolarHBondContact O-N 2.81Å; G443-A446 PolarHBondContact O-N 3.43Å; A444-A446 PolarHBondContact O-N 3.36Å; A446-Y450 WeakPolarHBondContact O-CB 3.4Å; A446-Y450 PolarHBondContact O-N 3.16Å; A446-Y450 VanDerWaalsContact O-N 3.11Å
447	L	95.7	Very high	93.9	Very high	4 Å²	4	66.5 Å²	66.5	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-77.4	-39.2	179.2	-167.3	63	0	0	0	112.1	L421 V436 V438 G443 A444 D445 Y450 L451 V486 Y506	L421-L447 HydrophobicContact CD2-CD1 3.83Å; L421-L447 HydrophobicContact CD2-CD2 3.88Å; L421-L447 HydrophobicContact CD2-CG 4.13Å; V436-L447 HydrophobicContact CG1-CD2 3.99Å; V438-L447 HydrophobicContact CG1-CD2 3.65Å; G443-L447 VanDerWaalsContact O-CB 3.25Å; G443-L447 WeakPolarHBondContact O-CB 3.45Å; G443-L447 PolarHBondContact O-N 2.86Å; A444-L447 PolarHBondContact O-N 3.48Å; D445-L447 VanDerWaalsContact C-N 3.32Å; D445-L447 PolarHBondContact O-N 2.75Å; L447-Y450 HydrophobicContact CD1-CD1 4.47Å; L447-Y450 PolarHBondContact O-N 3.25Å; L447-L451 HydrophobicContact CD1-CG 4.49Å; L447-L451 HydrophobicContact CG-CD1 4.13Å; L447-L451 HydrophobicContact CG-CG 4.43Å; L447-L451 WeakPolarHBondContact O-CB 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3.48Å; L447-V486 HydrophobicContact CB-CG1 4.29Å; L447-V486 HydrophobicContact CD2-CG1 4.04Å; L447-V486 HydrophobicContact CD2-CG2 4.29Å; L447-V486 HydrophobicContact CG-CG2 4.38Å; L447-Y506 HydrophobicContact CD1-CD2 4.44Å; L447-Y506 HydrophobicContact CD1-CE2 3.89Å; L447-Y506 HydrophobicContact CD2-CD1 4.48Å; L447-Y506 HydrophobicContact CD2-CD2 3.95Å; L447-Y506 HydrophobicContact CD2-CE2 4.16Å; L447-Y506 HydrophobicContact CD2-CG 4.11Å
448	E	95.4	Very high	93.8	Very high	17 Å²	17	66.9 Å²	66.9	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-58.1	-49.7	170.5	-177.1	-172.2	-146.5	0	0	110.8	A444 D445 Y450 L451 Y452 V458 S460 R465	A444-E448 WeakPolarHBondContact O-CB 3.47Å; A444-E448 PolarHBondContact O-N 3.02Å; D445-E448 PolarHBondContact O-N 3.2Å; E448-Y450 VanDerWaalsContact C-N 3.3Å; E448-Y450 PolarHBondContact O-N 3.26Å; E448-L451 PolarHBondContact O-N 2.68Å; E448-Y452 VanDerWaalsContact O-CB 3.24Å; E448-Y452 WeakPolarHBondContact O-CB 3.35Å; E448-Y452 PolarHBondContact O-N 3.19Å; E448-V458 HydrophobicContact CG-CG1 4.03Å; E448-V458 HydrophobicContact CG-CG2 4.37Å; E448-S460 PolarHBondContact OE1-N 3.18Å; E448-S460 VanDerWaalsContact OE1-N 3.11Å; E448-S460 PolarHBondContact OE1-OG 2.93Å; E448-S460 PolarHBondContact OE2-OG 3.32Å; E448-R465 IonicContact OE1-NH1 3.36Å; E448-R465 IonicContact OE2-CZ 3.86Å; E448-R465 IonicContact OE2-NH1 3.42Å; E448-R465 PolarHBondContact OE2-NH1 3.35Å; E448-R465 IonicContact OE2-NH2 3.54Å; E448-R465 PolarHBondContact OE2-NH2 2.61Å
449	N	95	Very high	93.7	Very high	68 Å²	68	67 Å²	67	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-54.3	-45.9	175	-83.2	-63.2	0	0	0	112.3	R93 D445 S453	R93-N449 PolarHBondContact NH1-OD1 3.01Å; R93-N449 PolarHBondContact NH2-OD1 2.72Å; D445-N449 WeakPolarHBondContact O-CB 3.25Å; D445-N449 PolarHBondContact O-N 2.99Å; D445-N449 PolarHBondContact O-ND2 2.67Å; N449-S453 PolarHBondContact O-N 2.86Å; N449-S453 VanDerWaalsContact O-N 3.12Å
450	Y	95	Very high	93.8	Very high	51 Å²	51	60.5 Å²	60.5	20%	0.2	29%	0.29	C	S	.	.	H	α-helix	trans	-69.5	-48.6	-178.2	178.5	-104	0	0	0	112.1	R418 D419 I422 A446 L447 E448 Y452 S453 Q454	R418-Y450 HydrophobicContact CB-CD1 4.43Å; R418-Y450 HydrophobicContact CB-CE1 3.68Å; R418-Y450 HydrophobicContact CG-CD1 4.38Å; R418-Y450 HydrophobicContact CG-CE1 4.1Å; D419-Y450 PolarHBondContact OD1-OH 2.65Å; I422-Y450 HydrophobicContact CD1-CE1 3.63Å; I422-Y450 VanDerWaalsContact CD1-OH 3.24Å; I422-Y450 WeakPolarHBondContact CD1-OH 3.32Å; I422-Y450 HydrophobicContact CG1-CE1 4.19Å; A446-Y450 WeakPolarHBondContact O-CB 3.4Å; A446-Y450 PolarHBondContact O-N 3.16Å; A446-Y450 VanDerWaalsContact O-N 3.11Å; L447-Y450 HydrophobicContact CD1-CD1 4.47Å; L447-Y450 PolarHBondContact O-N 3.25Å; E448-Y450 VanDerWaalsContact C-N 3.3Å; E448-Y450 PolarHBondContact O-N 3.26Å; Y450-Y452 VanDerWaalsContact C-N 3.33Å; Y450-Y452 PolarHBondContact O-N 2.84Å; Y450-S453 WeakPolarHBondContact O-CB 3.41Å; Y450-S453 PolarHBondContact O-N 3.25Å; Y450-S453 VanDerWaalsContact O-N 3.09Å; Y450-S453 PolarHBondContact O-OG 2.84Å; Y450-Q454 PolarHBondContact O-N 2.9Å; Y450-Q454 VanDerWaalsContact O-N 3.15Å
451	L	95	Very high	93.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-39.2	178	-71.5	175.7	0	0	0	112.2	L421 L425 L447 E448 S453 Q454 K455 F456 V458 V484 V486	L421-L451 HydrophobicContact CD2-CD1 4.01Å; L421-L451 HydrophobicContact CD2-CD2 4.08Å; L421-L451 HydrophobicContact CD2-CG 4.41Å; L425-L451 HydrophobicContact CD1-CD1 4.12Å; L425-L451 HydrophobicContact CD1-CD2 3.49Å; L425-L451 VanDerWaalsContact CD1-CD2 3.49Å; L425-L451 HydrophobicContact CD1-CG 4.44Å; L447-L451 HydrophobicContact CD1-CG 4.49Å; L447-L451 HydrophobicContact CG-CD1 4.13Å; L447-L451 HydrophobicContact CG-CG 4.43Å; L447-L451 WeakPolarHBondContact O-CB 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3.48Å; E448-L451 PolarHBondContact O-N 2.68Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.19Å; L451-Q454 CarbonylContact O-C 3.55Å; L451-Q454 WeakPolarHBondContact O-CA 3.34Å; L451-Q454 PolarHBondContact O-N 3.34Å; L451-Q454 VanDerWaalsContact O-N 3.1Å; L451-K455 PolarHBondContact O-N 3.04Å; L451-F456 HydrophobicContact CB-CB 4.35Å; L451-F456 HydrophobicContact CD2-CD2 4.08Å; L451-F456 PolarHBondContact O-N 3.45Å; L451-V458 HydrophobicContact CB-CB 4.34Å; L451-V458 HydrophobicContact CB-CG1 4.01Å; L451-V458 HydrophobicContact CB-CG2 4.44Å; L451-V458 HydrophobicContact CD1-CG2 4.15Å; L451-V484 HydrophobicContact CD1-CG1 4.23Å; L451-V486 HydrophobicContact CD1-CG2 4.07Å
452	Y	93.7	Very high	93.5	Very high	107 Å²	107	52.1 Å²	52.1	42%	0.42	25%	0.251	S	S	.	.	H	α-helix	trans	-62.3	-38.2	173.3	-171.4	-93.6	0	0	0	112	E448 Y450 Q454 K455	E448-Y452 VanDerWaalsContact O-CB 3.24Å; E448-Y452 WeakPolarHBondContact O-CB 3.35Å; E448-Y452 PolarHBondContact O-N 3.19Å; Y450-Y452 VanDerWaalsContact C-N 3.33Å; Y450-Y452 PolarHBondContact O-N 2.84Å; Y452-Q454 PolarHBondContact O-N 3.11Å; Y452-K455 WeakPolarHBondContact O-CA 3.46Å; Y452-K455 PolarHBondContact O-N 3.46Å
453	S	94	Very high	93	Very high	71 Å²	71	43.5 Å²	43.5	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-30.3	173.7	82.8	0	0	0	0	113	N449 Y450 L451 K455	N449-S453 PolarHBondContact O-N 2.86Å; N449-S453 VanDerWaalsContact O-N 3.12Å; Y450-S453 WeakPolarHBondContact O-CB 3.41Å; Y450-S453 PolarHBondContact O-N 3.25Å; Y450-S453 VanDerWaalsContact O-N 3.09Å; Y450-S453 PolarHBondContact O-OG 2.84Å; L451-S453 VanDerWaalsContact C-N 3.32Å; L451-S453 PolarHBondContact O-N 3.19Å; S453-K455 PolarHBondContact O-N 3.42Å
454	Q	92.5	Very high	92.7	Very high	89 Å²	89	47 Å²	47	42%	0.416	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	12.1	173.3	-56.6	-52.3	-60.3	0	0	113.1	I422 Y450 L451 Y452 F456	I422-Q454 HydrophobicContact CD1-CG 3.85Å; I422-Q454 HydrophobicContact CG1-CG 4.42Å; Y450-Q454 PolarHBondContact O-N 2.9Å; Y450-Q454 VanDerWaalsContact O-N 3.15Å; L451-Q454 CarbonylContact O-C 3.55Å; L451-Q454 WeakPolarHBondContact O-CA 3.34Å; L451-Q454 PolarHBondContact O-N 3.34Å; L451-Q454 VanDerWaalsContact O-N 3.1Å; Y452-Q454 PolarHBondContact O-N 3.11Å; Q454-F456 VanDerWaalsContact C-N 3.31Å; Q454-F456 HydrophobicContact CB-CD2 3.89Å; Q454-F456 HydrophobicContact CB-CE2 4.02Å; Q454-F456 PolarHBondContact O-N 3.48Å
455	K	90.7	Very high	92.3	Very high	191 Å²	191	49.1 Å²	49.1	83%	0.83	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	15.4	178	-49.5	177.7	-179.2	178.5	0	115.7	L451 Y452 S453	L451-K455 PolarHBondContact O-N 3.04Å; Y452-K455 WeakPolarHBondContact O-CA 3.46Å; Y452-K455 PolarHBondContact O-N 3.46Å; S453-K455 PolarHBondContact O-N 3.42Å
456	F	91.6	Very high	91.9	Very high	47 Å²	47	50.8 Å²	50.8	21%	0.206	26%	0.262	C	S	.	.			trans	-74.3	137.3	169.9	-67.9	-80.4	0	0	0	110.9	I422 L425 L451 Q454 V458	I422-F456 HydrophobicContact CG1-CE2 4.47Å; I422-F456 HydrophobicContact CG2-CE2 4.31Å; L425-F456 HydrophobicContact CB-CD1 4.2Å; L425-F456 HydrophobicContact CB-CE1 3.57Å; L425-F456 HydrophobicContact CB-CE2 4.48Å; L425-F456 HydrophobicContact CB-CZ 3.73Å; L425-F456 HydrophobicContact CD1-CD1 4.48Å; L425-F456 HydrophobicContact CD1-CG 4.5Å; L451-F456 HydrophobicContact CB-CB 4.35Å; L451-F456 HydrophobicContact CD2-CD2 4.08Å; L451-F456 PolarHBondContact O-N 3.45Å; Q454-F456 VanDerWaalsContact C-N 3.31Å; Q454-F456 HydrophobicContact CB-CD2 3.89Å; Q454-F456 HydrophobicContact CB-CE2 4.02Å; Q454-F456 PolarHBondContact O-N 3.48Å; F456-V458 PolarHBondContact O-N 2.95Å; F456-V458 VanDerWaalsContact O-N 3.16Å
457	Q	92.8	Very high	91.2	Very high	113 Å²	113	50.3 Å²	50.3	53%	0.528	25%	0.253	S	S	.	.			trans	-79.2	96.7	172.3	-73.5	179.6	102.3	0	0	109.2	R481 T482 P483 V484	Q457-R481 PolarHBondContact OE1-O 2.88Å; Q457-T482 CarbonylContact O-C 3.48Å; Q457-T482 WeakPolarHBondContact O-CA 3.45Å; Q457-P483 WeakPolarHBondContact O-CD 3.26Å; Q457-V484 PolarHBondContact O-N 2.92Å
458	V	93.7	Very high	90.7	Very high	10 Å²	10	57.8 Å²	57.8	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	148	-171.5	62.5	0	0	0	0	111.2	E448 L451 F456 V484 V486	E448-V458 HydrophobicContact CG-CG1 4.03Å; E448-V458 HydrophobicContact CG-CG2 4.37Å; L451-V458 HydrophobicContact CB-CB 4.34Å; L451-V458 HydrophobicContact CB-CG1 4.01Å; L451-V458 HydrophobicContact CB-CG2 4.44Å; L451-V458 HydrophobicContact CD1-CG2 4.15Å; F456-V458 PolarHBondContact O-N 2.95Å; F456-V458 VanDerWaalsContact O-N 3.16Å; V458-V484 WeakPolarHBondContact CA-O 3.3Å; V458-V484 HydrophobicContact CB-CB 4.25Å; V458-V484 HydrophobicContact CG2-CB 4.14Å; V458-V484 HydrophobicContact CG2-CG1 4.06Å; V458-V486 HydrophobicContact CG2-CG2 3.81Å
459	A	93.2	Very high	90.4	Very high	3 Å²	3	59 Å²	59	3%	0.025	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	165.8	163.1	0	0	0	0	0	109.9	A473 T482 V484 L485 V486	A459-A473 HydrophobicContact CB-CB 4.03Å; A459-T482 HydrophobicContact CB-CG2 4.23Å; A459-V484 PolarHBondContact N-O 3.04Å; A459-L485 HydrophobicContact CB-CD1 4.31Å; A459-L485 WeakPolarHBondContact O-CA 3.36Å; A459-V486 PolarHBondContact O-N 2.79Å
460	S	93.5	Very high	90	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.007	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	153.7	173.3	62	0	0	0	0	113.6	E448 R465 V486	E448-S460 PolarHBondContact OE1-N 3.18Å; E448-S460 VanDerWaalsContact OE1-N 3.11Å; E448-S460 PolarHBondContact OE1-OG 2.93Å; E448-S460 PolarHBondContact OE2-OG 3.32Å; S460-R465 PolarHBondContact OG-NH1 2.68Å; S460-R465 PolarHBondContact OG-NH2 3.24Å; S460-R465 VanDerWaalsContact OG-NH2 3.08Å; S460-V486 CarbonylContact C-O 3.56Å; S460-V486 WeakPolarHBondContact CA-O 3.4Å
461	I	90.2	Very high	89.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	117.5	176.1	-159.5	-172.7	0	0	0	111	R470 L474 L485 V486 A487 T488 A491 L495	I461-R470 HydrophobicContact CD1-CB 4.17Å; I461-R470 HydrophobicContact CD1-CG 4.35Å; I461-R470 HydrophobicContact CG1-CB 4.08Å; I461-R470 HydrophobicContact CG1-CG 3.82Å; I461-L474 HydrophobicContact CD1-CD1 3.96Å; I461-L474 HydrophobicContact CD1-CD2 4.09Å; I461-L474 HydrophobicContact CD1-CG 3.97Å; I461-L485 HydrophobicContact CB-CD1 4.1Å; I461-L485 HydrophobicContact CG2-CD1 3.93Å; I461-L485 HydrophobicContact CG2-CD2 4.18Å; I461-L485 HydrophobicContact CG2-CG 4.12Å; I461-V486 PolarHBondContact N-O 3.45Å; I461-A487 HydrophobicContact CG2-CB 3.48Å; I461-A487 VanDerWaalsContact CG2-CB 3.48Å; I461-A487 WeakPolarHBondContact O-CA 3.44Å; I461-T488 PolarHBondContact O-N 2.93Å; I461-T488 VanDerWaalsContact O-N 3.17Å; I461-A491 HydrophobicContact CB-CB 4.44Å; I461-A491 HydrophobicContact CD1-CB 4.37Å; I461-A491 HydrophobicContact CG1-CB 4.04Å; I461-A491 HydrophobicContact CG2-CB 4.14Å; I461-A491 WeakPolarHBondContact O-CB 3.49Å; I461-L495 HydrophobicContact CD1-CD1 4.35Å; I461-L495 HydrophobicContact CD1-CD2 4.47Å
462	H	89.9	Confident	89	Confident	3 Å²	3	62.4 Å²	62.4	1%	0.014	31%	0.311	C	S	.	.			trans	-155.8	166	-179.9	54.9	113	0	0	0	110.6	R441 D445 D464 R465 T488	R441-H462 HydrophobicContact CB-CB 4.3Å; R441-H462 HydrophobicContact CG-CB 4.29Å; D445-H462 IonicContact OD1-CE1 3.51Å; D445-H462 PolarHBondContact OD1-CE1 3.01Å; D445-H462 IonicContact OD1-NE2 2.67Å; D445-H462 PolarHBondContact OD1-NE2 2.84Å; D445-H462 VanDerWaalsContact OD1-NE2 3.15Å; D445-H462 IonicContact OD2-CE1 2.68Å; D445-H462 PolarHBondContact OD2-CE1 2.79Å; D445-H462 VanDerWaalsContact OD2-CE1 3.23Å; D445-H462 IonicContact OD2-NE2 2.96Å; H462-D464 IonicContact ND1-OD2 3.78Å; H462-D464 PolarHBondContact O-N 2.81Å; H462-R465 WeakPolarHBondContact NE2-CG 3.39Å; H462-R465 PolarHBondContact NE2-NE 3.22Å; H462-R465 PolarHBondContact O-N 2.99Å; H462-R465 VanDerWaalsContact O-N 3.13Å; H462-T488 WeakPolarHBondContact CA-OG1 3.44Å; H462-T488 HydrophobicContact CB-CG2 3.94Å; H462-T488 WeakPolarHBondContact CB-OG1 3.49Å
463	G	83.4	Confident	88.8	Confident	34 Å²	34	57.3 Å²	57.3	35%	0.351	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-1.3	-174.7	0	0	0	0	0	117
464	D	86.3	Confident	88.4	Confident	95 Å²	95	54.5 Å²	54.5	51%	0.508	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-11	174	-49.7	-43	0	0	0	113	R441 H462	R441-D464 WeakPolarHBondContact CB-OD2 3.22Å; R441-D464 VanDerWaalsContact CD-OD1 3.24Å; R441-D464 WeakPolarHBondContact CD-OD1 3.41Å; R441-D464 WeakPolarHBondContact CD-OD2 3.27Å; R441-D464 IonicContact CZ-OD1 3.53Å; R441-D464 IonicContact NE-OD1 3.67Å; R441-D464 IonicContact NH1-OD1 2.8Å; R441-D464 PolarHBondContact NH1-OD1 2.83Å; H462-D464 IonicContact ND1-OD2 3.78Å; H462-D464 PolarHBondContact O-N 2.81Å
465	R	86.4	Confident	88.1	Confident	45 Å²	45	52.9 Å²	52.9	17%	0.17	27%	0.269	C	S	.	.	S	Bend	trans	-74.5	145.3	175.2	-68.4	-70.3	169.3	126	-7	109.6	D445 E448 S460 H462 D469 R470	D445-R465 IonicContact OD1-CZ 2.72Å; D445-R465 IonicContact OD1-NE 3.46Å; D445-R465 IonicContact OD1-NH2 3.43Å; D445-R465 PolarHBondContact OD1-NH2 2.84Å; E448-R465 IonicContact OE1-NH1 3.36Å; E448-R465 IonicContact OE2-CZ 3.86Å; E448-R465 IonicContact OE2-NH1 3.42Å; E448-R465 PolarHBondContact OE2-NH1 3.35Å; E448-R465 IonicContact OE2-NH2 3.54Å; E448-R465 PolarHBondContact OE2-NH2 2.61Å; S460-R465 PolarHBondContact OG-NH1 2.68Å; S460-R465 PolarHBondContact OG-NH2 3.24Å; S460-R465 VanDerWaalsContact OG-NH2 3.08Å; H462-R465 WeakPolarHBondContact NE2-CG 3.39Å; H462-R465 PolarHBondContact NE2-NE 3.22Å; H462-R465 PolarHBondContact O-N 2.99Å; H462-R465 VanDerWaalsContact O-N 3.13Å; R465-D469 HydrophobicContact CB-CB 4.17Å; R465-R470 HydrophobicContact CB-CG 4.07Å
466	T	86.8	Confident	88	Confident	79 Å²	79	44.3 Å²	44.3	49%	0.485	23%	0.233	S	C	.	.			trans	-64	157.9	172.7	77.5	0	0	0	0	109.2	E468 D469 R470	T466-E468 PolarHBondContact O-N 2.92Å; T466-D469 VanDerWaalsContact CB-OD2 3.27Å; T466-D469 WeakPolarHBondContact CB-OD2 3.44Å; T466-D469 WeakPolarHBondContact CG2-OD2 3.4Å; T466-D469 PolarHBondContact N-OD2 3.47Å; T466-D469 WeakPolarHBondContact O-CB 3.24Å; T466-D469 PolarHBondContact O-N 2.81Å; T466-D469 PolarHBondContact OG1-N 2.96Å; T466-D469 PolarHBondContact OG1-OD2 2.91Å; T466-R470 WeakPolarHBondContact O-CG 3.43Å; T466-R470 PolarHBondContact O-N 3.45Å
467	Q	80.1	Confident	87.9	Confident	29 Å²	29	42 Å²	42	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-33	-179	-175.3	58.7	45.9	0	0	113	R266 G293 D469 R470 E471	R266-Q467 VanDerWaalsContact CD-CD 3.44Å; R266-Q467 VanDerWaalsContact CD-NE2 3.34Å; R266-Q467 VanDerWaalsContact CZ-CD 3.42Å; R266-Q467 VanDerWaalsContact NE-CD 3.29Å; R266-Q467 VanDerWaalsContact NE-NE2 3.1Å; G293-Q467 VanDerWaalsContact O-CB 3.27Å; G293-Q467 WeakPolarHBondContact O-CB 3.34Å; G293-Q467 WeakPolarHBondContact O-CG 3.35Å; Q467-D469 VanDerWaalsContact C-N 3.35Å; Q467-R470 PolarHBondContact O-N 2.78Å; Q467-E471 PolarHBondContact NE2-OE1 3.41Å; Q467-E471 PolarHBondContact O-N 2.9Å
468	E	85.9	Confident	87.4	Confident	160 Å²	160	43.1 Å²	43.1	75%	0.748	22%	0.222	S	C	*	.	H	α-helix	trans	-65.4	-40.7	175.9	-62.3	-179.7	-171.2	0	0	110.2	T466 R470 E471 L472	T466-E468 PolarHBondContact O-N 2.92Å; E468-R470 PolarHBondContact O-N 3.44Å; E468-E471 PolarHBondContact O-N 2.81Å; E468-L472 WeakPolarHBondContact O-CB 3.21Å; E468-L472 PolarHBondContact O-N 2.9Å
469	D	88.7	Confident	87	Confident	42 Å²	42	46 Å²	46	23%	0.225	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-42.3	171.7	-55	-50.4	0	0	0	111.9	R465 T466 Q467 L472 A473	R465-D469 HydrophobicContact CB-CB 4.17Å; T466-D469 VanDerWaalsContact CB-OD2 3.27Å; T466-D469 WeakPolarHBondContact CB-OD2 3.44Å; T466-D469 WeakPolarHBondContact CG2-OD2 3.4Å; T466-D469 PolarHBondContact N-OD2 3.47Å; T466-D469 WeakPolarHBondContact O-CB 3.24Å; T466-D469 PolarHBondContact O-N 2.81Å; T466-D469 PolarHBondContact OG1-N 2.96Å; T466-D469 PolarHBondContact OG1-OD2 2.91Å; Q467-D469 VanDerWaalsContact C-N 3.35Å; D469-L472 PolarHBondContact O-N 2.85Å; D469-A473 WeakPolarHBondContact O-CB 3.16Å; D469-A473 PolarHBondContact O-N 2.85Å
470	R	85.8	Confident	86.7	Confident	34 Å²	34	47.7 Å²	47.7	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-47.3	179.6	-68.3	173.2	62.7	152.3	-2.3	111.2	E267 I461 R465 T466 Q467 E468 L474	E267-R470 IonicContact OE1-CZ 2.9Å; E267-R470 IonicContact OE1-NE 2.68Å; E267-R470 PolarHBondContact OE1-NE 2.96Å; E267-R470 IonicContact OE1-NH2 2.85Å; E267-R470 PolarHBondContact OE1-NH2 2.89Å; E267-R470 IonicContact OE2-NH2 3.27Å; I461-R470 HydrophobicContact CD1-CB 4.17Å; I461-R470 HydrophobicContact CD1-CG 4.35Å; I461-R470 HydrophobicContact CG1-CB 4.08Å; I461-R470 HydrophobicContact CG1-CG 3.82Å; R465-R470 HydrophobicContact CB-CG 4.07Å; T466-R470 WeakPolarHBondContact O-CG 3.43Å; T466-R470 PolarHBondContact O-N 3.45Å; Q467-R470 PolarHBondContact O-N 2.78Å; E468-R470 PolarHBondContact O-N 3.44Å; R470-L474 WeakPolarHBondContact O-CB 3.29Å; R470-L474 VanDerWaalsContact O-CG 3.23Å; R470-L474 WeakPolarHBondContact O-CG 3.24Å; R470-L474 PolarHBondContact O-N 3.22Å
471	E	82.7	Confident	86.5	Confident	81 Å²	81	54.3 Å²	54.3	38%	0.379	29%	0.285	S	S	.	.	H	α-helix	trans	-67.9	-38.5	177.7	-82.7	162.5	-148.9	0	0	112	R266 Q467 E468 L474 S475	R266-E471 IonicContact CZ-OE1 3.7Å; R266-E471 IonicContact NE-OE1 3.99Å; R266-E471 PolarHBondContact NE-OE1 3.13Å; R266-E471 IonicContact NH2-OE1 2.78Å; R266-E471 PolarHBondContact NH2-OE1 3.08Å; R266-E471 IonicContact NH2-OE2 2.81Å; Q467-E471 PolarHBondContact NE2-OE1 3.41Å; Q467-E471 PolarHBondContact O-N 2.9Å; E468-E471 PolarHBondContact O-N 2.81Å; E471-L474 PolarHBondContact O-N 3.38Å; E471-S475 WeakPolarHBondContact O-CB 3.28Å; E471-S475 PolarHBondContact O-N 3.49Å
472	L	88.2	Confident	86.5	Confident	76 Å²	76	54.6 Å²	54.6	40%	0.398	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-44.3	176.1	-168.8	60.3	0	0	0	111.4	W94 E468 D469 L474 S475 C476	W94-L472 HydrophobicContact CE3-CD2 3.6Å; W94-L472 HydrophobicContact CE3-CG 4.22Å; W94-L472 HydrophobicContact CZ3-CB 4.17Å; W94-L472 HydrophobicContact CZ3-CD2 3.7Å; W94-L472 HydrophobicContact CZ3-CG 3.8Å; E468-L472 WeakPolarHBondContact O-CB 3.21Å; E468-L472 PolarHBondContact O-N 2.9Å; D469-L472 PolarHBondContact O-N 2.85Å; L472-L474 PolarHBondContact O-N 2.77Å; L472-S475 PolarHBondContact O-N 2.94Å; L472-S475 VanDerWaalsContact O-N 3.17Å; L472-S475 PolarHBondContact O-OG 2.75Å; L472-C476 WeakPolarHBondContact O-CB 3.33Å; L472-C476 PolarHBondContact O-N 2.9Å; L472-C476 PolarHBondContact O-SG 3.25Å
473	A	89.4	Confident	86.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-47.4	173.5	0	0	0	0	0	112	W94 A459 D469 S475 C476 F477	W94-A473 HydrophobicContact CH2-CB 4.18Å; A459-A473 HydrophobicContact CB-CB 4.03Å; D469-A473 WeakPolarHBondContact O-CB 3.16Å; D469-A473 PolarHBondContact O-N 2.85Å; A473-S475 VanDerWaalsContact C-N 3.32Å; A473-S475 PolarHBondContact O-N 3.09Å; A473-C476 PolarHBondContact O-N 3.43Å; A473-F477 WeakPolarHBondContact O-CB 3.4Å; A473-F477 PolarHBondContact O-N 3Å
474	L	85.4	Confident	87.1	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-63.8	-36.3	176.2	-68.9	169.8	0	0	0	112.1	E267 I461 R470 E471 L472 R478 L485 L495 I497	E267-L474 HydrophobicContact CG-CD1 4.09Å; I461-L474 HydrophobicContact CD1-CD1 3.96Å; I461-L474 HydrophobicContact CD1-CD2 4.09Å; I461-L474 HydrophobicContact CD1-CG 3.97Å; R470-L474 WeakPolarHBondContact O-CB 3.29Å; R470-L474 VanDerWaalsContact O-CG 3.23Å; R470-L474 WeakPolarHBondContact O-CG 3.24Å; R470-L474 PolarHBondContact O-N 3.22Å; E471-L474 PolarHBondContact O-N 3.38Å; L472-L474 PolarHBondContact O-N 2.77Å; L474-R478 VanDerWaalsContact O-CB 3.26Å; L474-R478 WeakPolarHBondContact O-CB 3.24Å; L474-R478 VanDerWaalsContact O-CG 3.23Å; L474-R478 WeakPolarHBondContact O-CG 3.27Å; L474-R478 PolarHBondContact O-N 3.32Å; L474-L485 HydrophobicContact CD2-CD2 4.03Å; L474-L495 HydrophobicContact CD1-CD2 3.87Å; L474-L495 HydrophobicContact CD2-CD1 3.81Å; L474-L495 HydrophobicContact CD2-CD2 4.05Å; L474-I497 HydrophobicContact CD2-CD1 4.43Å
475	S	84.6	Confident	87.5	Confident	55 Å²	55	49.9 Å²	49.9	39%	0.385	26%	0.255	S	S	.	.	H	α-helix	trans	-69.3	-39.3	175.8	82.5	0	0	0	0	112.5	E471 L472 A473 S479	E471-S475 WeakPolarHBondContact O-CB 3.28Å; E471-S475 PolarHBondContact O-N 3.49Å; L472-S475 PolarHBondContact O-N 2.94Å; L472-S475 VanDerWaalsContact O-N 3.17Å; L472-S475 PolarHBondContact O-OG 2.75Å; A473-S475 VanDerWaalsContact C-N 3.32Å; A473-S475 PolarHBondContact O-N 3.09Å; S475-S479 VanDerWaalsContact O-CB 3.31Å; S475-S479 WeakPolarHBondContact O-CB 3.41Å; S475-S479 PolarHBondContact O-N 2.97Å; S475-S479 PolarHBondContact O-OG 3.11Å
476	C	89.4	Confident	87.9	Confident	11 Å²	11	47.7 Å²	47.7	7%	0.074	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-36.8	175.9	-74.4	0	0	0	0	111.8	L472 A473 S479 G480 R481 T482	L472-C476 WeakPolarHBondContact O-CB 3.33Å; L472-C476 PolarHBondContact O-N 2.9Å; L472-C476 PolarHBondContact O-SG 3.25Å; A473-C476 PolarHBondContact O-N 3.43Å; C476-S479 WeakPolarHBondContact CA-OG 3.4Å; C476-S479 PolarHBondContact O-OG 2.96Å; C476-G480 PolarHBondContact O-N 3.48Å; C476-R481 HydrophobicContact CB-CB 4.25Å; C476-R481 PolarHBondContact O-N 3.35Å; C476-T482 VanDerWaalsContact C-OG1 3.26Å; C476-T482 HydrophobicContact CB-CG2 4.14Å; C476-T482 VanDerWaalsContact CB-OG1 3.28Å; C476-T482 WeakPolarHBondContact CB-OG1 3.37Å; C476-T482 PolarHBondContact O-N 2.97Å; C476-T482 VanDerWaalsContact O-N 3.12Å
477	F	89.2	Confident	88.2	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-51.2	173.4	-170.9	-87.7	0	0	0	112	L433 I434 A473 S479 G480 T482 P483 L485 I497 V500	L433-F477 HydrophobicContact CB-CE1 3.7Å; L433-F477 HydrophobicContact CB-CE2 4.41Å; L433-F477 HydrophobicContact CB-CZ 3.59Å; L433-F477 HydrophobicContact CD1-CD1 4.29Å; L433-F477 HydrophobicContact CD1-CE1 3.92Å; L433-F477 HydrophobicContact CD2-CD1 4.4Å; L433-F477 HydrophobicContact CD2-CE1 4.19Å; L433-F477 HydrophobicContact CD2-CE2 4.49Å; L433-F477 HydrophobicContact CD2-CZ 4.29Å; L433-F477 WeakPolarHBondContact CD2-O 3.47Å; L433-F477 HydrophobicContact CG-CE1 4.15Å; L433-F477 HydrophobicContact CG-CZ 4.36Å; I434-F477 WeakPolarHBondContact O-CE2 3.23Å; A473-F477 WeakPolarHBondContact O-CB 3.4Å; A473-F477 PolarHBondContact O-N 3Å; F477-S479 PolarHBondContact O-N 2.62Å; F477-S479 VanDerWaalsContact O-N 3.14Å; F477-G480 PolarHBondContact O-N 2.95Å; F477-T482 WeakPolarHBondContact CA-O 3.44Å; F477-T482 WeakPolarHBondContact CD2-O 3.29Å; F477-T482 PolarHBondContact N-OG1 3.17Å; F477-P483 WeakPolarHBondContact CE2-O 3.2Å; F477-L485 HydrophobicContact CB-CD2 4.47Å; F477-L485 HydrophobicContact CD2-CB 3.32Å; F477-L485 HydrophobicContact CD2-CD2 4.39Å; F477-L485 HydrophobicContact CD2-CG 4.45Å; F477-L485 HydrophobicContact CE2-CB 3.53Å; F477-L485 HydrophobicContact CG-CB 4.03Å; F477-L485 HydrophobicContact CG-CD2 4.29Å; F477-L485 HydrophobicContact CZ-CB 4.4Å; F477-I497 HydrophobicContact CD1-CG2 3.42Å; F477-I497 VanDerWaalsContact CD1-CG2 3.42Å; F477-I497 HydrophobicContact CE1-CG2 3.4Å; F477-I497 VanDerWaalsContact CE1-CG2 3.4Å; F477-V500 HydrophobicContact CE1-CG2 3.85Å; F477-V500 HydrophobicContact CZ-CG2 4.19Å
478	R	83.6	Confident	88.7	Confident	135 Å²	135	42.8 Å²	42.8	51%	0.509	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-24.3	177.5	-75	172.1	171.5	179.3	-4.1	113.5	L474 D496 I497	L474-R478 VanDerWaalsContact O-CB 3.26Å; L474-R478 WeakPolarHBondContact O-CB 3.24Å; L474-R478 VanDerWaalsContact O-CG 3.23Å; L474-R478 WeakPolarHBondContact O-CG 3.27Å; L474-R478 PolarHBondContact O-N 3.32Å; R478-D496 PolarHBondContact NH2-O 2.83Å; R478-I497 HydrophobicContact CG-CG2 4.41Å
479	S	85.4	Confident	88.3	Confident	72 Å²	72	35.9 Å²	35.9	50%	0.503	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	4.2	175	58.5	0	0	0	0	114.4	S475 C476 F477 R481	S475-S479 VanDerWaalsContact O-CB 3.31Å; S475-S479 WeakPolarHBondContact O-CB 3.41Å; S475-S479 PolarHBondContact O-N 2.97Å; S475-S479 PolarHBondContact O-OG 3.11Å; C476-S479 WeakPolarHBondContact CA-OG 3.4Å; C476-S479 PolarHBondContact O-OG 2.96Å; F477-S479 PolarHBondContact O-N 2.62Å; F477-S479 VanDerWaalsContact O-N 3.14Å; S479-R481 PolarHBondContact O-N 3.16Å
480	G	86.3	Confident	87.2	Confident	38 Å²	38	37.7 Å²	37.7	39%	0.392	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	6.2	179.7	0	0	0	0	0	115.5	C476 F477	C476-G480 PolarHBondContact O-N 3.48Å; F477-G480 PolarHBondContact O-N 2.95Å
481	R	88.4	Confident	86.2	Confident	140 Å²	140	36.1 Å²	36.1	53%	0.528	20%	0.196	S	C	.	.	S	Bend	trans	-67.5	-37.5	175.9	-67.3	178.4	173.4	-170.5	-2.5	111.9	Q457 C476 S479	Q457-R481 PolarHBondContact OE1-O 2.88Å; C476-R481 HydrophobicContact CB-CB 4.25Å; C476-R481 PolarHBondContact O-N 3.35Å; S479-R481 PolarHBondContact O-N 3.16Å
482	T	91.2	Very high	85.1	Confident	6 Å²	6	32.2 Å²	32.2	4%	0.037	18%	0.178	C	C	.	.	S	Bend	trans	-122.6	84.4	172.3	52.6	0	0	0	0	107.9	Q457 A459 C476 F477 V484	Q457-T482 CarbonylContact O-C 3.48Å; Q457-T482 WeakPolarHBondContact O-CA 3.45Å; A459-T482 HydrophobicContact CB-CG2 4.23Å; C476-T482 VanDerWaalsContact C-OG1 3.26Å; C476-T482 HydrophobicContact CB-CG2 4.14Å; C476-T482 VanDerWaalsContact CB-OG1 3.28Å; C476-T482 WeakPolarHBondContact CB-OG1 3.37Å; C476-T482 PolarHBondContact O-N 2.97Å; C476-T482 VanDerWaalsContact O-N 3.12Å; F477-T482 WeakPolarHBondContact CA-O 3.44Å; F477-T482 WeakPolarHBondContact CD2-O 3.29Å; F477-T482 PolarHBondContact N-OG1 3.17Å; T482-V484 PolarHBondContact O-N 3.26Å; T482-V484 VanDerWaalsContact O-N 3.15Å
483	P	92.2	Very high	84	Confident	27 Å²	27	30.8 Å²	30.8	18%	0.175	17%	0.167	C	C	.	.			trans	-65.7	-11.8	-176.4	26	-35.4	0	0	0	114.1	T432 L433 I434 Q457 F477	T432-P483 WeakPolarHBondContact O-CB 3.44Å; L433-P483 HydrophobicContact CD2-CB 4.35Å; I434-P483 PolarHBondContact N-O 3.46Å; Q457-P483 WeakPolarHBondContact O-CD 3.26Å; F477-P483 WeakPolarHBondContact CE2-O 3.2Å
484	V	93.7	Very high	82.5	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.03	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.3	172.5	-170.7	0	0	0	0	110	L425 I434 V436 L451 Q457 V458 A459 T482	L425-V484 HydrophobicContact CD1-CG2 4.49Å; L425-V484 HydrophobicContact CD2-CG1 4.32Å; L425-V484 HydrophobicContact CD2-CG2 3.87Å; I434-V484 WeakPolarHBondContact O-CA 3.26Å; V436-V484 HydrophobicContact CG2-CG1 3.87Å; L451-V484 HydrophobicContact CD1-CG1 4.23Å; Q457-V484 PolarHBondContact O-N 2.92Å; V458-V484 WeakPolarHBondContact CA-O 3.3Å; V458-V484 HydrophobicContact CB-CB 4.25Å; V458-V484 HydrophobicContact CG2-CB 4.14Å; V458-V484 HydrophobicContact CG2-CG1 4.06Å; A459-V484 PolarHBondContact N-O 3.04Å; T482-V484 PolarHBondContact O-N 3.26Å; T482-V484 VanDerWaalsContact O-N 3.15Å
485	L	93.4	Very high	81.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118.6	172.6	177.4	60.7	0	0	0	109.8	I434 L435 V436 A459 I461 L474 F477 I497	I434-L485 PolarHBondContact O-N 2.92Å; L435-L485 HydrophobicContact CD1-CB 4.17Å; L435-L485 HydrophobicContact CD1-CD2 3.99Å; L435-L485 HydrophobicContact CD1-CG 4.03Å; V436-L485 PolarHBondContact N-O 3.37Å; A459-L485 HydrophobicContact CB-CD1 4.31Å; A459-L485 WeakPolarHBondContact O-CA 3.36Å; I461-L485 HydrophobicContact CB-CD1 4.1Å; I461-L485 HydrophobicContact CG2-CD1 3.93Å; I461-L485 HydrophobicContact CG2-CD2 4.18Å; I461-L485 HydrophobicContact CG2-CG 4.12Å; L474-L485 HydrophobicContact CD2-CD2 4.03Å; F477-L485 HydrophobicContact CB-CD2 4.47Å; F477-L485 HydrophobicContact CD2-CB 3.32Å; F477-L485 HydrophobicContact CD2-CD2 4.39Å; F477-L485 HydrophobicContact CD2-CG 4.45Å; F477-L485 HydrophobicContact CE2-CB 3.53Å; F477-L485 HydrophobicContact CG-CB 4.03Å; F477-L485 HydrophobicContact CG-CD2 4.29Å; F477-L485 HydrophobicContact CZ-CB 4.4Å; L485-I497 HydrophobicContact CD2-CD1 4.14Å
486	V	94.9	Very high	80.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.2	174.4	-177	0	0	0	0	109.3	V436 V438 A444 L447 L451 V458 A459 S460 I461	V436-V486 HydrophobicContact CB-CG2 4.38Å; V436-V486 CarbonylContact O-C 3.55Å; V436-V486 WeakPolarHBondContact O-CA 3.43Å; V438-V486 HydrophobicContact CG1-CG1 4.06Å; V438-V486 HydrophobicContact CG2-CG1 3.92Å; A444-V486 HydrophobicContact CB-CG1 3.93Å; L447-V486 HydrophobicContact CB-CG1 4.29Å; L447-V486 HydrophobicContact CD2-CG1 4.04Å; L447-V486 HydrophobicContact CD2-CG2 4.29Å; L447-V486 HydrophobicContact CG-CG2 4.38Å; L451-V486 HydrophobicContact CD1-CG2 4.07Å; V458-V486 HydrophobicContact CG2-CG2 3.81Å; A459-V486 PolarHBondContact O-N 2.79Å; S460-V486 CarbonylContact C-O 3.56Å; S460-V486 WeakPolarHBondContact CA-O 3.4Å; I461-V486 PolarHBondContact N-O 3.45Å
487	A	92.9	Very high	79.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	143	-172.4	0	0	0	0	0	113.4	L435 V436 F437 V438 I461 A492	L435-A487 HydrophobicContact CD1-CB 4Å; V436-A487 PolarHBondContact O-N 2.94Å; F437-A487 WeakPolarHBondContact CA-O 3.49Å; V438-A487 PolarHBondContact N-O 2.89Å; I461-A487 HydrophobicContact CG2-CB 3.48Å; I461-A487 VanDerWaalsContact CG2-CB 3.48Å; I461-A487 WeakPolarHBondContact O-CA 3.44Å; A487-A492 HydrophobicContact CB-CB 3.7Å
488	T	91	Very high	78.2	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	153.8	163.6	55.7	0	0	0	0	111.3	V438 R441 A444 I461 H462 V490 A491 A492	V438-T488 HydrophobicContact CG2-CG2 4.11Å; R441-T488 HydrophobicContact CG-CG2 4.4Å; A444-T488 HydrophobicContact CB-CG2 4.29Å; I461-T488 PolarHBondContact O-N 2.93Å; I461-T488 VanDerWaalsContact O-N 3.17Å; H462-T488 WeakPolarHBondContact CA-OG1 3.44Å; H462-T488 HydrophobicContact CB-CG2 3.94Å; H462-T488 WeakPolarHBondContact CB-OG1 3.49Å; T488-V490 VanDerWaalsContact C-N 3.34Å; T488-V490 PolarHBondContact O-N 3.47Å; T488-A491 PolarHBondContact O-N 2.95Å; T488-A492 PolarHBondContact O-N 3.26Å; T488-A492 VanDerWaalsContact O-N 3.12Å
489	A	76.8	Confident	77.5	Confident	15 Å²	15	30 Å²	30	12%	0.124	17%	0.171	C	C	.	.	H	α-helix	trans	-39.7	-57.1	178.9	0	0	0	0	0	113.9	A491 A492 R493 E514	A489-A491 PolarHBondContact O-N 2.85Å; A489-A492 PolarHBondContact O-N 2.92Å; A489-A492 VanDerWaalsContact O-N 3.12Å; A489-R493 WeakPolarHBondContact O-CG 3.29Å; A489-R493 PolarHBondContact O-N 2.86Å; A489-R493 VanDerWaalsContact O-N 3.11Å; A489-E514 WeakPolarHBondContact CB-OE1 3.46Å
490	V	67.4	Low	77.5	Confident	80 Å²	80	26.9 Å²	26.9	49%	0.485	15%	0.149	S	C	.	.	H	α-helix	trans	-58.9	-33.3	-176.4	-177.6	0	0	0	0	112.9	T488	T488-V490 VanDerWaalsContact C-N 3.34Å; T488-V490 PolarHBondContact O-N 3.47Å
491	A	63	Low	77.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-87.1	-20.3	-179.1	0	0	0	0	0	113.5	I461 T488 A489 L495	I461-A491 HydrophobicContact CB-CB 4.44Å; I461-A491 HydrophobicContact CD1-CB 4.37Å; I461-A491 HydrophobicContact CG1-CB 4.04Å; I461-A491 HydrophobicContact CG2-CB 4.14Å; I461-A491 WeakPolarHBondContact O-CB 3.49Å; T488-A491 PolarHBondContact O-N 2.95Å; A489-A491 PolarHBondContact O-N 2.85Å; A491-L495 WeakPolarHBondContact O-CD1 3.26Å; A491-L495 VanDerWaalsContact O-CG 3.3Å; A491-L495 WeakPolarHBondContact O-CG 3.23Å
492	A	59.8	Low	77.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-102.9	-27	-173.6	0	0	0	0	0	115.9	F437 A487 T488 A489 L495	F437-A492 HydrophobicContact CD1-CB 4.1Å; F437-A492 HydrophobicContact CE1-CB 3.24Å; F437-A492 HydrophobicContact CZ-CB 3.69Å; A487-A492 HydrophobicContact CB-CB 3.7Å; T488-A492 PolarHBondContact O-N 3.26Å; T488-A492 VanDerWaalsContact O-N 3.12Å; A489-A492 PolarHBondContact O-N 2.92Å; A489-A492 VanDerWaalsContact O-N 3.12Å; A492-L495 HydrophobicContact CB-CD1 4.25Å; A492-L495 WeakPolarHBondContact O-CG 3.42Å; A492-L495 PolarHBondContact O-N 2.8Å
493	R	66.5	Low	78	Confident	45 Å²	45	23.2 Å²	23.2	17%	0.17	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	138	167.6	24.6	167.6	142	176.6	-9	109.8	R341 D344 A489 L495 E514	R341-R493 VanDerWaalsContact CZ-C 3.41Å; R341-R493 VanDerWaalsContact NE-CD 3.33Å; R341-R493 PolarHBondContact NH1-O 2.88Å; R341-R493 PolarHBondContact NH2-O 2.92Å; D344-R493 IonicContact OD2-CZ 3.77Å; D344-R493 IonicContact OD2-NH1 3.92Å; D344-R493 PolarHBondContact OD2-NH1 3.11Å; A489-R493 WeakPolarHBondContact O-CG 3.29Å; A489-R493 PolarHBondContact O-N 2.86Å; A489-R493 VanDerWaalsContact O-N 3.11Å; R493-L495 VanDerWaalsContact C-N 3.31Å; R493-L495 PolarHBondContact O-N 2.84Å; R493-E514 IonicContact CZ-OE2 3.13Å; R493-E514 IonicContact NE-OE2 2.77Å; R493-E514 IonicContact NH2-OE2 2.67Å; R493-E514 PolarHBondContact NH2-OE2 3.43Å
494	G	57.5	Low	78.2	Confident	1 Å²	1	22 Å²	22	1%	0.01	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-8.1	-174.5	0	0	0	0	0	116.1	L268 D496	L268-G494 PolarHBondContact N-O 2.89Å; G494-D496 PolarHBondContact O-N 3.29Å
495	L	65.9	Low	78.3	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.016	12%	0.116	C	C	.	.			trans	-69.8	120.9	167.8	-57.5	-177	0	0	0	109.3	E267 I461 L474 A491 A492 R493 I497 R521	E267-L495 HydrophobicContact CB-CD2 3.62Å; E267-L495 HydrophobicContact CG-CD2 3.51Å; I461-L495 HydrophobicContact CD1-CD1 4.35Å; I461-L495 HydrophobicContact CD1-CD2 4.47Å; L474-L495 HydrophobicContact CD1-CD2 3.87Å; L474-L495 HydrophobicContact CD2-CD1 3.81Å; L474-L495 HydrophobicContact CD2-CD2 4.05Å; A491-L495 WeakPolarHBondContact O-CD1 3.26Å; A491-L495 VanDerWaalsContact O-CG 3.3Å; A491-L495 WeakPolarHBondContact O-CG 3.23Å; A492-L495 HydrophobicContact CB-CD1 4.25Å; A492-L495 WeakPolarHBondContact O-CG 3.42Å; A492-L495 PolarHBondContact O-N 2.8Å; R493-L495 VanDerWaalsContact C-N 3.31Å; R493-L495 PolarHBondContact O-N 2.84Å; L495-I497 HydrophobicContact CB-CD1 4.05Å; L495-I497 HydrophobicContact CB-CG1 3.67Å; L495-I497 HydrophobicContact CD1-CD1 3.74Å; L495-I497 HydrophobicContact CD1-CG1 4.24Å; L495-R521 WeakPolarHBondContact O-CD 3.48Å; L495-R521 PolarHBondContact O-NH1 3.34Å
496	D	61.5	Low	78.4	Confident	41 Å²	41	22.8 Å²	22.8	22%	0.219	12%	0.12	C	C	.	.			trans	-88.4	112.2	151.3	-173.5	51.7	0	0	0	109.2	Q271 R478 G494 R524	Q271-D496 HydrophobicContact CG-CB 4.27Å; R478-D496 PolarHBondContact NH2-O 2.83Å; G494-D496 PolarHBondContact O-N 3.29Å; D496-R524 IonicContact OD1-CZ 3.63Å; D496-R524 IonicContact OD1-NH1 2.71Å; D496-R524 PolarHBondContact OD1-NH1 2.84Å
497	I	67.9	Low	78.4	Confident	3 Å²	3	23.8 Å²	23.8	2%	0.015	13%	0.125	C	C	.	.			trans	-117.6	99.4	176	-42.9	-179.1	0	0	0	105.3	L435 L474 F477 R478 L485 L495 V500	L435-I497 HydrophobicContact CD1-CD1 4.24Å; L435-I497 HydrophobicContact CD2-CD1 4.21Å; L474-I497 HydrophobicContact CD2-CD1 4.43Å; F477-I497 HydrophobicContact CD1-CG2 3.42Å; F477-I497 VanDerWaalsContact CD1-CG2 3.42Å; F477-I497 HydrophobicContact CE1-CG2 3.4Å; F477-I497 VanDerWaalsContact CE1-CG2 3.4Å; R478-I497 HydrophobicContact CG-CG2 4.41Å; L485-I497 HydrophobicContact CD2-CD1 4.14Å; L495-I497 HydrophobicContact CB-CD1 4.05Å; L495-I497 HydrophobicContact CB-CG1 3.67Å; L495-I497 HydrophobicContact CD1-CD1 3.74Å; L495-I497 HydrophobicContact CD1-CG1 4.24Å; I497-V500 HydrophobicContact CB-CG2 3.67Å; I497-V500 HydrophobicContact CD1-CG2 4.41Å; I497-V500 HydrophobicContact CG2-CG2 3.7Å
498	P	62.7	Low	78.5	Confident	43 Å²	43	24.2 Å²	24.2	28%	0.279	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	145.9	178.1	24.7	-33.7	0	0	0	109.9	V500	P498-V500 VanDerWaalsContact C-N 3.33Å; P498-V500 PolarHBondContact O-N 2.85Å
499	N	68.8	Low	78.5	Confident	106 Å²	106	24.3 Å²	24.3	57%	0.567	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	21.9	171.6	-48.3	-19.7	0	0	0	116.4	L433 K501	L433-N499 HydrophobicContact CD1-CB 4.39Å; N499-K501 PolarHBondContact O-N 3.16Å
500	V	86.3	Confident	79	Confident	7 Å²	7	28.3 Å²	28.3	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	109.3	162.5	176.5	0	0	0	0	108.2	L435 F477 I497 P498 H502 V503 T522	L435-V500 HydrophobicContact CB-CG1 3.95Å; F477-V500 HydrophobicContact CE1-CG2 3.85Å; F477-V500 HydrophobicContact CZ-CG2 4.19Å; I497-V500 HydrophobicContact CB-CG2 3.67Å; I497-V500 HydrophobicContact CD1-CG2 4.41Å; I497-V500 HydrophobicContact CG2-CG2 3.7Å; P498-V500 VanDerWaalsContact C-N 3.33Å; P498-V500 PolarHBondContact O-N 2.85Å; V500-H502 WeakPolarHBondContact CG1-O 3.32Å; V500-V503 HydrophobicContact CG1-CG2 3.98Å; V500-T522 VanDerWaalsContact O-CB 3.25Å; V500-T522 WeakPolarHBondContact O-CB 3.35Å; V500-T522 PolarHBondContact O-OG1 2.86Å
501	K	89.1	Confident	79.8	Confident	97 Å²	97	28 Å²	28	42%	0.422	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-33.7	177.5	-87.8	-174.1	172.5	-178.5	0	111.9	E429 T432 L433 N499 T522 L530	E429-K501 IonicContact OE2-NZ 2.67Å; E429-K501 PolarHBondContact OE2-NZ 3.42Å; T432-K501 HydrophobicContact CG2-CB 3.63Å; T432-K501 HydrophobicContact CG2-CD 3.91Å; T432-K501 HydrophobicContact CG2-CG 4.4Å; L433-K501 PolarHBondContact O-N 3.48Å; N499-K501 PolarHBondContact O-N 3.16Å; K501-T522 PolarHBondContact O-OG1 3.2Å; K501-L530 PolarHBondContact O-N 3.21Å
502	H	93	Very high	81	Confident	10 Å²	10	30 Å²	30	5%	0.046	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	125.7	-172.4	-165.7	-175.5	0	0	0	111.1	T432 L433 I434 L435 V500 L530 T532	T432-H502 HydrophobicContact CG2-CB 4.44Å; L433-H502 PolarHBondContact O-N 3.16Å; I434-H502 WeakPolarHBondContact CA-O 3.32Å; I434-H502 HydrophobicContact CG1-CB 4.19Å; I434-H502 HydrophobicContact CG2-CB 4.24Å; L435-H502 PolarHBondContact N-O 2.92Å; V500-H502 WeakPolarHBondContact CG1-O 3.32Å; H502-L530 CarbonylContact C-O 3.56Å; H502-L530 WeakPolarHBondContact CA-O 3.46Å; H502-L530 HydrophobicContact CB-CB 4.42Å; H502-L530 PolarHBondContact CD2-O 3.34Å; H502-T532 PolarHBondContact NE2-OG1 2.86Å
503	V	93.4	Very high	82	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	131	166.2	172.9	0	0	0	0	108.3	L435 F437 V500 R521 T522 L530 A531 T532	L435-V503 WeakPolarHBondContact O-CA 3.24Å; F437-V503 HydrophobicContact CD2-CG1 3.76Å; F437-V503 HydrophobicContact CE2-CG1 3.74Å; V500-V503 HydrophobicContact CG1-CG2 3.98Å; V503-R521 HydrophobicContact CG2-CB 4.2Å; V503-T522 HydrophobicContact CB-CG2 4.38Å; V503-T522 HydrophobicContact CG2-CG2 3.85Å; V503-L530 PolarHBondContact N-O 3.18Å; V503-A531 CarbonylContact O-C 3.57Å; V503-A531 WeakPolarHBondContact O-CA 3.19Å; V503-T532 PolarHBondContact O-N 2.68Å
504	I	95.8	Very high	82.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	111.6	174.4	-55.9	178.8	0	0	0	108.8	L421 L424 L425 I434 L435 V436 F437 Y506 T532 F534	L421-I504 HydrophobicContact CD1-CD1 3.74Å; L421-I504 HydrophobicContact CD1-CG2 3.94Å; L424-I504 HydrophobicContact CB-CD1 4.31Å; L424-I504 HydrophobicContact CD1-CD1 4.26Å; L425-I504 HydrophobicContact CD2-CD1 4.47Å; I434-I504 HydrophobicContact CG2-CD1 3.69Å; I434-I504 HydrophobicContact CG2-CG1 4.04Å; L435-I504 PolarHBondContact O-N 3.35Å; V436-I504 CarbonylContact C-O 3.5Å; V436-I504 WeakPolarHBondContact CA-O 3.48Å; V436-I504 HydrophobicContact CG2-CB 4.37Å; F437-I504 PolarHBondContact N-O 3.13Å; I504-Y506 PolarHBondContact O-N 3.17Å; I504-T532 CarbonylContact C-O 3.56Å; I504-T532 VanDerWaalsContact CA-O 3.27Å; I504-T532 WeakPolarHBondContact CA-O 3.42Å; I504-F534 HydrophobicContact CG2-CZ 4.43Å
505	N	96.2	Very high	84.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	93.5	165.2	-68.1	-65.7	0	0	0	108.4	L508 R518 T532 S533 F534	N505-L508 HydrophobicContact CB-CD2 4.2Å; N505-R518 WeakPolarHBondContact OD1-CD 3.42Å; N505-R518 PolarHBondContact OD1-NH1 2.8Å; N505-R518 VanDerWaalsContact OD1-NH1 3.1Å; N505-T532 PolarHBondContact N-O 3.38Å; N505-S533 PolarHBondContact ND2-OG 3.01Å; N505-F534 PolarHBondContact O-N 3.24Å
506	Y	96.7	Very high	85.1	Confident	22 Å²	22	33 Å²	33	9%	0.086	18%	0.178	C	C	.	.	S	Bend	trans	-68.7	-40.3	173.3	178.1	-79.1	0	0	0	110.5	K417 R418 L421 F437 V438 L447 I504 F534	K417-Y506 HydrophobicContact CB-CD2 4.26Å; K417-Y506 HydrophobicContact CB-CE1 4.17Å; K417-Y506 HydrophobicContact CB-CE2 3.6Å; K417-Y506 HydrophobicContact CD-CD1 4.1Å; K417-Y506 HydrophobicContact CD-CE1 3.73Å; K417-Y506 WeakPolarHBondContact CD-O 3.48Å; K417-Y506 WeakPolarHBondContact CE-O 3.49Å; K417-Y506 PolarHBondContact NZ-O 3.39Å; R418-Y506 HydrophobicContact CG-CE2 4.5Å; R418-Y506 WeakPolarHBondContact CG-OH 3.41Å; L421-Y506 HydrophobicContact CB-CD2 4.31Å; L421-Y506 HydrophobicContact CB-CE2 4.44Å; L421-Y506 HydrophobicContact CD2-CD2 3.91Å; L421-Y506 HydrophobicContact CD2-CE2 4.23Å; F437-Y506 WeakPolarHBondContact O-CB 3.48Å; F437-Y506 PolarHBondContact O-N 2.93Å; V438-Y506 HydrophobicContact CG1-CD1 3.89Å; V438-Y506 HydrophobicContact CG1-CG 4.17Å; L447-Y506 HydrophobicContact CD1-CD2 4.44Å; L447-Y506 HydrophobicContact CD1-CE2 3.89Å; L447-Y506 HydrophobicContact CD2-CD1 4.48Å; L447-Y506 HydrophobicContact CD2-CD2 3.95Å; L447-Y506 HydrophobicContact CD2-CE2 4.16Å; L447-Y506 HydrophobicContact CD2-CG 4.11Å; I504-Y506 PolarHBondContact O-N 3.17Å; Y506-F534 HydrophobicContact CD2-CD2 4.08Å; Y506-F534 AromaticContact CD2-CE2 3.79Å; Y506-F534 HydrophobicContact CD2-CE2 3.79Å; Y506-F534 HydrophobicContact CE2-CE2 4.39Å; Y506-F534 HydrophobicContact CG-CD2 4.3Å; Y506-F534 HydrophobicContact CG-CE2 4.42Å
507	D	95.1	Very high	85.9	Confident	22 Å²	22	31.5 Å²	31.5	12%	0.118	17%	0.17	C	C	.	.	S	Bend	trans	-115.9	123.8	162.2	-54.4	-50.1	0	0	0	108.3	K417 F437 V438 E439 R518	K417-D507 IonicContact NZ-OD1 2.67Å; K417-D507 PolarHBondContact NZ-OD1 3.15Å; F437-D507 PolarHBondContact O-N 2.84Å; V438-D507 WeakPolarHBondContact CA-OD2 3.24Å; E439-D507 HydrophobicContact CB-CB 3.91Å; E439-D507 PolarHBondContact N-OD2 3.27Å; D507-R518 PolarHBondContact O-NH1 3.37Å
508	L	93.5	Very high	86.8	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	17%	0.17	C	C	.	.			trans	-62.4	149.1	167.6	-82.8	167.6	0	0	0	110.8	N505 Y515 F534 F535 N539 L542 L546	N505-L508 HydrophobicContact CB-CD2 4.2Å; L508-Y515 HydrophobicContact CD2-CD2 3.66Å; L508-Y515 HydrophobicContact CD2-CE2 3.92Å; L508-F534 WeakPolarHBondContact CD1-O 3.47Å; L508-F534 WeakPolarHBondContact CG-O 3.3Å; L508-F535 HydrophobicContact CD1-CB 4.05Å; L508-F535 HydrophobicContact CD1-CD2 3.58Å; L508-F535 HydrophobicContact CD1-CE2 4.46Å; L508-F535 HydrophobicContact CD1-CG 4.2Å; L508-N539 HydrophobicContact CD1-CB 3.98Å; L508-L542 HydrophobicContact CB-CD1 4.38Å; L508-L546 HydrophobicContact CD1-CD1 4.18Å
509	P	91	Very high	88.1	Confident	8 Å²	8	29.6 Å²	29.6	5%	0.052	16%	0.157	C	C	.	.			trans	-66.1	175.3	173.5	28.8	-34	0	0	0	112.3	D511 E514 L542	P509-D511 WeakPolarHBondContact CG-O 3.27Å; P509-E514 HydrophobicContact CB-CB 3.95Å; P509-E514 HydrophobicContact CB-CG 3.97Å; P509-E514 HydrophobicContact CG-CB 4.32Å; P509-E514 HydrophobicContact CG-CG 4.45Å; P509-L542 HydrophobicContact CG-CD1 4.28Å; P509-L542 WeakPolarHBondContact O-CD1 3.37Å
510	S	87.2	Confident	88.7	Confident	99 Å²	99	24.9 Å²	24.9	69%	0.692	13%	0.133	S	C	*	.	S	Bend	trans	-78.6	-22	170	49.8	0	0	0	0	113.6	N541	S510-N541 PolarHBondContact O-ND2 3.26Å; S510-N541 VanDerWaalsContact O-ND2 3.08Å
511	D	86.1	Confident	88.5	Confident	73 Å²	73	24.9 Å²	24.9	39%	0.39	13%	0.132	S	C	.	.	S	Bend	trans	-131.2	154.3	-173.5	173.5	59.9	0	0	0	113.2	P509 E513 E514 Y515	P509-D511 WeakPolarHBondContact CG-O 3.27Å; D511-E513 WeakPolarHBondContact OD2-CA 3.46Å; D511-E513 WeakPolarHBondContact OD2-CB 3.23Å; D511-E513 PolarHBondContact OD2-N 3.41Å; D511-E514 PolarHBondContact OD2-N 3.17Å; D511-Y515 PolarHBondContact O-N 2.96Å
512	I	86.3	Confident	88.4	Confident	42 Å²	42	20.4 Å²	20.4	22%	0.215	11%	0.113	C	C	.	.	H	α-helix	trans	-79.2	-31.3	-175.8	-163.5	65.8	0	0	0	113.7	E514 Y515 V516 L542 L546 L549	I512-E514 VanDerWaalsContact C-N 3.33Å; I512-Y515 HydrophobicContact CD1-CD1 4.07Å; I512-Y515 HydrophobicContact CD1-CG 4.4Å; I512-Y515 WeakPolarHBondContact O-CB 3.24Å; I512-Y515 PolarHBondContact O-N 2.9Å; I512-Y515 VanDerWaalsContact O-N 3.15Å; I512-V516 WeakPolarHBondContact O-CG2 3.44Å; I512-V516 PolarHBondContact O-N 2.77Å; I512-V516 VanDerWaalsContact O-N 3.09Å; I512-L542 HydrophobicContact CB-CD2 4.35Å; I512-L546 HydrophobicContact CD1-CD2 3.81Å; I512-L546 HydrophobicContact CD1-CG 4.04Å; I512-L549 HydrophobicContact CD1-CD1 3.97Å; I512-L549 HydrophobicContact CG1-CD1 4.22Å
513	E	81	Confident	87.7	Confident	69 Å²	69	20.1 Å²	20.1	32%	0.322	11%	0.113	S	C	.	.	H	α-helix	trans	-68.3	-36.7	176.4	-58	-164.6	-171	0	0	110	T374 D511 V516 H517	T374-E513 VanDerWaalsContact CB-OE2 3.25Å; T374-E513 WeakPolarHBondContact CB-OE2 3.48Å; T374-E513 HydrophobicContact CG2-CB 4.44Å; T374-E513 HydrophobicContact CG2-CG 4.22Å; T374-E513 WeakPolarHBondContact CG2-OE2 3.24Å; T374-E513 PolarHBondContact OG1-OE2 3.36Å; D511-E513 WeakPolarHBondContact OD2-CA 3.46Å; D511-E513 WeakPolarHBondContact OD2-CB 3.23Å; D511-E513 PolarHBondContact OD2-N 3.41Å; E513-V516 PolarHBondContact O-N 2.81Å; E513-H517 PolarHBondContact O-N 3.09Å; E513-H517 VanDerWaalsContact O-N 3.1Å; E513-H517 PolarHBondContact O-ND1 3.16Å
514	E	83.2	Confident	86.9	Confident	23 Å²	23	21.7 Å²	21.7	11%	0.107	12%	0.119	C	C	.	.	H	α-helix	trans	-62.3	-42.1	169.3	-175.1	171.9	130.8	0	0	111.7	A489 R493 P509 D511 I512 V516 H517 R518	A489-E514 WeakPolarHBondContact CB-OE1 3.46Å; R493-E514 IonicContact CZ-OE2 3.13Å; R493-E514 IonicContact NE-OE2 2.77Å; R493-E514 IonicContact NH2-OE2 2.67Å; R493-E514 PolarHBondContact NH2-OE2 3.43Å; P509-E514 HydrophobicContact CB-CB 3.95Å; P509-E514 HydrophobicContact CB-CG 3.97Å; P509-E514 HydrophobicContact CG-CB 4.32Å; P509-E514 HydrophobicContact CG-CG 4.45Å; D511-E514 PolarHBondContact OD2-N 3.17Å; I512-E514 VanDerWaalsContact C-N 3.33Å; E514-V516 VanDerWaalsContact C-N 3.33Å; E514-V516 PolarHBondContact O-N 2.72Å; E514-H517 CarbonylContact O-C 3.54Å; E514-H517 PolarHBondContact O-N 3.26Å; E514-H517 VanDerWaalsContact O-N 3.07Å; E514-R518 HydrophobicContact CG-CG 4.05Å; E514-R518 VanDerWaalsContact O-CG 3.31Å; E514-R518 WeakPolarHBondContact O-CG 3.45Å; E514-R518 PolarHBondContact O-N 3.09Å; E514-R518 IonicContact OE1-CZ 3.67Å; E514-R518 IonicContact OE1-NE 3.11Å; E514-R518 PolarHBondContact OE1-NE 2.62Å; E514-R518 IonicContact OE1-NH2 3.24Å; E514-R518 PolarHBondContact OE1-NH2 2.96Å
515	Y	88.2	Confident	85.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.6	-45.9	178	171.4	-93.6	0	0	0	111.9	Q407 L508 D511 I512 H517 R518 I519 L546 L549	Q407-Y515 PolarHBondContact OE1-OH 3.27Å; L508-Y515 HydrophobicContact CD2-CD2 3.66Å; L508-Y515 HydrophobicContact CD2-CE2 3.92Å; D511-Y515 PolarHBondContact O-N 2.96Å; I512-Y515 HydrophobicContact CD1-CD1 4.07Å; I512-Y515 HydrophobicContact CD1-CG 4.4Å; I512-Y515 WeakPolarHBondContact O-CB 3.24Å; I512-Y515 PolarHBondContact O-N 2.9Å; I512-Y515 VanDerWaalsContact O-N 3.15Å; Y515-H517 VanDerWaalsContact C-N 3.35Å; Y515-H517 PolarHBondContact O-N 3.13Å; Y515-R518 PolarHBondContact O-N 3.24Å; Y515-I519 HydrophobicContact CD2-CG2 4.37Å; Y515-I519 HydrophobicContact CE1-CD1 3.87Å; Y515-I519 HydrophobicContact CE1-CG2 4.34Å; Y515-I519 HydrophobicContact CE2-CG2 3.92Å; Y515-I519 PolarHBondContact O-N 3.17Å; Y515-L546 HydrophobicContact CD1-CD2 3.82Å; Y515-L546 HydrophobicContact CD2-CD2 3.99Å; Y515-L546 HydrophobicContact CE1-CD2 3.68Å; Y515-L546 HydrophobicContact CE2-CD2 3.83Å; Y515-L546 HydrophobicContact CG-CD2 3.99Å; Y515-L549 HydrophobicContact CD1-CD1 3.67Å; Y515-L549 HydrophobicContact CE1-CD1 3.72Å; Y515-L549 HydrophobicContact CE1-CD2 4.07Å
516	V	84.1	Confident	84.3	Confident	20 Å²	20	24.5 Å²	24.5	12%	0.121	14%	0.136	C	C	.	.	H	α-helix	trans	-55.8	-48.6	173.2	175.2	0	0	0	0	110.8	T401 I512 E513 E514 R518 I519 G520 L549	T401-V516 HydrophobicContact CG2-CB 4.31Å; T401-V516 HydrophobicContact CG2-CG1 4.09Å; T401-V516 HydrophobicContact CG2-CG2 3.82Å; I512-V516 WeakPolarHBondContact O-CG2 3.44Å; I512-V516 PolarHBondContact O-N 2.77Å; I512-V516 VanDerWaalsContact O-N 3.09Å; E513-V516 PolarHBondContact O-N 2.81Å; E514-V516 VanDerWaalsContact C-N 3.33Å; E514-V516 PolarHBondContact O-N 2.72Å; V516-R518 VanDerWaalsContact C-N 3.3Å; V516-R518 PolarHBondContact O-N 2.78Å; V516-I519 PolarHBondContact O-N 2.88Å; V516-G520 PolarHBondContact O-N 3.07Å; V516-L549 HydrophobicContact CG2-CD1 3.76Å
517	H	79.4	Confident	83.5	Confident	9 Å²	9	26.4 Å²	26.4	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-67.1	-24.3	-179.7	-70.4	129.8	0	0	0	115.1	A373 E513 E514 Y515 R521	A373-H517 WeakPolarHBondContact CB-NE2 3.41Å; E513-H517 PolarHBondContact O-N 3.09Å; E513-H517 VanDerWaalsContact O-N 3.1Å; E513-H517 PolarHBondContact O-ND1 3.16Å; E514-H517 CarbonylContact O-C 3.54Å; E514-H517 PolarHBondContact O-N 3.26Å; E514-H517 VanDerWaalsContact O-N 3.07Å; Y515-H517 VanDerWaalsContact C-N 3.35Å; Y515-H517 PolarHBondContact O-N 3.13Å; H517-R521 PolarHBondContact O-NE 2.77Å; H517-R521 PolarHBondContact O-NH2 3.16Å
518	R	86.9	Confident	83	Confident	7 Å²	7	30.9 Å²	30.9	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-78.1	-51.5	174.1	-68.5	-173.9	-179.1	-169.4	3.8	111.8	F437 N505 D507 E514 Y515 V516 G520 R521	F437-R518 HydrophobicContact CD1-CB 4.39Å; F437-R518 HydrophobicContact CD1-CG 3.72Å; F437-R518 HydrophobicContact CD2-CB 4.13Å; F437-R518 HydrophobicContact CD2-CG 4.33Å; F437-R518 HydrophobicContact CE1-CB 4.04Å; F437-R518 HydrophobicContact CE1-CG 3.48Å; F437-R518 VanDerWaalsContact CE1-CG 3.48Å; F437-R518 HydrophobicContact CE2-CB 3.77Å; F437-R518 HydrophobicContact CE2-CG 4.14Å; F437-R518 HydrophobicContact CG-CB 4.41Å; F437-R518 HydrophobicContact CG-CG 4.12Å; F437-R518 HydrophobicContact CZ-CB 3.72Å; F437-R518 HydrophobicContact CZ-CG 3.71Å; N505-R518 WeakPolarHBondContact OD1-CD 3.42Å; N505-R518 PolarHBondContact OD1-NH1 2.8Å; N505-R518 VanDerWaalsContact OD1-NH1 3.1Å; D507-R518 PolarHBondContact O-NH1 3.37Å; E514-R518 HydrophobicContact CG-CG 4.05Å; E514-R518 VanDerWaalsContact O-CG 3.31Å; E514-R518 WeakPolarHBondContact O-CG 3.45Å; E514-R518 PolarHBondContact O-N 3.09Å; E514-R518 IonicContact OE1-CZ 3.67Å; E514-R518 IonicContact OE1-NE 3.11Å; E514-R518 PolarHBondContact OE1-NE 2.62Å; E514-R518 IonicContact OE1-NH2 3.24Å; E514-R518 PolarHBondContact OE1-NH2 2.96Å; Y515-R518 PolarHBondContact O-N 3.24Å; V516-R518 VanDerWaalsContact C-N 3.3Å; V516-R518 PolarHBondContact O-N 2.78Å; R518-G520 VanDerWaalsContact C-N 3.29Å; R518-G520 PolarHBondContact O-N 3.18Å; R518-R521 WeakPolarHBondContact O-CB 3.4Å; R518-R521 VanDerWaalsContact O-CG 3.28Å; R518-R521 WeakPolarHBondContact O-CG 3.43Å; R518-R521 PolarHBondContact O-N 2.68Å
519	I	88	Confident	82.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-32.1	-179.2	73.9	170.4	0	0	0	111.4	T401 I405 Q407 Y515 V516 R521 T522 A531	T401-I519 HydrophobicContact CG2-CD1 3.69Å; T401-I519 HydrophobicContact CG2-CG1 4.32Å; I405-I519 HydrophobicContact CD1-CD1 4.46Å; I405-I519 HydrophobicContact CD1-CG1 4.19Å; I405-I519 HydrophobicContact CG2-CB 4.46Å; I405-I519 HydrophobicContact CG2-CD1 4.29Å; Q407-I519 HydrophobicContact CG-CD1 3.95Å; Q407-I519 VanDerWaalsContact OE1-CD1 3.28Å; Y515-I519 HydrophobicContact CD2-CG2 4.37Å; Y515-I519 HydrophobicContact CE1-CD1 3.87Å; Y515-I519 HydrophobicContact CE1-CG2 4.34Å; Y515-I519 HydrophobicContact CE2-CG2 3.92Å; Y515-I519 PolarHBondContact O-N 3.17Å; V516-I519 PolarHBondContact O-N 2.88Å; I519-R521 PolarHBondContact O-N 3.17Å; I519-T522 VanDerWaalsContact O-CG2 3.29Å; I519-T522 WeakPolarHBondContact O-CG2 3.24Å; I519-T522 PolarHBondContact O-N 2.84Å; I519-A531 HydrophobicContact CB-CB 3.85Å; I519-A531 HydrophobicContact CG2-CB 3.72Å
520	G	81.9	Confident	82.9	Confident	7 Å²	7	34.3 Å²	34.3	7%	0.072	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	8.2	171.3	0	0	0	0	0	115.6	T219 V516 R518 R524	T219-G520 PolarHBondContact OG1-O 3.43Å; V516-G520 PolarHBondContact O-N 3.07Å; R518-G520 VanDerWaalsContact C-N 3.29Å; R518-G520 PolarHBondContact O-N 3.18Å; G520-R524 VanDerWaalsContact O-CZ 3.26Å; G520-R524 PolarHBondContact O-NE 3.27Å; G520-R524 PolarHBondContact O-NH2 2.91Å
521	R	83.1	Confident	83.2	Confident	6 Å²	6	29.6 Å²	29.6	2%	0.023	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.3	163.6	-56.7	-62.8	133.4	-175.2	-2.1	112.4	E338 L435 F437 L495 V503 H517 R518 I519	E338-R521 IonicContact OE1-NH2 3.19Å; L435-R521 HydrophobicContact CD2-CB 3.75Å; L435-R521 HydrophobicContact CD2-CG 3.93Å; F437-R521 HydrophobicContact CE2-CG 4.48Å; F437-R521 HydrophobicContact CZ-CG 4.09Å; L495-R521 WeakPolarHBondContact O-CD 3.48Å; L495-R521 PolarHBondContact O-NH1 3.34Å; V503-R521 HydrophobicContact CG2-CB 4.2Å; H517-R521 PolarHBondContact O-NE 2.77Å; H517-R521 PolarHBondContact O-NH2 3.16Å; R518-R521 WeakPolarHBondContact O-CB 3.4Å; R518-R521 VanDerWaalsContact O-CG 3.28Å; R518-R521 WeakPolarHBondContact O-CG 3.43Å; R518-R521 PolarHBondContact O-N 2.68Å; I519-R521 PolarHBondContact O-N 3.17Å
522	T	85.8	Confident	83.7	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.018	14%	0.141	C	C	.	.	S	Bend	trans	-102.7	-176.6	165	-167.9	0	0	0	0	111.1	I405 V500 K501 V503 I519 R524 G529	I405-T522 HydrophobicContact CG1-CG2 4.35Å; I405-T522 HydrophobicContact CG2-CG2 4.1Å; V500-T522 VanDerWaalsContact O-CB 3.25Å; V500-T522 WeakPolarHBondContact O-CB 3.35Å; V500-T522 PolarHBondContact O-OG1 2.86Å; K501-T522 PolarHBondContact O-OG1 3.2Å; V503-T522 HydrophobicContact CB-CG2 4.38Å; V503-T522 HydrophobicContact CG2-CG2 3.85Å; I519-T522 VanDerWaalsContact O-CG2 3.29Å; I519-T522 WeakPolarHBondContact O-CG2 3.24Å; I519-T522 PolarHBondContact O-N 2.84Å; T522-R524 VanDerWaalsContact C-N 3.33Å; T522-R524 PolarHBondContact O-N 3.3Å; T522-G529 WeakPolarHBondContact OG1-CA 3.24Å
523	G	79.5	Confident	84.2	Confident	5 Å²	5	24.6 Å²	24.6	5%	0.052	13%	0.13	C	C	.	.	S	Bend	trans	71.5	18	177.1	0	0	0	0	0	115.6	N527	G523-N527 CarbonylContact C-O 3.25Å; G523-N527 VanDerWaalsContact C-O 3.3Å; G523-N527 VanDerWaalsContact CA-O 3.27Å; G523-N527 WeakPolarHBondContact CA-O 3.18Å
524	R	76.5	Confident	85	Confident	32 Å²	32	21.3 Å²	21.3	12%	0.121	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-87.1	143.7	-168.7	-65	-174.5	172	-160.2	-4.8	113.1	D496 G520 T522 G526 N527	D496-R524 IonicContact OD1-CZ 3.63Å; D496-R524 IonicContact OD1-NH1 2.71Å; D496-R524 PolarHBondContact OD1-NH1 2.84Å; G520-R524 VanDerWaalsContact O-CZ 3.26Å; G520-R524 PolarHBondContact O-NE 3.27Å; G520-R524 PolarHBondContact O-NH2 2.91Å; T522-R524 VanDerWaalsContact C-N 3.33Å; T522-R524 PolarHBondContact O-N 3.3Å; R524-G526 VanDerWaalsContact C-N 3.27Å; R524-G526 PolarHBondContact O-N 3.39Å; R524-N527 WeakPolarHBondContact O-CB 3.25Å; R524-N527 PolarHBondContact O-N 3.12Å; R524-N527 VanDerWaalsContact O-N 3.08Å; R524-N527 PolarHBondContact O-ND2 3.13Å
525	V	68.5	Low	85.6	Confident	60 Å²	60	20.2 Å²	20.2	36%	0.364	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	54.1	39.2	175	-157.3	0	0	0	0	112.9	A146 G147 F150 Y153 N527	A146-V525 HydrophobicContact CB-CG1 4.45Å; G147-V525 WeakPolarHBondContact CA-O 3.13Å; G147-V525 PolarHBondContact N-O 3.5Å; F150-V525 HydrophobicContact CD2-CG1 4.37Å; F150-V525 HydrophobicContact CE2-CG1 4.34Å; Y153-V525 PolarHBondContact OH-N 3.43Å; V525-N527 VanDerWaalsContact C-N 3.26Å; V525-N527 PolarHBondContact O-N 3.36Å
526	G	69.6	Low	85.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	72.8	12	-179.6	0	0	0	0	0	115.3	G147 I148 N149 Y153 R524	G147-G526 CarbonylContact C-O 3.56Å; G147-G526 VanDerWaalsContact C-O 3.25Å; G147-G526 WeakPolarHBondContact CA-O 3.43Å; I148-G526 PolarHBondContact N-O 3.01Å; N149-G526 WeakPolarHBondContact CB-O 3.44Å; N149-G526 PolarHBondContact N-O 3.08Å; Y153-G526 PolarHBondContact OH-N 3.34Å; R524-G526 VanDerWaalsContact C-N 3.27Å; R524-G526 PolarHBondContact O-N 3.39Å
527	N	78	Confident	86.2	Confident	62 Å²	62	23.4 Å²	23.4	33%	0.332	13%	0.126	S	C	.	.			trans	-79.6	141.5	164	-63.9	-75	0	0	0	109.1	G147 G523 R524 V525	G147-N527 WeakPolarHBondContact CA-OD1 3.44Å; G523-N527 CarbonylContact C-O 3.25Å; G523-N527 VanDerWaalsContact C-O 3.3Å; G523-N527 VanDerWaalsContact CA-O 3.27Å; G523-N527 WeakPolarHBondContact CA-O 3.18Å; R524-N527 WeakPolarHBondContact O-CB 3.25Å; R524-N527 PolarHBondContact O-N 3.12Å; R524-N527 VanDerWaalsContact O-N 3.08Å; R524-N527 PolarHBondContact O-ND2 3.13Å; V525-N527 VanDerWaalsContact C-N 3.26Å; V525-N527 PolarHBondContact O-N 3.36Å
528	L	86	Confident	86.7	Confident	116 Å²	116	29.6 Å²	29.6	61%	0.607	15%	0.153	S	C	*	.			trans	-68.8	147.4	169.3	-69.4	174.7	0	0	0	110.4	N149 N404	N149-L528 WeakPolarHBondContact ND2-CD2 3.45Å; N404-L528 WeakPolarHBondContact O-CA 3.38Å
529	G	88.3	Confident	86.8	Confident	2 Å²	2	30 Å²	30	2%	0.021	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.1	178.4	0	0	0	0	0	112.6	N404 I405 T406 T522	N404-G529 PolarHBondContact O-N 2.91Å; I405-G529 CarbonylContact C-O 3.3Å; I405-G529 WeakPolarHBondContact CA-O 3.41Å; T406-G529 PolarHBondContact N-O 3.17Å; T522-G529 WeakPolarHBondContact OG1-CA 3.24Å
530	L	93.1	Very high	86.9	Confident	86 Å²	86	36.7 Å²	36.7	45%	0.45	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.3	172.3	-58.3	-178.6	0	0	0	109.9	K501 H502 V503	K501-L530 PolarHBondContact O-N 3.21Å; H502-L530 CarbonylContact C-O 3.56Å; H502-L530 WeakPolarHBondContact CA-O 3.46Å; H502-L530 HydrophobicContact CB-CB 4.42Å; H502-L530 PolarHBondContact CD2-O 3.34Å; V503-L530 PolarHBondContact N-O 3.18Å
531	A	94.1	Very high	87.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	103.4	173.8	0	0	0	0	0	110.2	I405 T406 Q407 T408 V503 I519	I405-A531 HydrophobicContact CG2-CB 3.54Å; T406-A531 PolarHBondContact O-N 3.25Å; Q407-A531 WeakPolarHBondContact CA-O 3.44Å; Q407-A531 HydrophobicContact CG-CB 4.24Å; T408-A531 PolarHBondContact N-O 3.4Å; V503-A531 CarbonylContact O-C 3.57Å; V503-A531 WeakPolarHBondContact O-CA 3.19Å; I519-A531 HydrophobicContact CB-CB 3.85Å; I519-A531 HydrophobicContact CG2-CB 3.72Å
532	T	96.3	Very high	87.7	Confident	10 Å²	10	41.4 Å²	41.4	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.6	175.4	-52.4	0	0	0	0	109.9	T408 L410 L424 H502 V503 I504 N505	T408-T532 CarbonylContact O-C 3.57Å; T408-T532 VanDerWaalsContact O-CA 3.32Å; T408-T532 WeakPolarHBondContact O-CA 3.3Å; L410-T532 HydrophobicContact CD1-CG2 3.67Å; L410-T532 HydrophobicContact CG-CG2 4.1Å; L424-T532 HydrophobicContact CD1-CG2 3.79Å; H502-T532 PolarHBondContact NE2-OG1 2.86Å; V503-T532 PolarHBondContact O-N 2.68Å; I504-T532 CarbonylContact C-O 3.56Å; I504-T532 VanDerWaalsContact CA-O 3.27Å; I504-T532 WeakPolarHBondContact CA-O 3.42Å; N505-T532 PolarHBondContact N-O 3.38Å
533	S	96.8	Very high	87.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.8	-178.4	-55.5	0	0	0	0	112	T408 L410 N505	T408-S533 PolarHBondContact O-N 3.06Å; L410-S533 PolarHBondContact N-O 3.36Å; N505-S533 PolarHBondContact ND2-OG 3.01Å
534	F	97.3	Very high	88.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	122.1	174.9	-62.4	-15.7	0	0	0	109.7	L410 V412 K417 T420 L421 L424 I504 N505 Y506 L508	L410-F534 HydrophobicContact CD1-CE1 4.38Å; V412-F534 HydrophobicContact CB-CB 4.11Å; V412-F534 HydrophobicContact CB-CD1 4.25Å; V412-F534 HydrophobicContact CB-CG 4.1Å; V412-F534 HydrophobicContact CG2-CB 4.23Å; V412-F534 HydrophobicContact CG2-CD1 3.58Å; V412-F534 HydrophobicContact CG2-CE1 4.1Å; V412-F534 HydrophobicContact CG2-CG 3.95Å; K417-F534 HydrophobicContact CB-CD2 3.96Å; K417-F534 HydrophobicContact CB-CE2 4.16Å; K417-F534 HydrophobicContact CD-CD2 4.27Å; K417-F534 HydrophobicContact CG-CB 4.44Å; K417-F534 HydrophobicContact CG-CD2 3.76Å; K417-F534 HydrophobicContact CG-CE2 4.44Å; K417-F534 HydrophobicContact CG-CG 4.44Å; K417-F534 WeakPolarHBondContact O-CE2 3.44Å; T420-F534 HydrophobicContact CG2-CE1 3.7Å; T420-F534 HydrophobicContact CG2-CZ 3.81Å; L421-F534 HydrophobicContact CB-CE2 4.24Å; L421-F534 HydrophobicContact CB-CZ 4.32Å; L424-F534 HydrophobicContact CD1-CE1 3.7Å; L424-F534 HydrophobicContact CD1-CZ 3.88Å; I504-F534 HydrophobicContact CG2-CZ 4.43Å; N505-F534 PolarHBondContact O-N 3.24Å; Y506-F534 HydrophobicContact CD2-CD2 4.08Å; Y506-F534 AromaticContact CD2-CE2 3.79Å; Y506-F534 HydrophobicContact CD2-CE2 3.79Å; Y506-F534 HydrophobicContact CE2-CE2 4.39Å; Y506-F534 HydrophobicContact CG-CD2 4.3Å; Y506-F534 HydrophobicContact CG-CE2 4.42Å; L508-F534 WeakPolarHBondContact CD1-O 3.47Å; L508-F534 WeakPolarHBondContact CG-O 3.3Å
535	F	96.7	Very high	89	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	138	-179.8	-171.9	-74.6	0	0	0	109.5	I409 L410 W411 V412 L508 N539 A543 L546 W560 L561 I564	I409-F535 HydrophobicContact CG2-CB 3.75Å; I409-F535 HydrophobicContact CG2-CD2 4.38Å; I409-F535 HydrophobicContact CG2-CG 4.35Å; L410-F535 PolarHBondContact O-N 3Å; W411-F535 WeakPolarHBondContact CA-O 3.41Å; W411-F535 AromaticContact CE3-CD1 3.81Å; W411-F535 HydrophobicContact CE3-CD1 3.81Å; W411-F535 HydrophobicContact CE3-CE1 4.33Å; W411-F535 AromaticContact CZ3-CD1 3.64Å; W411-F535 HydrophobicContact CZ3-CD1 3.64Å; W411-F535 AromaticContact CZ3-CE1 3.72Å; W411-F535 HydrophobicContact CZ3-CE1 3.72Å; V412-F535 PolarHBondContact N-O 3.16Å; L508-F535 HydrophobicContact CD1-CB 4.05Å; L508-F535 HydrophobicContact CD1-CD2 3.58Å; L508-F535 HydrophobicContact CD1-CE2 4.46Å; L508-F535 HydrophobicContact CD1-CG 4.2Å; F535-N539 HydrophobicContact CD2-CB 3.85Å; F535-N539 HydrophobicContact CE1-CB 4.42Å; F535-N539 HydrophobicContact CE2-CB 3.71Å; F535-N539 VanDerWaalsContact CE2-O 3.29Å; F535-N539 WeakPolarHBondContact CE2-O 3.29Å; F535-N539 HydrophobicContact CG-CB 4.27Å; F535-N539 HydrophobicContact CZ-CB 4.01Å; F535-N539 VanDerWaalsContact CZ-O 3.32Å; F535-N539 WeakPolarHBondContact CZ-O 3.05Å; F535-A543 HydrophobicContact CE2-CB 4.32Å; F535-A543 HydrophobicContact CZ-CB 4.02Å; F535-L546 HydrophobicContact CD2-CD1 4Å; F535-L546 HydrophobicContact CE2-CD1 4.04Å; F535-W560 HydrophobicContact CB-CH2 3.84Å; F535-W560 HydrophobicContact CB-CZ3 4.43Å; F535-W560 AromaticContact CD1-CH2 3.85Å; F535-W560 HydrophobicContact CD1-CH2 3.85Å; F535-W560 AromaticContact CD1-CZ3 3.56Å; F535-W560 HydrophobicContact CD1-CZ3 3.56Å; F535-W560 AromaticContact CE1-CZ3 3.95Å; F535-W560 HydrophobicContact CE1-CZ3 3.95Å; F535-W560 AromaticContact CG-CH2 3.84Å; F535-W560 HydrophobicContact CG-CH2 3.84Å; F535-W560 AromaticContact CG-CZ3 3.96Å; F535-W560 HydrophobicContact CG-CZ3 3.96Å; F535-L561 HydrophobicContact CD2-CD1 4.21Å; F535-L561 HydrophobicContact CE2-CD1 3.83Å; F535-L561 HydrophobicContact CZ-CD1 4.01Å; F535-I564 HydrophobicContact CE1-CD1 4.04Å
536	N	93.1	Very high	90.1	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	22%	0.22	C	C	.	.			trans	-145.7	-172.6	168.5	66.1	46.6	0	0	0	111.4	E414 K538 N539	E414-N536 VanDerWaalsContact CD-ND2 3.32Å; E414-N536 PolarHBondContact OE1-ND2 3.28Å; N536-K538 PolarHBondContact O-N 2.99Å; N536-K538 WeakPolarHBondContact OD1-CB 3.49Å; N536-K538 WeakPolarHBondContact OD1-CG 3.29Å; N536-K538 PolarHBondContact OD1-N 3.42Å; N536-N539 PolarHBondContact N-OD1 2.91Å; N536-N539 VanDerWaalsContact N-OD1 3.16Å; N536-N539 PolarHBondContact O-N 3.05Å
537	D	90.6	Very high	91.1	Very high	82 Å²	82	46.4 Å²	46.4	44%	0.439	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-55.8	-23.9	-176.1	-94.1	-7.8	0	0	0	115.6	W411 N539 R540	W411-D537 WeakPolarHBondContact CH2-OD1 3.45Å; D537-N539 VanDerWaalsContact C-N 3.27Å; D537-N539 PolarHBondContact O-N 3.29Å; D537-R540 VanDerWaalsContact CG-NH2 3.28Å; D537-R540 WeakPolarHBondContact O-CG 3.23Å; D537-R540 IonicContact OD1-CZ 2.74Å; D537-R540 IonicContact OD1-NE 2.91Å; D537-R540 PolarHBondContact OD1-NE 3.48Å; D537-R540 IonicContact OD1-NH2 2.64Å; D537-R540 PolarHBondContact OD1-NH2 2.78Å; D537-R540 IonicContact OD2-NH2 3.52Å; D537-R540 PolarHBondContact OD2-NH2 3.28Å
538	K	89.9	Confident	91.6	Very high	139 Å²	139	48.1 Å²	48.1	60%	0.604	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-67.5	-28.1	173.7	-60.2	177.5	-174.5	169.4	0	112.8	E414 N536	E414-K538 WeakPolarHBondContact OE1-CD 3.18Å; E414-K538 VanDerWaalsContact OE1-CE 3.22Å; E414-K538 WeakPolarHBondContact OE1-CE 3.49Å; E414-K538 IonicContact OE1-NZ 3.23Å; E414-K538 PolarHBondContact OE1-NZ 3.05Å; E414-K538 IonicContact OE2-NZ 3.55Å; N536-K538 PolarHBondContact O-N 2.99Å; N536-K538 WeakPolarHBondContact OD1-CB 3.49Å; N536-K538 WeakPolarHBondContact OD1-CG 3.29Å; N536-K538 PolarHBondContact OD1-N 3.42Å
539	N	90.4	Very high	91.6	Very high	16 Å²	16	43.5 Å²	43.5	9%	0.086	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-94.1	9.1	-171.6	-49.7	118.3	0	0	0	113.4	L508 F535 N536 D537 N541 L542 A543	L508-N539 HydrophobicContact CD1-CB 3.98Å; F535-N539 HydrophobicContact CD2-CB 3.85Å; F535-N539 HydrophobicContact CE1-CB 4.42Å; F535-N539 HydrophobicContact CE2-CB 3.71Å; F535-N539 VanDerWaalsContact CE2-O 3.29Å; F535-N539 WeakPolarHBondContact CE2-O 3.29Å; F535-N539 HydrophobicContact CG-CB 4.27Å; F535-N539 HydrophobicContact CZ-CB 4.01Å; F535-N539 VanDerWaalsContact CZ-O 3.32Å; F535-N539 WeakPolarHBondContact CZ-O 3.05Å; N536-N539 PolarHBondContact N-OD1 2.91Å; N536-N539 VanDerWaalsContact N-OD1 3.16Å; N536-N539 PolarHBondContact O-N 3.05Å; D537-N539 VanDerWaalsContact C-N 3.27Å; D537-N539 PolarHBondContact O-N 3.29Å; N539-N541 VanDerWaalsContact C-OD1 3.3Å; N539-N541 WeakPolarHBondContact CA-OD1 3.28Å; N539-N541 PolarHBondContact O-N 2.91Å; N539-N541 VanDerWaalsContact O-N 3.08Å; N539-N541 PolarHBondContact O-OD1 2.93Å; N539-L542 PolarHBondContact O-N 3.47Å; N539-A543 PolarHBondContact O-N 2.95Å
540	R	89.7	Confident	91.7	Very high	140 Å²	140	43.4 Å²	43.4	53%	0.528	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-26.8	177.9	-73.6	179.2	-179.2	-149.1	9.8	113.5	D537 L542 A543 I564	D537-R540 VanDerWaalsContact CG-NH2 3.28Å; D537-R540 WeakPolarHBondContact O-CG 3.23Å; D537-R540 IonicContact OD1-CZ 2.74Å; D537-R540 IonicContact OD1-NE 2.91Å; D537-R540 PolarHBondContact OD1-NE 3.48Å; D537-R540 IonicContact OD1-NH2 2.64Å; D537-R540 PolarHBondContact OD1-NH2 2.78Å; D537-R540 IonicContact OD2-NH2 3.52Å; D537-R540 PolarHBondContact OD2-NH2 3.28Å; R540-L542 VanDerWaalsContact C-N 3.34Å; R540-L542 PolarHBondContact O-N 3.35Å; R540-A543 WeakPolarHBondContact O-CB 3.44Å; R540-A543 PolarHBondContact O-N 2.93Å; R540-I564 HydrophobicContact CG-CG2 4.25Å
541	N	89.7	Confident	91.4	Very high	103 Å²	103	44.3 Å²	44.3	55%	0.551	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-38.1	173	66.8	-41.8	0	0	0	112.9	S510 N539	S510-N541 PolarHBondContact O-ND2 3.26Å; S510-N541 VanDerWaalsContact O-ND2 3.08Å; N539-N541 VanDerWaalsContact C-OD1 3.3Å; N539-N541 WeakPolarHBondContact CA-OD1 3.28Å; N539-N541 PolarHBondContact O-N 2.91Å; N539-N541 VanDerWaalsContact O-N 3.08Å; N539-N541 PolarHBondContact O-OD1 2.93Å
542	L	90.9	Very high	90.9	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15	179.5	-72	-169.7	0	0	0	113.9	L508 P509 I512 N539 R540 R544 G545 L546	L508-L542 HydrophobicContact CB-CD1 4.38Å; P509-L542 HydrophobicContact CG-CD1 4.28Å; P509-L542 WeakPolarHBondContact O-CD1 3.37Å; I512-L542 HydrophobicContact CB-CD2 4.35Å; N539-L542 PolarHBondContact O-N 3.47Å; R540-L542 VanDerWaalsContact C-N 3.34Å; R540-L542 PolarHBondContact O-N 3.35Å; L542-R544 PolarHBondContact O-N 3.02Å; L542-R544 VanDerWaalsContact O-N 3.09Å; L542-G545 PolarHBondContact O-N 3.42Å; L542-L546 HydrophobicContact CB-CD1 3.96Å; L542-L546 HydrophobicContact CB-CG 4.26Å; L542-L546 PolarHBondContact O-N 3.02Å
543	A	91.6	Very high	90.1	Very high	2 Å²	2	47 Å²	47	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-50.6	-42.9	-171.8	0	0	0	0	0	112.9	F535 N539 R540 V547 L561 I564 T565	F535-A543 HydrophobicContact CE2-CB 4.32Å; F535-A543 HydrophobicContact CZ-CB 4.02Å; N539-A543 PolarHBondContact O-N 2.95Å; R540-A543 WeakPolarHBondContact O-CB 3.44Å; R540-A543 PolarHBondContact O-N 2.93Å; A543-V547 WeakPolarHBondContact O-CG2 3.05Å; A543-V547 PolarHBondContact O-N 2.72Å; A543-L561 HydrophobicContact CB-CD1 4.04Å; A543-I564 HydrophobicContact CB-CB 4.48Å; A543-I564 HydrophobicContact CB-CG2 3.71Å; A543-T565 HydrophobicContact CB-CG2 4.07Å
544	R	90.7	Very high	89.6	Confident	170 Å²	170	53.6 Å²	53.6	64%	0.642	25%	0.254	S	S	*	.	H	α-helix	trans	-65.9	-49.6	177.8	-177.9	177.7	170.6	174	-2.1	112.8	L542 L546 V547 E548 T565	L542-R544 PolarHBondContact O-N 3.02Å; L542-R544 VanDerWaalsContact O-N 3.09Å; R544-L546 VanDerWaalsContact C-N 3.3Å; R544-L546 PolarHBondContact O-N 3.44Å; R544-V547 PolarHBondContact O-N 2.82Å; R544-E548 IonicContact CZ-OE1 3.76Å; R544-E548 IonicContact NE-OE1 2.68Å; R544-E548 PolarHBondContact NE-OE1 3.38Å; R544-E548 IonicContact NH2-OE1 3.15Å; R544-E548 PolarHBondContact NH2-OE1 3.22Å; R544-E548 WeakPolarHBondContact O-CG 3.41Å; R544-E548 PolarHBondContact O-N 2.74Å; R544-T565 HydrophobicContact CB-CG2 4.31Å
545	G	88.5	Confident	89.2	Confident	21 Å²	21	55.2 Å²	55.2	22%	0.216	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-37	179.9	0	0	0	0	0	112.2	L542 L549	L542-G545 PolarHBondContact O-N 3.42Å; G545-L549 WeakPolarHBondContact O-CB 3.22Å; G545-L549 PolarHBondContact O-N 3.05Å
546	L	90.9	Very high	88.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-41.7	173.8	-70.6	170	0	0	0	112.1	L508 I512 Y515 F535 L542 R544 L550 L561	L508-L546 HydrophobicContact CD1-CD1 4.18Å; I512-L546 HydrophobicContact CD1-CD2 3.81Å; I512-L546 HydrophobicContact CD1-CG 4.04Å; Y515-L546 HydrophobicContact CD1-CD2 3.82Å; Y515-L546 HydrophobicContact CD2-CD2 3.99Å; Y515-L546 HydrophobicContact CE1-CD2 3.68Å; Y515-L546 HydrophobicContact CE2-CD2 3.83Å; Y515-L546 HydrophobicContact CG-CD2 3.99Å; F535-L546 HydrophobicContact CD2-CD1 4Å; F535-L546 HydrophobicContact CE2-CD1 4.04Å; L542-L546 HydrophobicContact CB-CD1 3.96Å; L542-L546 HydrophobicContact CB-CG 4.26Å; L542-L546 PolarHBondContact O-N 3.02Å; R544-L546 VanDerWaalsContact C-N 3.3Å; R544-L546 PolarHBondContact O-N 3.44Å; L546-L550 VanDerWaalsContact O-CB 3.28Å; L546-L550 WeakPolarHBondContact O-CB 3.4Å; L546-L550 WeakPolarHBondContact O-CD1 3.49Å; L546-L550 WeakPolarHBondContact O-CG 3.48Å; L546-L550 PolarHBondContact O-N 3.42Å; L546-L561 HydrophobicContact CB-CD2 4.37Å
547	V	91.3	Very high	88.8	Confident	11 Å²	11	60.7 Å²	60.7	7%	0.067	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-47.9	175.4	171.9	0	0	0	0	111.3	A543 R544 L549 L550 E551 I557 L561 K562 T565	A543-V547 WeakPolarHBondContact O-CG2 3.05Å; A543-V547 PolarHBondContact O-N 2.72Å; R544-V547 PolarHBondContact O-N 2.82Å; V547-L549 VanDerWaalsContact C-N 3.28Å; V547-L549 PolarHBondContact O-N 3.36Å; V547-L550 PolarHBondContact O-N 2.7Å; V547-E551 HydrophobicContact CG1-CG 4.28Å; V547-E551 WeakPolarHBondContact O-CB 3.06Å; V547-E551 WeakPolarHBondContact O-CG 3.32Å; V547-E551 PolarHBondContact O-N 3.38Å; V547-I557 HydrophobicContact CG2-CG2 4.34Å; V547-L561 HydrophobicContact CG2-CD2 3.96Å; V547-L561 HydrophobicContact CG2-CG 3.77Å; V547-K562 HydrophobicContact CG2-CG 4.48Å; V547-T565 HydrophobicContact CB-CG2 4.36Å; V547-T565 HydrophobicContact CG2-CG2 3.89Å
548	E	87.6	Confident	88.9	Confident	99 Å²	99	57.7 Å²	57.7	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-59.7	-38.7	179	-70.5	179.3	-175.3	0	0	111.8	R544 E552	R544-E548 IonicContact CZ-OE1 3.76Å; R544-E548 IonicContact NE-OE1 2.68Å; R544-E548 PolarHBondContact NE-OE1 3.38Å; R544-E548 IonicContact NH2-OE1 3.15Å; R544-E548 PolarHBondContact NH2-OE1 3.22Å; R544-E548 WeakPolarHBondContact O-CG 3.41Å; R544-E548 PolarHBondContact O-N 2.74Å; E548-E552 WeakPolarHBondContact O-CB 3.13Å; E548-E552 PolarHBondContact O-N 3.05Å
549	L	86.7	Confident	89	Confident	18 Å²	18	56.3 Å²	56.3	9%	0.094	29%	0.293	C	S	.	.	H	α-helix	trans	-69.8	-44.3	175.8	179.8	166.1	0	0	0	113	T401 Q407 I512 Y515 V516 G545 V547 E552 A553	T401-L549 HydrophobicContact CG2-CD1 3.79Å; T401-L549 HydrophobicContact CG2-CD2 3.86Å; T401-L549 HydrophobicContact CG2-CG 3.92Å; Q407-L549 VanDerWaalsContact OE1-CD2 3.24Å; I512-L549 HydrophobicContact CD1-CD1 3.97Å; I512-L549 HydrophobicContact CG1-CD1 4.22Å; Y515-L549 HydrophobicContact CD1-CD1 3.67Å; Y515-L549 HydrophobicContact CE1-CD1 3.72Å; Y515-L549 HydrophobicContact CE1-CD2 4.07Å; V516-L549 HydrophobicContact CG2-CD1 3.76Å; G545-L549 WeakPolarHBondContact O-CB 3.22Å; G545-L549 PolarHBondContact O-N 3.05Å; V547-L549 VanDerWaalsContact C-N 3.28Å; V547-L549 PolarHBondContact O-N 3.36Å; L549-E552 PolarHBondContact O-N 3.45Å; L549-A553 WeakPolarHBondContact O-CB 3.24Å; L549-A553 PolarHBondContact O-N 3.41Å
550	L	89.5	Confident	89.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-72.4	-33.7	-177.9	-69.7	166.8	0	0	0	112.3	Q407 I409 L546 V547 E552 N554 Q555 I557 L561	Q407-L550 HydrophobicContact CB-CD2 3.59Å; Q407-L550 HydrophobicContact CG-CD2 4.38Å; I409-L550 HydrophobicContact CD1-CD1 4.44Å; I409-L550 HydrophobicContact CG1-CD1 3.76Å; L546-L550 VanDerWaalsContact O-CB 3.28Å; L546-L550 WeakPolarHBondContact O-CB 3.4Å; L546-L550 WeakPolarHBondContact O-CD1 3.49Å; L546-L550 WeakPolarHBondContact O-CG 3.48Å; L546-L550 PolarHBondContact O-N 3.42Å; V547-L550 PolarHBondContact O-N 2.7Å; L550-E552 VanDerWaalsContact C-N 3.34Å; L550-N554 PolarHBondContact O-N 3.45Å; L550-Q555 HydrophobicContact CB-CB 4.23Å; L550-Q555 HydrophobicContact CD2-CB 3.6Å; L550-Q555 HydrophobicContact CD2-CG 3.99Å; L550-Q555 PolarHBondContact O-N 3.29Å; L550-I557 HydrophobicContact CB-CD1 4.14Å; L550-I557 HydrophobicContact CB-CG1 3.59Å; L550-I557 HydrophobicContact CD1-CG1 4.33Å; L550-L561 HydrophobicContact CD1-CD2 4.08Å
551	E	87.7	Confident	89.1	Confident	105 Å²	105	52.5 Å²	52.5	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-40.8	171.4	-73.4	-169.6	157.7	0	0	111	V547 N554 I557 K562	V547-E551 HydrophobicContact CG1-CG 4.28Å; V547-E551 WeakPolarHBondContact O-CB 3.06Å; V547-E551 WeakPolarHBondContact O-CG 3.32Å; V547-E551 PolarHBondContact O-N 3.38Å; E551-N554 PolarHBondContact O-N 3.2Å; E551-I557 HydrophobicContact CB-CD1 4.23Å; E551-I557 HydrophobicContact CG-CD1 3.25Å; E551-K562 WeakPolarHBondContact OE1-CE 3.25Å; E551-K562 IonicContact OE1-NZ 3.87Å; E551-K562 PolarHBondContact OE1-NZ 3.43Å
552	E	82	Confident	89	Confident	62 Å²	62	51.7 Å²	51.7	29%	0.29	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-43.6	177.1	178.9	173.4	162.8	0	0	113.1	R397 S400 E548 L549 L550 N554	R397-E552 VanDerWaalsContact CD-OE1 3.31Å; R397-E552 WeakPolarHBondContact CD-OE1 3.42Å; R397-E552 VanDerWaalsContact CZ-CD 3.5Å; R397-E552 IonicContact CZ-OE1 2.71Å; R397-E552 IonicContact CZ-OE2 3.16Å; R397-E552 IonicContact NE-OE1 3.38Å; R397-E552 IonicContact NE-OE2 3.68Å; R397-E552 IonicContact NH1-OE1 3.34Å; R397-E552 PolarHBondContact NH1-OE1 3.39Å; R397-E552 IonicContact NH1-OE2 3.62Å; R397-E552 PolarHBondContact NH1-OE2 3.45Å; R397-E552 IonicContact NH2-OE2 3.54Å; R397-E552 PolarHBondContact NH2-OE2 2.8Å; S400-E552 VanDerWaalsContact CB-OE1 3.26Å; S400-E552 WeakPolarHBondContact CB-OE1 3.22Å; S400-E552 PolarHBondContact OG-OE1 3.5Å; E548-E552 WeakPolarHBondContact O-CB 3.13Å; E548-E552 PolarHBondContact O-N 3.05Å; L549-E552 PolarHBondContact O-N 3.45Å; L550-E552 VanDerWaalsContact C-N 3.34Å; E552-N554 PolarHBondContact O-N 3.12Å; E552-N554 PolarHBondContact O-ND2 3.13Å
553	A	81.4	Confident	88.9	Confident	6 Å²	6	53.6 Å²	53.6	5%	0.05	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	10.5	179.7	0	0	0	0	0	113.8	L549 Q555	L549-A553 WeakPolarHBondContact O-CB 3.24Å; L549-A553 PolarHBondContact O-N 3.41Å; A553-Q555 HydrophobicContact CB-CG 3.77Å; A553-Q555 WeakPolarHBondContact O-CG 3.39Å; A553-Q555 PolarHBondContact O-N 3.34Å; A553-Q555 PolarHBondContact O-NE2 3.43Å
554	N	85.7	Confident	88.7	Confident	137 Å²	137	55.6 Å²	55.6	73%	0.733	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	35.4	-177.6	-62.9	-76.6	0	0	0	114.1	L550 E551 E552	L550-N554 PolarHBondContact O-N 3.45Å; E551-N554 PolarHBondContact O-N 3.2Å; E552-N554 PolarHBondContact O-N 3.12Å; E552-N554 PolarHBondContact O-ND2 3.13Å
555	Q	88.5	Confident	88.3	Confident	35 Å²	35	50.1 Å²	50.1	16%	0.164	28%	0.282	C	S	.	.			trans	-91	160.6	-174.7	-61.3	-60.6	-58.1	0	0	112.8	I405 Q407 L550 A553 I557	I405-Q555 PolarHBondContact O-OE1 2.96Å; Q407-Q555 HydrophobicContact CB-CB 4.49Å; Q407-Q555 HydrophobicContact CB-CG 4.08Å; Q407-Q555 HydrophobicContact CG-CG 4.35Å; L550-Q555 HydrophobicContact CB-CB 4.23Å; L550-Q555 HydrophobicContact CD2-CB 3.6Å; L550-Q555 HydrophobicContact CD2-CG 3.99Å; L550-Q555 PolarHBondContact O-N 3.29Å; A553-Q555 HydrophobicContact CB-CG 3.77Å; A553-Q555 WeakPolarHBondContact O-CG 3.39Å; A553-Q555 PolarHBondContact O-N 3.34Å; A553-Q555 PolarHBondContact O-NE2 3.43Å; Q555-I557 PolarHBondContact O-N 3.02Å
556	A	90.2	Very high	87.4	Confident	84 Å²	84	51.9 Å²	51.9	69%	0.694	30%	0.3	S	S	*	.			trans	-73.9	109.7	176.8	0	0	0	0	0	111.2
557	I	91.7	Very high	85.8	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.174	34%	0.336	C	S	.	.			trans	-94	124.4	-177.1	-59	155.5	0	0	0	110.3	V547 L550 E551 Q555 L561 K562	V547-I557 HydrophobicContact CG2-CG2 4.34Å; L550-I557 HydrophobicContact CB-CD1 4.14Å; L550-I557 HydrophobicContact CB-CG1 3.59Å; L550-I557 HydrophobicContact CD1-CG1 4.33Å; E551-I557 HydrophobicContact CB-CD1 4.23Å; E551-I557 HydrophobicContact CG-CD1 3.25Å; Q555-I557 PolarHBondContact O-N 3.02Å; I557-L561 HydrophobicContact CG2-CD2 4.39Å; I557-K562 VanDerWaalsContact CD1-CE 3.5Å; I557-K562 HydrophobicContact CG2-CD 4.24Å; I557-K562 HydrophobicContact CG2-CG 3.66Å
558	P	92.5	Very high	83.7	Confident	20 Å²	20	60.6 Å²	60.6	13%	0.13	36%	0.359	C	S	.	.			trans	-62.2	134.9	176.1	-21.6	32.4	0	0	0	112.1	I409 W560 L561 K562	I409-P558 HydrophobicContact CB-CG 4.21Å; I409-P558 WeakPolarHBondContact O-CG 3.41Å; P558-W560 HydrophobicContact CB-CD2 4.07Å; P558-W560 VanDerWaalsContact CB-CE2 3.46Å; P558-W560 HydrophobicContact CB-CG 4.2Å; P558-W560 HydrophobicContact CB-CZ2 3.85Å; P558-W560 VanDerWaalsContact CB-NE1 3.28Å; P558-W560 HydrophobicContact CG-CZ2 3.92Å; P558-W560 PolarHBondContact O-N 2.82Å; P558-L561 HydrophobicContact CB-CB 4.35Å; P558-L561 WeakPolarHBondContact O-CB 3.37Å; P558-L561 PolarHBondContact O-N 2.96Å; P558-K562 PolarHBondContact O-N 3.4Å
559	P	91.2	Very high	81.5	Confident	109 Å²	109	66.7 Å²	66.7	71%	0.708	38%	0.378	S	S	*	.	H	α-helix	trans	-57.2	-35.5	-179.2	-28.3	35.7	0	0	0	114.1	L561 K562 A563	P559-L561 VanDerWaalsContact C-N 3.29Å; P559-L561 PolarHBondContact O-N 3.22Å; P559-K562 PolarHBondContact O-N 2.88Å; P559-A563 PolarHBondContact O-N 2.84Å
560	W	92.3	Very high	79.1	Confident	76 Å²	76	71.6 Å²	71.6	29%	0.288	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-31.2	176.6	60.5	-105.2	0	0	0	112.6	I409 W411 F535 P558 A563 I564	I409-W560 HydrophobicContact CG2-CH2 3.76Å; I409-W560 HydrophobicContact CG2-CZ2 4.19Å; W411-W560 HydrophobicContact CB-CZ2 4.09Å; W411-W560 HydrophobicContact CE3-CD2 4.17Å; W411-W560 AromaticContact CE3-CE3 3.62Å; W411-W560 HydrophobicContact CE3-CE3 3.62Å; W411-W560 HydrophobicContact CE3-CH2 4.09Å; W411-W560 AromaticContact CE3-CZ3 3.59Å; W411-W560 HydrophobicContact CE3-CZ3 3.59Å; W411-W560 HydrophobicContact CZ3-CE3 4.04Å; W411-W560 HydrophobicContact CZ3-CZ3 4.02Å; F535-W560 HydrophobicContact CB-CH2 3.84Å; F535-W560 HydrophobicContact CB-CZ3 4.43Å; F535-W560 AromaticContact CD1-CH2 3.85Å; F535-W560 HydrophobicContact CD1-CH2 3.85Å; F535-W560 AromaticContact CD1-CZ3 3.56Å; F535-W560 HydrophobicContact CD1-CZ3 3.56Å; F535-W560 AromaticContact CE1-CZ3 3.95Å; F535-W560 HydrophobicContact CE1-CZ3 3.95Å; F535-W560 AromaticContact CG-CH2 3.84Å; F535-W560 HydrophobicContact CG-CH2 3.84Å; F535-W560 AromaticContact CG-CZ3 3.96Å; F535-W560 HydrophobicContact CG-CZ3 3.96Å; P558-W560 HydrophobicContact CB-CD2 4.07Å; P558-W560 VanDerWaalsContact CB-CE2 3.46Å; P558-W560 HydrophobicContact CB-CG 4.2Å; P558-W560 HydrophobicContact CB-CZ2 3.85Å; P558-W560 VanDerWaalsContact CB-NE1 3.28Å; P558-W560 HydrophobicContact CG-CZ2 3.92Å; P558-W560 PolarHBondContact O-N 2.82Å; W560-A563 PolarHBondContact O-N 2.86Å; W560-I564 HydrophobicContact CE3-CD1 3.83Å; W560-I564 HydrophobicContact CZ3-CD1 4.14Å; W560-I564 WeakPolarHBondContact O-CG1 3.47Å; W560-I564 PolarHBondContact O-N 3.09Å; W560-I564 VanDerWaalsContact O-N 3.12Å
561	L	90.9	Very high	76.8	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	45%	0.447	C	S	.	.	H	α-helix	trans	-70.7	-39.2	179	-172.7	66.5	0	0	0	110.5	I409 F535 A543 L546 V547 L550 I557 P558 P559 I564 T565	I409-L561 HydrophobicContact CG1-CD2 4.48Å; F535-L561 HydrophobicContact CD2-CD1 4.21Å; F535-L561 HydrophobicContact CE2-CD1 3.83Å; F535-L561 HydrophobicContact CZ-CD1 4.01Å; A543-L561 HydrophobicContact CB-CD1 4.04Å; L546-L561 HydrophobicContact CB-CD2 4.37Å; V547-L561 HydrophobicContact CG2-CD2 3.96Å; V547-L561 HydrophobicContact CG2-CG 3.77Å; L550-L561 HydrophobicContact CD1-CD2 4.08Å; I557-L561 HydrophobicContact CG2-CD2 4.39Å; P558-L561 HydrophobicContact CB-CB 4.35Å; P558-L561 WeakPolarHBondContact O-CB 3.37Å; P558-L561 PolarHBondContact O-N 2.96Å; P559-L561 VanDerWaalsContact C-N 3.29Å; P559-L561 PolarHBondContact O-N 3.22Å; L561-I564 PolarHBondContact O-N 2.69Å; L561-T565 PolarHBondContact O-N 3.08Å
562	K	88.3	Confident	74.4	Confident	86 Å²	86	79.3 Å²	79.3	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-39.6	172	-64.4	-157	178.3	-165	0	112.1	V547 E551 I557 P558 P559 I564 T565 G566	V547-K562 HydrophobicContact CG2-CG 4.48Å; E551-K562 WeakPolarHBondContact OE1-CE 3.25Å; E551-K562 IonicContact OE1-NZ 3.87Å; E551-K562 PolarHBondContact OE1-NZ 3.43Å; I557-K562 VanDerWaalsContact CD1-CE 3.5Å; I557-K562 HydrophobicContact CG2-CD 4.24Å; I557-K562 HydrophobicContact CG2-CG 3.66Å; P558-K562 PolarHBondContact O-N 3.4Å; P559-K562 PolarHBondContact O-N 2.88Å; K562-I564 PolarHBondContact O-N 3Å; K562-T565 PolarHBondContact O-N 2.94Å; K562-T565 VanDerWaalsContact O-N 3.12Å; K562-T565 PolarHBondContact O-OG1 3.05Å; K562-G566 PolarHBondContact O-N 3.09Å
563	A	88.7	Confident	72.4	Confident	51 Å²	51	82.5 Å²	82.5	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-57.6	-46.2	175.7	0	0	0	0	0	112.1	P559 W560 T565 G566 D567	P559-A563 PolarHBondContact O-N 2.84Å; W560-A563 PolarHBondContact O-N 2.86Å; A563-T565 PolarHBondContact O-N 3.31Å; A563-G566 WeakPolarHBondContact O-CA 3.37Å; A563-G566 PolarHBondContact O-N 3.09Å; A563-D567 PolarHBondContact O-N 3.04Å
564	I	86.1	Confident	70.3	Confident	44 Å²	44	90.7 Å²	90.7	23%	0.226	52%	0.515	C	S	.	.	H	α-helix	trans	-57.6	-35.7	176.2	-66.9	165.7	0	0	0	112.1	W411 F535 R540 A543 W560 L561 K562	W411-I564 HydrophobicContact CH2-CD1 4.44Å; W411-I564 HydrophobicContact CZ3-CD1 3.7Å; F535-I564 HydrophobicContact CE1-CD1 4.04Å; R540-I564 HydrophobicContact CG-CG2 4.25Å; A543-I564 HydrophobicContact CB-CB 4.48Å; A543-I564 HydrophobicContact CB-CG2 3.71Å; W560-I564 HydrophobicContact CE3-CD1 3.83Å; W560-I564 HydrophobicContact CZ3-CD1 4.14Å; W560-I564 WeakPolarHBondContact O-CG1 3.47Å; W560-I564 PolarHBondContact O-N 3.09Å; W560-I564 VanDerWaalsContact O-N 3.12Å; L561-I564 PolarHBondContact O-N 2.69Å; K562-I564 PolarHBondContact O-N 3Å
565	T	83.1	Confident	68.3	Low	54 Å²	54	94.7 Å²	94.7	33%	0.331	52%	0.52	S	S	.	.	H	α-helix	trans	-76.5	-24.1	174.8	61.9	0	0	0	0	114	A543 R544 V547 L561 K562 A563	A543-T565 HydrophobicContact CB-CG2 4.07Å; R544-T565 HydrophobicContact CB-CG2 4.31Å; V547-T565 HydrophobicContact CB-CG2 4.36Å; V547-T565 HydrophobicContact CG2-CG2 3.89Å; L561-T565 PolarHBondContact O-N 3.08Å; K562-T565 PolarHBondContact O-N 2.94Å; K562-T565 VanDerWaalsContact O-N 3.12Å; K562-T565 PolarHBondContact O-OG1 3.05Å; A563-T565 PolarHBondContact O-N 3.31Å
566	G	69	Low	65.9	Low	59 Å²	59	98.8 Å²	98.8	61%	0.608	55%	0.549	S	S	*	.	H	α-helix	trans	-84.1	-36.1	179.4	0	0	0	0	0	114.3	K562 A563 G568	K562-G566 PolarHBondContact O-N 3.09Å; A563-G566 WeakPolarHBondContact O-CA 3.37Å; A563-G566 PolarHBondContact O-N 3.09Å; G566-G568 PolarHBondContact O-N 3.1Å
567	D	58.2	Low	63.3	Low	139 Å²	139	107 Å²	107	74%	0.743	56%	0.562	S	S	*	*	S	Bend	trans	-72.6	-6.2	179	-75.4	-34.1	0	0	0	113.6	A563 R569	A563-D567 PolarHBondContact O-N 3.04Å; D567-R569 VanDerWaalsContact C-N 3.28Å; D567-R569 PolarHBondContact O-N 2.74Å
568	G	46.4	Very low	60.8	Low	54 Å²	54	111.7 Å²	111.7	56%	0.557	59%	0.588	S	S	*	*	S	Bend	trans	-65.4	83	167.3	0	0	0	0	0	111.6	G566	G566-G568 PolarHBondContact O-N 3.1Å
569	R	40.7	Very low	58.2	Low	227 Å²	227	118.7 Å²	118.7	86%	0.857	62%	0.624	S	S	*	*			trans	-36.1	128.8	176.2	-80.6	-176.4	172.7	179.6	-1.5	111.2	D567 T571	D567-R569 VanDerWaalsContact C-N 3.28Å; D567-R569 PolarHBondContact O-N 2.74Å; R569-T571 PolarHBondContact O-N 2.81Å
570	P	37.3	Very low	55.8	Low	121 Å²	121	121.8 Å²	121.8	79%	0.786	62%	0.622	S	S	*	*			trans	-60.4	113.2	173.9	25.5	-33.1	0	0	0	108.7	N572	P570-N572 PolarHBondContact O-N 2.72Å
571	T	41.5	Very low	53.3	Low	123 Å²	123	130 Å²	130	76%	0.755	65%	0.653	S	S	*	*			trans	-65.2	100.9	172.3	40.2	0	0	0	0	107.1	R569 I573	R569-T571 PolarHBondContact O-N 2.81Å; T571-I573 PolarHBondContact O-N 3.35Å
572	N	36.3	Very low	50.6	Low	145 Å²	145	134 Å²	134	78%	0.775	69%	0.694	S	S	*	*			trans	-77.3	46.3	-166.5	-158.7	7.4	0	0	0	112.6	P570 Q574	P570-N572 PolarHBondContact O-N 2.72Å; N572-Q574 PolarHBondContact O-N 3.44Å
573	I	41.4	Very low	48.3	Very low	129 Å²	129	133 Å²	133	66%	0.662	71%	0.708	S	S	*	*			trans	-80.8	104.7	171	-58.3	177.8	0	0	0	106.2	T571 R575	T571-I573 PolarHBondContact O-N 3.35Å; I573-R575 VanDerWaalsContact C-N 3.28Å; I573-R575 HydrophobicContact CG2-CG 4.37Å; I573-R575 PolarHBondContact O-N 2.89Å
574	Q	37.1	Very low	45.9	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	73%	0.732	S	S	*	*			trans	-65.4	81.7	-179.7	-65.5	176.3	-13.9	0	0	111.5	N572	N572-Q574 PolarHBondContact O-N 3.44Å
575	R	43.9	Very low	44.1	Very low	222 Å²	222	141.2 Å²	141.2	84%	0.838	75%	0.748	S	S	*	*			trans	-82.4	136.8	165.6	-74.1	-172.3	168	-170.3	-3.7	109.5	I573 R577	I573-R575 VanDerWaalsContact C-N 3.28Å; I573-R575 HydrophobicContact CG2-CG 4.37Å; I573-R575 PolarHBondContact O-N 2.89Å; R575-R577 PolarHBondContact O-N 3.29Å
576	P	37	Very low	42.8	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	75%	0.753	S	S	*	*			trans	-60.3	133.9	-170.1	-26.1	35	0	0	0	113.5	N578	P576-N578 VanDerWaalsContact C-N 3.31Å; P576-N578 PolarHBondContact O-N 3.46Å
577	R	36	Very low	42.3	Very low	255 Å²	255	146.3 Å²	146.3	96%	0.962	76%	0.755	S	S	*	*			trans	-63	87.3	169.9	-93.4	-178.7	161.2	173.4	-5.2	110.4	R575	R575-R577 PolarHBondContact O-N 3.29Å
578	N	39.1	Very low	42.5	Very low	134 Å²	134	139.8 Å²	139.8	72%	0.717	72%	0.72	S	S	*	*			trans	-96.6	97	171.5	-141.5	-24.8	0	0	0	108.9	P576 R580	P576-N578 VanDerWaalsContact C-N 3.31Å; P576-N578 PolarHBondContact O-N 3.46Å; N578-R580 PolarHBondContact O-N 3.05Å
579	N	37.2	Very low	43.4	Very low	167 Å²	167	140.8 Å²	140.8	89%	0.893	71%	0.707	S	S	*	*			trans	-73.9	96.2	-165.7	-150.9	15	0	0	0	111.1
580	R	41.8	Very low	44.9	Very low	173 Å²	173	133.9 Å²	133.9	65%	0.653	68%	0.681	S	S	*	*			trans	-132.3	130.8	170.8	-68	-168.1	-176.3	169.7	8.3	110.5	N578	N578-R580 PolarHBondContact O-N 3.05Å
581	R	40.2	Very low	46	Very low	250 Å²	250	131.9 Å²	131.9	94%	0.943	66%	0.661	S	S	*	*			trans	-56.4	148.3	177.3	-77.3	173.3	160.9	166.2	-8.5	111.1
582	G	34.2	Very low	46.6	Very low	83 Å²	83	130.6 Å²	130.6	86%	0.856	65%	0.653	S	S	*	*			trans	-65	168	-177.7	0	0	0	0	0	114.7
583	G	38.3	Very low	47	Very low	65 Å²	65	129.2 Å²	129.2	67%	0.67	65%	0.652	S	S	*	*			trans	154.8	50.2	-175.1	0	0	0	0	0	111.7
584	F	38.2	Very low	47	Very low	212 Å²	212	128.9 Å²	128.9	93%	0.93	66%	0.661	S	S	*	*			trans	-94.2	140.5	179.3	-122.9	-101.6	0	0	0	110
585	G	49.8	Very low	47.3	Very low	55 Å²	55	130.1 Å²	130.1	57%	0.567	66%	0.658	S	S	*	*	S	Bend	trans	100.5	-10	166.4	0	0	0	0	0	118.8
586	A	55.7	Low	47.1	Very low	53 Å²	53	122.7 Å²	122.7	44%	0.438	65%	0.65	S	S	.	*			trans	-140.8	26	-169.9	0	0	0	0	0	116	V398	V398-A586 HydrophobicContact CG2-CB 4.43Å
587	R	57.3	Low	47.1	Very low	168 Å²	168	121.7 Å²	121.7	63%	0.634	65%	0.653	S	S	*	*			trans	-122	119	-174.4	-151.2	174.2	-159.1	147.4	6.4	113	Y589 Q591	R587-Y589 PolarHBondContact O-N 3.41Å; R587-Q591 HydrophobicContact CG-CB 4.44Å
588	D	62.1	Low	47.1	Very low	2 Å²	2	117.4 Å²	117.4	1%	0.011	65%	0.649	C	S	.	*			trans	-54.2	130.1	171.6	-176	-22.5	0	0	0	111.1	F392 R590 Q591	F392-D588 HydrophobicContact CD1-CB 3.86Å; F392-D588 HydrophobicContact CE1-CB 4.38Å; F392-D588 HydrophobicContact CG-CB 4.33Å; D588-R590 PolarHBondContact O-N 2.86Å; D588-R590 VanDerWaalsContact O-N 3.16Å; D588-R590 VanDerWaalsContact OD1-CB 3.23Å; D588-R590 WeakPolarHBondContact OD1-CB 3.49Å; D588-R590 VanDerWaalsContact OD1-CG 3.23Å; D588-R590 WeakPolarHBondContact OD1-CG 3.37Å; D588-R590 PolarHBondContact OD1-N 2.88Å; D588-R590 IonicContact OD1-NE 3.89Å; D588-R590 PolarHBondContact OD1-NE 3.08Å; D588-R590 IonicContact OD2-CZ 2.71Å; D588-R590 IonicContact OD2-NE 3.09Å; D588-R590 PolarHBondContact OD2-NE 3.44Å; D588-R590 IonicContact OD2-NH2 2.76Å; D588-R590 PolarHBondContact OD2-NH2 2.94Å; D588-Q591 HydrophobicContact CB-CG 4.26Å; D588-Q591 WeakPolarHBondContact O-CB 3.44Å; D588-Q591 PolarHBondContact O-N 3.11Å
589	Y	65.9	Low	47.2	Very low	74 Å²	74	116.7 Å²	116.7	29%	0.29	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-58.5	-28	179.7	66.8	-95.8	0	0	0	112.4	K384 Y390 R587 Q591 T592	K384-Y589 HydrophobicContact CB-CE1 4.06Å; K384-Y589 WeakPolarHBondContact CB-OH 3.3Å; K384-Y589 HydrophobicContact CD-CE2 4.48Å; K384-Y589 WeakPolarHBondContact CG-OH 3.42Å; Y390-Y589 VanDerWaalsContact OH-CE1 3.26Å; Y390-Y589 WeakPolarHBondContact OH-CE1 3.46Å; R587-Y589 PolarHBondContact O-N 3.41Å; Y589-Q591 PolarHBondContact O-N 3.06Å; Y589-T592 WeakPolarHBondContact O-CB 3.47Å; Y589-T592 PolarHBondContact O-N 3.5Å; Y589-T592 PolarHBondContact O-OG1 2.84Å
590	R	72.1	Confident	47.4	Very low	83 Å²	83	113.9 Å²	113.9	31%	0.313	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-64.2	-18.1	176.1	-58.5	178.7	-62.7	177	4.2	113	T161 Y390 D588	T161-R590 PolarHBondContact O-NH2 3.18Å; Y390-R590 PolarHBondContact O-NH1 3.02Å; Y390-R590 PolarHBondContact O-NH2 3.45Å; Y390-R590 VanDerWaalsContact O-NH2 3.07Å; D588-R590 PolarHBondContact O-N 2.86Å; D588-R590 VanDerWaalsContact O-N 3.16Å; D588-R590 VanDerWaalsContact OD1-CB 3.23Å; D588-R590 WeakPolarHBondContact OD1-CB 3.49Å; D588-R590 VanDerWaalsContact OD1-CG 3.23Å; D588-R590 WeakPolarHBondContact OD1-CG 3.37Å; D588-R590 PolarHBondContact OD1-N 2.88Å; D588-R590 IonicContact OD1-NE 3.89Å; D588-R590 PolarHBondContact OD1-NE 3.08Å; D588-R590 IonicContact OD2-CZ 2.71Å; D588-R590 IonicContact OD2-NE 3.09Å; D588-R590 PolarHBondContact OD2-NE 3.44Å; D588-R590 IonicContact OD2-NH2 2.76Å; D588-R590 PolarHBondContact OD2-NH2 2.94Å
591	Q	61.3	Low	47.3	Very low	79 Å²	79	113.5 Å²	113.5	37%	0.369	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-91.8	1.6	174.4	-58.5	-176.8	20.3	0	0	113.5	T161 R587 D588 Y589 P593	T161-Q591 PolarHBondContact OG1-NE2 3.14Å; R587-Q591 HydrophobicContact CG-CB 4.44Å; D588-Q591 HydrophobicContact CB-CG 4.26Å; D588-Q591 WeakPolarHBondContact O-CB 3.44Å; D588-Q591 PolarHBondContact O-N 3.11Å; Y589-Q591 PolarHBondContact O-N 3.06Å; Q591-P593 VanDerWaalsContact O-CD 3.29Å; Q591-P593 WeakPolarHBondContact O-CD 3.47Å
592	T	53.7	Low	47.4	Very low	96 Å²	96	112.8 Å²	112.8	59%	0.589	66%	0.656	S	S	*	*	S	Bend	trans	-74	118.6	172.6	60.8	0	0	0	0	109.5	Y589 S594	Y589-T592 WeakPolarHBondContact O-CB 3.47Å; Y589-T592 PolarHBondContact O-N 3.5Å; Y589-T592 PolarHBondContact O-OG1 2.84Å; T592-S594 PolarHBondContact O-N 2.88Å; T592-S594 VanDerWaalsContact O-N 3.11Å
593	P	43.7	Very low	47.5	Very low	116 Å²	116	114.8 Å²	114.8	75%	0.753	65%	0.654	S	S	*	*			trans	-69.6	115.7	178.7	-16.4	31.3	0	0	0	108.7	Q591 R595	Q591-P593 VanDerWaalsContact O-CD 3.29Å; Q591-P593 WeakPolarHBondContact O-CD 3.47Å; P593-R595 PolarHBondContact O-N 3.32Å
594	S	43.3	Very low	48	Very low	121 Å²	121	118.2 Å²	118.2	85%	0.846	66%	0.662	S	S	*	*			trans	-58	106.7	172.6	-174.1	0	0	0	0	108.8	T592 G596	T592-S594 PolarHBondContact O-N 2.88Å; T592-S594 VanDerWaalsContact O-N 3.11Å; S594-G596 PolarHBondContact O-N 3.21Å
595	R	43	Very low	48.1	Very low	204 Å²	204	111.6 Å²	111.6	77%	0.77	65%	0.654	S	S	*	*			trans	-74.5	93.2	-178.8	-85.3	-174.2	159.5	-138.4	-10.5	108.6	P593 A597	P593-R595 PolarHBondContact O-N 3.32Å; R595-A597 PolarHBondContact O-N 3.27Å
596	G	38.7	Very low	47.6	Very low	65 Å²	65	115.2 Å²	115.2	67%	0.67	67%	0.667	S	S	*	*			trans	-46.2	131.8	177	0	0	0	0	0	112.1	S594 N598	S594-G596 PolarHBondContact O-N 3.21Å; G596-N598 VanDerWaalsContact C-N 3.3Å; G596-N598 PolarHBondContact O-N 3.37Å
597	A	36.8	Very low	47	Very low	101 Å²	101	119 Å²	119	84%	0.835	69%	0.685	S	S	*	*			trans	-75.8	76.6	-173.6	0	0	0	0	0	111.7	R595 S599	R595-A597 PolarHBondContact O-N 3.27Å; A597-S599 PolarHBondContact O-N 3.42Å
598	N	37.6	Very low	46.3	Very low	165 Å²	165	116.2 Å²	116.2	88%	0.882	69%	0.691	S	S	*	*			trans	-69.1	81.9	168.1	-102.7	14.2	0	0	0	110	G596 S600	G596-N598 VanDerWaalsContact C-N 3.3Å; G596-N598 PolarHBondContact O-N 3.37Å; N598-S600 PolarHBondContact O-N 3.2Å
599	S	40.3	Very low	45.3	Very low	119 Å²	119	126.6 Å²	126.6	83%	0.832	73%	0.73	S	S	*	*			trans	-68.5	106.8	171	-170.2	0	0	0	0	109.3	A597 N601	A597-S599 PolarHBondContact O-N 3.42Å; S599-N601 PolarHBondContact O-N 3.05Å
600	S	42.5	Very low	44.1	Very low	107 Å²	107	129.2 Å²	129.2	75%	0.748	75%	0.749	S	S	*	*			trans	-78.7	119.3	-178.2	57	0	0	0	0	111.3	N598 R602	N598-S600 PolarHBondContact O-N 3.2Å; S600-R602 PolarHBondContact O-N 3.24Å
601	N	38.7	Very low	42.7	Very low	165 Å²	165	135.7 Å²	135.7	88%	0.882	78%	0.775	S	S	*	*			trans	-41.6	131.7	175.5	-89.9	-19.1	0	0	0	114.1	S599	S599-N601 PolarHBondContact O-N 3.05Å
602	R	41.4	Very low	41.5	Very low	236 Å²	236	135.2 Å²	135.2	89%	0.891	79%	0.791	S	S	*	*			trans	-133.7	120.8	152.8	-101.2	-173.7	167.3	-167	-4.7	109	S600	S600-R602 PolarHBondContact O-N 3.24Å
603	P	38.2	Very low	40.9	Very low	125 Å²	125	138.2 Å²	138.2	81%	0.812	80%	0.803	S	S	*	*			trans	-88.1	136.7	-175.1	33.3	-33.6	0	0	0	112.4
604	T	47.4	Very low	40.7	Very low	136 Å²	136	139.8 Å²	139.8	83%	0.834	80%	0.804	S	S	*	*			trans	-144.7	116.7	171.6	50.1	0	0	0	0	112.1
605	G	41.3	Very low	40.3	Very low	74 Å²	74	144 Å²	144	76%	0.763	80%	0.802	S	S	*	*			trans	45.1	111.1	148.7	0	0	0	0	0	121
606	P	38.3	Very low	40	Very low	131 Å²	131	140 Å²	140	85%	0.851	80%	0.796	S	S	*	*			trans	-96.8	117.4	175.4	34.8	-30.6	0	0	0	114.8
607	T	43.3	Very low	39.8	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	80%	0.796	S	S	*	*			trans	-148.8	109.3	156.7	50.1	0	0	0	0	107.5
608	S	42.3	Very low	39.6	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	79%	0.789	S	S	*	*				96.9	132.7	51.2	-174.1	0	0	0	0	111.9
609	R	40.9	Very low	39.4	Very low	220 Å²	220	143.3 Å²	143.3	83%	0.83	79%	0.785	S	S	*	*			trans	75.1	143.3	-175.7	-58.2	-176.5	-177.3	146.6	0.9	115.9
610	D	41.8	Very low	39.3	Very low	129 Å²	129	148.4 Å²	148.4	69%	0.69	79%	0.788	S	S	*	*			cis	-152	-176.3	-10	-113.4	-35	0	0	0	113
611	Y	41.5	Very low	38.7	Very low	219 Å²	219	149.9 Å²	149.9	86%	0.859	79%	0.788	S	S	*	*			trans	-78.7	148	-160.1	-71	-98.5	0	0	0	119.5
612	G	38.1	Very low	38.7	Very low	69 Å²	69	147.1 Å²	147.1	71%	0.711	78%	0.781	S	S	*	*			trans	85.3	164.8	135.7	0	0	0	0	0	118.6
613	L	39.4	Very low	38.3	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	78%	0.778	S	S	*	*			cis	177	152	-26.6	-123	171.6	0	0	0	106.5
614	L	39.3	Very low	38.3	Very low	149 Å²	149	144.3 Å²	144.3	78%	0.78	78%	0.778	S	S	*	*			trans	71	134.3	176.5	-56.8	161.7	0	0	0	114.2
615	R	35.9	Very low	37.5	Very low	210 Å²	210	143.4 Å²	143.4	79%	0.792	78%	0.776	S	S	*	*			cis	77.5	128.6	47.1	-173	-179.4	174.4	-172.9	-5.4	110.5
616	D	37.3	Very low	37.1	Very low	121 Å²	121	145.8 Å²	145.8	65%	0.647	78%	0.781	S	S	*	*			cis	-143.6	-172.9	31.2	-142.6	-31.7	0	0	0	115.1
617	S	34	Very low	37	Very low	97 Å²	97	145.7 Å²	145.7	68%	0.678	78%	0.778	S	S	*	*			trans	-48.1	145.6	175.2	-177.8	0	0	0	0	117.6
618	S	32.8	Very low	36.3	Very low	98 Å²	98	144.8 Å²	144.8	69%	0.685	78%	0.777	S	S	*	*				163.2	162.4	106.8	56.9	0	0	0	0	114.6
619	Y	32.4	Very low	35.9	Very low	205 Å²	205	148.2 Å²	148.2	80%	0.804	78%	0.781	S	S	*	*			trans	53.8	120.5	166.1	-93.6	-98.8	0	0	0	119.6
620	Y	39	Very low	35.4	Very low	226 Å²	226	143.6 Å²	143.6	89%	0.886	78%	0.782	S	S	*	*				-159.2	132.6	110.5	-113.5	-73.4	0	0	0	111.6
621	D	30.4	Very low	35.1	Very low	138 Å²	138	142.5 Å²	142.5	74%	0.738	78%	0.784	S	S	*	*			trans	-87.5	139.8	171.3	-179.1	17.7	0	0	0	109.6
622	S	38.2	Very low	34.8	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	77%	0.774	S	S	*	*			trans	-159.4	132.1	172.2	51.7	0	0	0	0	112.3
623	Q	33.6	Very low	34.6	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.4	145	-175.4	-61.7	173.2	-16.9	0	0	112.4
624	P	36.7	Very low	34.4	Very low	127 Å²	127	144 Å²	144	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-81.2	117.7	165	31.7	-30.8	0	0	0	110.8	S626	P624-S626 PolarHBondContact O-N 2.94Å
625	C	31.5	Very low	34.1	Very low	117 Å²	117	148.6 Å²	148.6	79%	0.791	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67.5	125	171.4	-66.3	0	0	0	0	111.1	V627	C625-V627 PolarHBondContact O-N 3.23Å
626	S	32	Very low	33.8	Very low	123 Å²	123	141.9 Å²	141.9	86%	0.86	79%	0.785	S	S	*	*			trans	-76.6	101.1	174.1	43.2	0	0	0	0	111.5	P624	P624-S626 PolarHBondContact O-N 2.94Å
627	V	36	Very low	33.5	Very low	130 Å²	130	148.1 Å²	148.1	79%	0.788	82%	0.818	S	S	*	*			trans	-82.7	126.3	171.1	178.9	0	0	0	0	109.7	C625	C625-V627 PolarHBondContact O-N 3.23Å
628	S	28.9	Very low	33.5	Very low	114 Å²	114	150.7 Å²	150.7	80%	0.797	83%	0.825	S	S	*	*			trans	-78.4	126.8	177.1	44.5	0	0	0	0	112
629	Q	35	Very low	33.5	Very low	180 Å²	180	153.4 Å²	153.4	84%	0.841	83%	0.832	S	S	*	*			trans	-132.9	111.9	157.6	-74.2	-164.6	-8.6	0	0	110.1	S631	Q629-S631 PolarHBondContact O-N 3.03Å
630	S	30.6	Very low	33.6	Very low	122 Å²	122	150.6 Å²	150.6	85%	0.853	83%	0.834	S	S	*	*			trans	-79.5	107.8	171.9	52.1	0	0	0	0	110.1
631	S	34.5	Very low	33.2	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-82.6	143.8	160.8	-67.4	0	0	0	0	109.6	Q629	Q629-S631 PolarHBondContact O-N 3.03Å
632	P	35.9	Very low	33.4	Very low	99 Å²	99	146.6 Å²	146.6	64%	0.643	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-80.9	134.8	-178.6	30	-31.6	0	0	0	111.8	W634	P632-W634 PolarHBondContact O-N 3.46Å
633	D	33.1	Very low	33.1	Very low	162 Å²	162	149.3 Å²	149.3	87%	0.866	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-68.5	126	167	-76.1	-52	0	0	0	110.7
634	W	36.4	Very low	33.1	Very low	218 Å²	218	147.4 Å²	147.4	83%	0.826	84%	0.844	S	S	*	*			trans	-106	11.4	178.3	-87.2	62	0	0	0	113.9	P632	P632-W634 PolarHBondContact O-N 3.46Å
635	W	32.8	Very low	32.8	Very low	245 Å²	245	149 Å²	149	93%	0.928	85%	0.846	S	S	*	*			trans	-134.1	95.4	180	-62.4	103.7	0	0	0	110.9
636	G	29.2	Very low	32.9	Very low	70 Å²	70	151.7 Å²	151.7	72%	0.722	85%	0.851	S	S	*	*			trans	-134.7	128.6	177	0	0	0	0	0	111.7
637	N	30.5	Very low	33	Very low	251 Å²	251	154.3 Å²	154.3	100%	1.342	85%	0.85	S	S	*	*			trans	69.9	0	-166.9	-60	-28.8	0	0	0	114.9

Retrieved 637 of 637 residues in 295.5 ms (Link to these results)

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