A0A5K4F896_SCHMA Loading...

YTH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F896, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 660 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.7	Very low	43.3	Very low	239 Å²	239	141.7 Å²	141.7	100%	1.177	81%	0.809	S	S	*	*				0	158.5	0	-80.7	179.2	166	0	0	108.7
2	L	48	Very low	43.3	Very low	177 Å²	177	138.2 Å²	138.2	93%	0.927	79%	0.792	S	S	*	*			trans	61.8	84.6	175.8	-59.4	176.9	0	0	0	116
3	C	35.9	Very low	43.2	Very low	137 Å²	137	140.8 Å²	140.8	93%	0.926	79%	0.789	S	S	*	*			trans	-90	156.9	153	-58	0	0	0	0	109.7
4	G	51.5	Low	43.3	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	79%	0.79	S	S	*	*			trans	-133.5	138.5	166.8	0	0	0	0	0	109.9
5	R	38.7	Very low	43.3	Very low	243 Å²	243	135.1 Å²	135.1	92%	0.917	79%	0.793	S	S	*	*			trans	-152.4	174.9	-167.3	-175.3	171.6	173.4	172.1	-0.7	109.9
6	S	42.1	Very low	43.2	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	79%	0.79	S	S	*	*			trans	83	148.9	166	-100.7	0	0	0	0	117.2
7	S	41.2	Very low	43.3	Very low	79 Å²	79	133.9 Å²	133.9	55%	0.552	78%	0.782	S	S	*	*			cis	-172.8	-171.8	-21.8	35.3	0	0	0	0	111.1
8	D	46.5	Very low	43.4	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	77%	0.773	S	S	*	*			trans	87.5	143	147.4	-58.2	-40.4	0	0	0	120.7
9	V	43.6	Very low	43.4	Very low	119 Å²	119	133.4 Å²	133.4	72%	0.721	77%	0.765	S	S	*	*			cis	-168.4	157.7	-20.8	95.2	0	0	0	0	113.7
10	S	42.3	Very low	43.2	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	76%	0.759	S	S	*	*			trans	68.2	161.7	159.6	70.2	0	0	0	0	120.5
11	E	44	Very low	43.2	Very low	136 Å²	136	132.2 Å²	132.2	64%	0.636	75%	0.754	S	S	*	*			cis	-125.5	-132	10.8	-148.2	-118.3	45.2	0	0	114.7	K13	E11-K13 WeakPolarHBondContact OE1-CE 3.29Å; E11-K13 IonicContact OE1-NZ 3.07Å; E11-K13 PolarHBondContact OE1-NZ 3.38Å; E11-K13 IonicContact OE2-NZ 2.78Å; E11-K13 PolarHBondContact OE2-NZ 3.34Å
12	T	42.5	Very low	43.2	Very low	99 Å²	99	127 Å²	127	61%	0.607	74%	0.735	S	S	*	*			trans	-149.2	-172.8	-157	73.8	0	0	0	0	116.2
13	K	42.9	Very low	42.8	Very low	172 Å²	172	123.1 Å²	123.1	75%	0.748	73%	0.728	S	S	*	*			trans	74.5	133	176.4	-51.1	123.6	-170.3	160.3	0	114.9	E11	E11-K13 WeakPolarHBondContact OE1-CE 3.29Å; E11-K13 IonicContact OE1-NZ 3.07Å; E11-K13 PolarHBondContact OE1-NZ 3.38Å; E11-K13 IonicContact OE2-NZ 2.78Å; E11-K13 PolarHBondContact OE2-NZ 3.34Å
14	G	43.9	Very low	43	Very low	79 Å²	79	124.5 Å²	124.5	81%	0.814	72%	0.719	S	S	*	*			cis	171.1	176.1	-1	0	0	0	0	0	107.9
15	S	43	Very low	42.3	Very low	118 Å²	118	126.1 Å²	126.1	83%	0.825	71%	0.708	S	S	*	*			cis	-165.4	-175.7	-7.9	57.1	0	0	0	0	106.5
16	V	43	Very low	42.2	Very low	123 Å²	123	120 Å²	120	75%	0.745	70%	0.703	S	S	*	*			cis	-157.1	-171.5	9.3	82.9	0	0	0	0	111.2
17	L	44.7	Very low	42	Very low	127 Å²	127	120 Å²	120	67%	0.665	71%	0.709	S	S	*	*			trans	-33.3	161.5	167.5	-60	159.6	0	0	0	117.6
18	D	44.4	Very low	41.9	Very low	115 Å²	115	121 Å²	121	62%	0.615	72%	0.716	S	S	*	*			cis	-167.8	174.4	4.8	-114.8	-3.7	0	0	0	108.1
19	K	42.9	Very low	41.4	Very low	143 Å²	143	120.5 Å²	120.5	62%	0.622	71%	0.713	S	S	*	*			cis	176.9	164	-29.7	-122	-160.4	-136.6	82.6	0	105.9
20	N	41.1	Very low	41.2	Very low	121 Å²	121	122.5 Å²	122.5	65%	0.647	71%	0.714	S	S	*	*			trans	65.4	153.5	155.1	-69.1	39.2	0	0	0	119.1
21	D	43.3	Very low	41	Very low	121 Å²	121	123.9 Å²	123.9	65%	0.647	72%	0.719	S	S	*	*			cis	-152.6	131.2	-15.3	-92.9	-26.8	0	0	0	107.6
22	V	41.4	Very low	40.8	Very low	129 Å²	129	120.8 Å²	120.8	78%	0.782	72%	0.724	S	S	*	*				69.4	128.8	89.8	179.4	0	0	0	0	116.5
23	A	40.4	Very low	40.9	Very low	95 Å²	95	122.6 Å²	122.6	79%	0.785	73%	0.725	S	S	*	*			trans	72.7	152.3	162.7	0	0	0	0	0	119.6
24	K	38.5	Very low	40.8	Very low	167 Å²	167	123.6 Å²	123.6	73%	0.726	72%	0.724	S	S	*	*			cis	-170.6	173.5	-26.7	-159.5	173	158.1	-75	0	109.3
25	D	38.6	Very low	40.6	Very low	115 Å²	115	126 Å²	126	62%	0.615	72%	0.719	S	S	*	*			trans	76.1	105	155.4	-64.7	-42.4	0	0	0	122.3
26	S	35.9	Very low	40.6	Very low	114 Å²	114	128.6 Å²	128.6	80%	0.797	72%	0.722	S	S	*	*			trans	9.6	136.3	138.1	59.1	0	0	0	0	122.7
27	A	38.9	Very low	40.4	Very low	103 Å²	103	129.1 Å²	129.1	85%	0.851	72%	0.721	S	S	*	*				-160.6	157.6	125	0	0	0	0	0	113.4
28	S	37.2	Very low	40.3	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	73%	0.733	S	S	*	*			trans	-74.5	-177.2	-169.8	54.4	0	0	0	0	118.2
29	N	38	Very low	39.9	Very low	130 Å²	130	132.7 Å²	132.7	70%	0.695	74%	0.738	S	S	*	*			trans	75.6	149.4	162.7	-69.4	40.8	0	0	0	117.2
30	E	38	Very low	39.4	Very low	160 Å²	160	131 Å²	131	75%	0.748	74%	0.744	S	S	*	*			cis	176.6	152.2	-23.4	-112.7	-176.6	144.6	0	0	105.1
31	T	38.6	Very low	39.1	Very low	134 Å²	134	136.9 Å²	136.9	82%	0.822	76%	0.757	S	S	*	*			trans	131.3	97.1	134.6	-47.8	0	0	0	0	115.4
32	G	40.6	Very low	38.7	Very low	72 Å²	72	136.4 Å²	136.4	74%	0.742	76%	0.759	S	S	*	*			trans	74.8	172.7	137.7	0	0	0	0	0	119.8
33	Q	43.1	Very low	38.4	Very low	137 Å²	137	137.6 Å²	137.6	64%	0.64	76%	0.756	S	S	*	*			cis	-162.7	153.9	-21.3	-141.3	-171	-28.6	0	0	111.5
34	R	40.7	Very low	38.2	Very low	192 Å²	192	139.2 Å²	139.2	73%	0.725	75%	0.752	S	S	*	*			trans	73.1	149.1	161.9	-57.4	170.3	-145.4	125.8	10.6	116.6
35	D	41	Very low	38.5	Very low	130 Å²	130	140.5 Å²	140.5	70%	0.695	76%	0.76	S	S	*	*			cis	163.1	133	-27	-91.4	-35	0	0	0	103.6
36	L	43.3	Very low	38.6	Very low	173 Å²	173	142.6 Å²	142.6	91%	0.906	77%	0.771	S	S	*	*				172.4	125.2	115.1	-90.2	174.1	0	0	0	111.1
37	D	37.5	Very low	38.6	Very low	133 Å²	133	145.6 Å²	145.6	71%	0.711	77%	0.773	S	S	*	*			trans	-71.7	163.6	167.5	-87.8	-81	0	0	0	112.4
38	V	42.5	Very low	38.7	Very low	152 Å²	152	148.2 Å²	148.2	92%	0.921	77%	0.772	S	S	*	*				-164.8	154.9	116.2	140.9	0	0	0	0	109.7
39	K	36.1	Very low	38.7	Very low	166 Å²	166	151.3 Å²	151.3	72%	0.722	78%	0.779	S	S	*	*			trans	-143.6	140.9	-148.8	-167.2	173.8	-172.3	167.4	0	112.3
40	S	33.1	Very low	38.6	Very low	108 Å²	108	149.1 Å²	149.1	76%	0.755	79%	0.788	S	S	*	*			trans	53.4	130.9	158.1	61.7	0	0	0	0	120.7
41	R	35.3	Very low	38.4	Very low	243 Å²	243	152.9 Å²	152.9	92%	0.917	80%	0.795	S	S	*	*				-156.9	-179.1	110.9	-138.1	167.3	173.5	147.1	-3.2	111.7
42	T	33.4	Very low	38.4	Very low	111 Å²	111	151.9 Å²	151.9	68%	0.681	79%	0.793	S	S	*	*			trans	-132.5	167.2	-159.7	49.4	0	0	0	0	112.8
43	Q	36.1	Very low	38.1	Very low	155 Å²	155	155.5 Å²	155.5	72%	0.724	80%	0.796	S	S	*	*			trans	82.5	128.9	157.3	-77	-179.8	-95.3	0	0	119.7
44	D	36.1	Very low	38.1	Very low	129 Å²	129	157 Å²	157	69%	0.69	80%	0.803	S	S	*	*			trans	56.5	134.2	131.1	-41.8	-18.4	0	0	0	120.5
45	E	44.8	Very low	37.8	Very low	194 Å²	194	154.1 Å²	154.1	91%	0.907	80%	0.802	S	S	*	*			trans	-178.1	165.9	130.5	-78.7	-120.6	143.1	0	0	108.9
46	D	41.4	Very low	37.6	Very low	158 Å²	158	155.7 Å²	155.7	85%	0.845	81%	0.805	S	S	*	*			trans	-101.6	157	-150.1	-80	-59.1	0	0	0	119.2
47	E	35.9	Very low	37.2	Very low	178 Å²	178	154.9 Å²	154.9	83%	0.832	80%	0.801	S	S	*	*			trans	20.7	107.9	141	-168.6	179.8	-119.5	0	0	120.2
48	L	41.1	Very low	37.1	Very low	158 Å²	158	154.6 Å²	154.6	83%	0.827	80%	0.799	S	S	*	*			trans	-144.5	111.1	151.5	-82.9	-175.3	0	0	0	114.6
49	L	35.5	Very low	36.7	Very low	165 Å²	165	152.4 Å²	152.4	86%	0.864	79%	0.79	S	S	*	*			trans	44	118.8	138.6	-53	178.1	0	0	0	120.8
50	G	36.4	Very low	36.7	Very low	84 Å²	84	154.4 Å²	154.4	87%	0.866	80%	0.795	S	S	*	*			trans	-168.9	65.7	168.6	0	0	0	0	0	114.5
51	R	34.8	Very low	36.7	Very low	239 Å²	239	156.8 Å²	156.8	90%	0.902	79%	0.794	S	S	*	*			trans	-102.4	107.8	-173.1	-179.1	-174.5	-179.8	175.4	1.4	112.9
52	S	38.4	Very low	36.8	Very low	113 Å²	113	150.9 Å²	150.9	79%	0.79	79%	0.785	S	S	*	*			trans	-158.4	109.7	162.1	54.3	0	0	0	0	111.4
53	D	34.4	Very low	36.7	Very low	148 Å²	148	152.9 Å²	152.9	79%	0.791	79%	0.786	S	S	*	*			trans	-66.1	133.8	158.7	-47.9	-95.2	0	0	0	108.9
54	E	42.7	Very low	36.8	Very low	168 Å²	168	150.3 Å²	150.3	79%	0.785	79%	0.786	S	S	*	*			trans	-163.9	125.7	146.6	-89.2	-123	-177	0	0	111
55	N	34.1	Very low	36.6	Very low	132 Å²	132	151.3 Å²	151.3	71%	0.706	79%	0.791	S	S	*	*			trans	31.5	101	139.6	-53.4	-46.9	0	0	0	118.8
56	H	36.8	Very low	36.3	Very low	163 Å²	163	151 Å²	151	76%	0.755	79%	0.79	S	S	*	*			trans	-134.1	95	150	-119.1	-64.4	0	0	0	111.6	L58	H56-L58 HydrophobicContact CB-CG 4.5Å
57	D	33.8	Very low	35.8	Very low	155 Å²	155	150.5 Å²	150.5	83%	0.829	79%	0.792	S	S	*	*			trans	-69.1	132.9	160.3	-164.4	1.4	0	0	0	108
58	L	36.5	Very low	35.7	Very low	128 Å²	128	145.3 Å²	145.3	67%	0.67	79%	0.786	S	S	*	*			trans	-134	79.9	-173.4	-74.9	178.8	0	0	0	110.8	H56 Y60	H56-L58 HydrophobicContact CB-CG 4.5Å; L58-Y60 PolarHBondContact O-N 3.36Å
59	S	33.2	Very low	35.1	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	79%	0.785	S	S	*	*			trans	-61.5	111.8	163.1	53.9	0	0	0	0	110.5	E61	S59-E61 PolarHBondContact O-N 3.31Å
60	Y	37.4	Very low	35.1	Very low	208 Å²	208	143.3 Å²	143.3	82%	0.816	78%	0.779	S	S	*	*			trans	-81.8	92.3	175.7	40.3	-88.2	0	0	0	111.1	L58 T62	L58-Y60 PolarHBondContact O-N 3.36Å; Y60-T62 PolarHBondContact O-N 3.3Å
61	E	32.8	Very low	35.1	Very low	157 Å²	157	143.3 Å²	143.3	73%	0.734	77%	0.765	S	S	*	*			trans	-76.3	96.1	165.8	-71.8	-161.9	126.5	0	0	110.8	S59 H63	S59-E61 PolarHBondContact O-N 3.31Å; E61-H63 PolarHBondContact O-N 3.45Å
62	T	37	Very low	35	Very low	119 Å²	119	139.9 Å²	139.9	73%	0.73	76%	0.76	S	S	*	*			trans	-85.8	90.3	170.5	-47.6	0	0	0	0	110.3	Y60 S64	Y60-T62 PolarHBondContact O-N 3.3Å; T62-S64 PolarHBondContact O-N 3.46Å
63	H	31.3	Very low	34.7	Very low	153 Å²	153	141.9 Å²	141.9	71%	0.708	75%	0.754	S	S	*	*			trans	-67.4	114.2	168.3	-75.4	-78.7	0	0	0	111	E61	E61-H63 PolarHBondContact O-N 3.45Å
64	S	37.8	Very low	34.6	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	75%	0.748	S	S	*	*			trans	-137.3	112.8	161.1	60.4	0	0	0	0	110.2	T62 E66	T62-S64 PolarHBondContact O-N 3.46Å; S64-E66 PolarHBondContact O-N 3.26Å
65	N	32	Very low	34.2	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	74%	0.74	S	S	*	*			trans	-80.2	115	-174.6	-62.8	-37	0	0	0	111.6
66	E	38.8	Very low	34.1	Very low	189 Å²	189	136.1 Å²	136.1	88%	0.883	74%	0.74	S	S	*	*			trans	-130.2	98.6	157	-72.8	-162.1	162	0	0	110.1	S64 G68	S64-E66 PolarHBondContact O-N 3.26Å; E66-G68 PolarHBondContact O-N 3.13Å
67	T	32.2	Very low	34.1	Very low	146 Å²	146	134.2 Å²	134.2	90%	0.896	74%	0.739	S	S	*	*			trans	-80.3	66.6	178.1	51.4	0	0	0	0	111.2	S69	T67-S69 PolarHBondContact O-N 2.97Å
68	G	32.8	Very low	34.2	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	74%	0.737	S	S	*	*			trans	-85.8	90.4	176.3	0	0	0	0	0	112.5	E66 F70	E66-G68 PolarHBondContact O-N 3.13Å; G68-F70 PolarHBondContact O-N 3.41Å
69	S	29.1	Very low	34	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	75%	0.745	S	S	*	*			trans	-71.2	91.4	175.6	177.9	0	0	0	0	111.5	T67	T67-S69 PolarHBondContact O-N 2.97Å
70	F	35.2	Very low	34.4	Very low	168 Å²	168	137 Å²	137	74%	0.737	75%	0.749	S	S	*	*			trans	-98.8	83.2	173.9	-155.3	-92.4	0	0	0	111.6	G68 F73	G68-F70 PolarHBondContact O-N 3.41Å; F70-F73 AromaticContact CE1-CD2 3.62Å; F70-F73 HydrophobicContact CE1-CD2 3.62Å; F70-F73 HydrophobicContact CE1-CE2 4.26Å; F70-F73 HydrophobicContact CE1-CG 4.46Å; F70-F73 HydrophobicContact CE2-CE2 4.46Å; F70-F73 AromaticContact CZ-CD2 3.54Å; F70-F73 HydrophobicContact CZ-CD2 3.54Å; F70-F73 AromaticContact CZ-CE2 3.74Å; F70-F73 HydrophobicContact CZ-CE2 3.74Å
71	S	35.4	Very low	34.2	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	75%	0.75	S	S	*	*			trans	-72	133.7	169.4	50.5	0	0	0	0	111.3
72	E	32.7	Very low	34.6	Very low	167 Å²	167	134.2 Å²	134.2	78%	0.78	75%	0.753	S	S	*	*			trans	53.6	86.6	139	-164.8	156.7	-143	0	0	118.1
73	F	32.6	Very low	34.7	Very low	155 Å²	155	133.8 Å²	133.8	68%	0.68	75%	0.754	S	S	*	*			trans	-116.2	72	157.2	-90.8	-92.7	0	0	0	110.9	F70 T75	F70-F73 AromaticContact CE1-CD2 3.62Å; F70-F73 HydrophobicContact CE1-CD2 3.62Å; F70-F73 HydrophobicContact CE1-CE2 4.26Å; F70-F73 HydrophobicContact CE1-CG 4.46Å; F70-F73 HydrophobicContact CE2-CE2 4.46Å; F70-F73 AromaticContact CZ-CD2 3.54Å; F70-F73 HydrophobicContact CZ-CD2 3.54Å; F70-F73 AromaticContact CZ-CE2 3.74Å; F70-F73 HydrophobicContact CZ-CE2 3.74Å; F73-T75 PolarHBondContact O-N 3.29Å
74	H	33.5	Very low	35.2	Very low	142 Å²	142	135.9 Å²	135.9	66%	0.657	77%	0.765	S	S	*	*			trans	-81.4	83.8	160.7	-105.7	-88	0	0	0	109.1	A76	H74-A76 PolarHBondContact O-N 3.49Å
75	T	33.4	Very low	35.1	Very low	102 Å²	102	140.8 Å²	140.8	63%	0.626	78%	0.776	S	S	*	*			trans	-90.9	92.7	172.6	-48.9	0	0	0	0	110	F73 V77	F73-T75 PolarHBondContact O-N 3.29Å; T75-V77 HydrophobicContact CG2-CG2 3.9Å
76	A	32.2	Very low	35.4	Very low	84 Å²	84	137.4 Å²	137.4	69%	0.694	78%	0.777	S	S	*	*			trans	-67.9	128.7	156.5	0	0	0	0	0	108.4	H74	H74-A76 PolarHBondContact O-N 3.49Å
77	V	35.7	Very low	35.2	Very low	122 Å²	122	134.7 Å²	134.7	74%	0.739	78%	0.779	S	S	*	*			trans	-112.7	88.3	165.6	-176.6	0	0	0	0	106.7	T75	T75-V77 HydrophobicContact CG2-CG2 3.9Å
78	E	36.9	Very low	35.4	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	77%	0.774	S	S	*	*			trans	-71.2	141.9	166.1	-62.7	-167.3	129.7	0	0	109.2	L80	E78-L80 PolarHBondContact O-N 3.29Å
79	C	32.7	Very low	35.4	Very low	124 Å²	124	135.6 Å²	135.6	84%	0.838	78%	0.78	S	S	*	*			trans	-81.8	82.5	-174.1	-58.6	0	0	0	0	111.5	N81	C79-N81 PolarHBondContact O-N 2.91Å
80	L	40.1	Very low	35.8	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	78%	0.783	S	S	*	*			trans	-82.6	90.5	164.2	-68.7	176.2	0	0	0	110	E78	E78-L80 PolarHBondContact O-N 3.29Å
81	N	35.1	Very low	35.7	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	78%	0.781	S	S	*	*			trans	-88.3	109.3	157.3	-82.7	-3.4	0	0	0	107.6	C79	C79-N81 PolarHBondContact O-N 2.91Å
82	D	40.8	Very low	36	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	80%	0.795	S	S	*	*			trans	-130.9	160.3	164.2	-110.4	-48.9	0	0	0	110.7
83	S	39.3	Very low	36.2	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	79%	0.792	S	S	*	*			trans	-92.6	137.9	-152.4	-52.7	0	0	0	0	114.4
84	E	42	Very low	36.3	Very low	198 Å²	198	136 Å²	136	93%	0.925	79%	0.788	S	S	*	*			trans	-138.1	125.4	144.7	-74.9	-155.9	144.4	0	0	110.6
85	E	35.5	Very low	36.6	Very low	205 Å²	205	139.1 Å²	139.1	96%	0.958	80%	0.8	S	S	*	*			trans	-88.9	121.3	164.9	-68.1	-168.9	148.3	0	0	108.9
86	G	37.2	Very low	36.9	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	81%	0.805	S	S	*	*			trans	-137.2	102.6	-178.6	0	0	0	0	0	112.1
87	S	34.1	Very low	37.2	Very low	132 Å²	132	144.6 Å²	144.6	92%	0.923	81%	0.805	S	S	*	*			trans	-71.8	131	179.9	58	0	0	0	0	112.6
88	G	37	Very low	37.5	Very low	78 Å²	78	146.6 Å²	146.6	80%	0.804	81%	0.812	S	S	*	*			trans	-152.5	95.9	174.6	0	0	0	0	0	112.7
89	D	33.5	Very low	37.3	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	81%	0.81	S	S	*	*			trans	-66.7	135.3	173.4	-106.4	-46.8	0	0	0	111.7
90	F	38	Very low	37.9	Very low	195 Å²	195	147.6 Å²	147.6	86%	0.855	81%	0.811	S	S	*	*			trans	-149.9	104.7	153.2	-129.5	-82.5	0	0	0	112.6
91	S	32.9	Very low	37.8	Very low	101 Å²	101	147.6 Å²	147.6	71%	0.706	81%	0.805	S	S	*	*			trans	-83.2	128.5	175.4	-77.5	0	0	0	0	112.1
92	I	41.3	Very low	37.7	Very low	167 Å²	167	147.4 Å²	147.4	86%	0.856	80%	0.802	S	S	*	*			trans	-123.1	141.4	158.9	-62.9	-176.8	0	0	0	108.3
93	N	36.4	Very low	37.5	Very low	136 Å²	136	144.9 Å²	144.9	73%	0.727	80%	0.796	S	S	*	*			trans	-122.9	137.4	-140	-156.5	-15.1	0	0	0	114.6
94	T	34.7	Very low	37.1	Very low	97 Å²	97	146 Å²	146	60%	0.595	80%	0.799	S	S	*	*			trans	60.7	115.4	154.6	-68.2	0	0	0	0	119.4
95	K	40.4	Very low	37	Very low	207 Å²	207	143.1 Å²	143.1	90%	0.9	79%	0.794	S	S	*	*				-155.9	107.2	115.9	-110	160.8	-170.5	173.1	0	114.9
96	K	40	Very low	37	Very low	168 Å²	168	139 Å²	139	73%	0.73	78%	0.783	S	S	*	*			trans	-37.7	156.5	152.5	-71.8	173	-177.6	174.2	0	112.8
97	N	38.2	Very low	37.1	Very low	133 Å²	133	140.5 Å²	140.5	71%	0.711	78%	0.782	S	S	*	*			cis	-162.1	148.7	14	-115.4	0.7	0	0	0	109.9
98	N	40.9	Very low	37.6	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	78%	0.782	S	S	*	*				172.6	133.9	119.8	-90.2	-15.2	0	0	0	111.5
99	F	34.4	Very low	38	Very low	171 Å²	171	147.6 Å²	147.6	75%	0.75	79%	0.785	S	S	*	*			trans	-132.4	130.1	-177.3	171.2	-90.4	0	0	0	109.2	K101	F99-K101 HydrophobicContact CE1-CB 3.77Å; F99-K101 HydrophobicContact CE1-CG 4.05Å; F99-K101 HydrophobicContact CZ-CB 4.3Å; F99-K101 HydrophobicContact CZ-CG 4.33Å
100	V	44.7	Very low	38.6	Very low	144 Å²	144	147 Å²	147	87%	0.873	79%	0.786	S	S	*	*			trans	-124.1	141.5	167	179.5	0	0	0	0	108
101	K	37.6	Very low	38.8	Very low	156 Å²	156	144 Å²	144	68%	0.678	78%	0.779	S	S	*	*			trans	-98	124.4	-152.7	-173.1	177.3	178.7	-178.7	0	112	F99	F99-K101 HydrophobicContact CE1-CB 3.77Å; F99-K101 HydrophobicContact CE1-CG 4.05Å; F99-K101 HydrophobicContact CZ-CB 4.3Å; F99-K101 HydrophobicContact CZ-CG 4.33Å
102	I	32.2	Very low	39.5	Very low	151 Å²	151	144.3 Å²	144.3	77%	0.774	78%	0.778	S	S	*	*			trans	-77	137.5	164	-62.1	174.4	0	0	0	108.5
103	S	36.7	Very low	39.4	Very low	98 Å²	98	144.9 Å²	144.9	69%	0.685	78%	0.775	S	S	*	*			trans	-128.5	113.2	170.5	-63.8	0	0	0	0	108.7
104	T	31.1	Very low	39.8	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	78%	0.784	S	S	*	*			trans	-81.8	142.9	177.6	45.6	0	0	0	0	112
105	V	39.5	Very low	40	Very low	137 Å²	137	150 Å²	150	83%	0.83	79%	0.793	S	S	*	*			trans	-134.8	143.3	161.4	-171.4	0	0	0	0	108.4
106	T	37.3	Very low	40	Very low	119 Å²	119	147 Å²	147	73%	0.73	79%	0.791	S	S	*	*			trans	-66.5	136.6	179.2	42.9	0	0	0	0	111.6
107	S	38.8	Very low	39.7	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	79%	0.793	S	S	*	*				65.5	97	71.3	-51.3	0	0	0	0	113.9
108	E	45	Very low	39.6	Very low	197 Å²	197	143.4 Å²	143.4	92%	0.921	80%	0.799	S	S	*	*			trans	-148.3	149.4	147.3	-70.1	-160.2	152.8	0	0	108.3
109	D	44.5	Very low	39.2	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	79%	0.791	S	S	*	*			trans	-106.3	130	-168.6	-55.2	-84.7	0	0	0	113.4
110	V	45.6	Very low	39.3	Very low	144 Å²	144	138.2 Å²	138.2	87%	0.873	80%	0.796	S	S	*	*			trans	-146.1	119.3	156.9	-174.3	0	0	0	0	110.8
111	D	43.9	Very low	39	Very low	130 Å²	130	138.2 Å²	138.2	70%	0.695	79%	0.791	S	S	*	*			trans	-108.2	141.2	157.6	-166.3	12.7	0	0	0	105.8
112	P	45.7	Very low	39	Very low	108 Å²	108	139 Å²	139	70%	0.701	80%	0.797	S	S	*	*				-151.6	165.8	94.9	40	-22.6	0	0	0	116.5
113	F	39.1	Very low	39.4	Very low	179 Å²	179	140.1 Å²	140.1	79%	0.785	80%	0.803	S	S	*	*			trans	-64.4	143.9	157.2	-69.2	-117.6	0	0	0	111.9
114	E	46.7	Very low	39.5	Very low	195 Å²	195	140.3 Å²	140.3	91%	0.911	80%	0.8	S	S	*	*				-162.8	167.8	126.1	-117.8	176.2	-156.4	0	0	112.4
115	D	37.4	Very low	40.1	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	80%	0.798	S	S	*	*			trans	-73.3	163.9	-173.4	-75.5	-65.3	0	0	0	114.7
116	V	40.7	Very low	40.4	Very low	143 Å²	143	142.2 Å²	142.2	87%	0.867	79%	0.793	S	S	*	*				-169.2	150.3	116.6	141.4	0	0	0	0	110.9
117	T	34.3	Very low	40.8	Very low	124 Å²	124	146.4 Å²	146.4	76%	0.761	80%	0.801	S	S	*	*			trans	-113.9	176.6	-174	54.6	0	0	0	0	113.1
118	A	35.7	Very low	41.2	Very low	101 Å²	101	145.7 Å²	145.7	84%	0.835	80%	0.802	S	S	*	*			trans	88.3	148.1	175.2	0	0	0	0	0	116.7
119	A	32.2	Very low	41.5	Very low	86 Å²	86	144.3 Å²	144.3	71%	0.711	80%	0.799	S	S	*	*			cis	162.8	122.1	-33.4	0	0	0	0	0	107.2
120	T	36.3	Very low	41.6	Very low	140 Å²	140	141.3 Å²	141.3	86%	0.859	79%	0.791	S	S	*	*			trans	-145.8	93.2	174	26.2	0	0	0	0	112.5
121	N	38.4	Very low	41.7	Very low	144 Å²	144	140.1 Å²	140.1	77%	0.77	79%	0.786	S	S	*	*			trans	32.6	114.7	142.5	-56.3	4.9	0	0	0	120.9
122	E	38.4	Very low	42.3	Very low	171 Å²	171	140.5 Å²	140.5	80%	0.799	79%	0.786	S	S	*	*				43.2	108.9	123.1	-57.8	-173.3	163.7	0	0	120.5
123	I	40.9	Very low	42.7	Very low	176 Å²	176	143.4 Å²	143.4	90%	0.903	79%	0.791	S	S	*	*				-127.7	129.6	125.8	-62.8	-176.7	0	0	0	107.5
124	T	39.1	Very low	43.4	Very low	102 Å²	102	145.6 Å²	145.6	63%	0.626	79%	0.794	S	S	*	*			trans	-89.8	137.7	178.2	59.6	0	0	0	0	111.7
125	D	42.9	Very low	43.4	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	79%	0.79	S	S	*	*				-156.4	164.2	126.7	-124.9	-22.9	0	0	0	114.7
126	K	46.2	Very low	43.6	Very low	168 Å²	168	148 Å²	148	73%	0.73	80%	0.795	S	S	*	*			trans	-104.3	142.8	-163.6	-43	101	-167.6	153.7	0	113.7
127	K	44.6	Very low	43.9	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.896	79%	0.794	S	S	*	*			trans	-153.1	103.9	147.6	-117.4	165.4	-175.2	172.8	0	111.1
128	A	47.6	Very low	44.4	Very low	96 Å²	96	147 Å²	147	79%	0.793	79%	0.794	S	S	*	*			trans	-73.8	145.8	165.3	0	0	0	0	0	109.3
129	I	50.8	Low	44.5	Very low	168 Å²	168	149.3 Å²	149.3	86%	0.862	79%	0.792	S	S	*	*			trans	-92.2	114.8	174.3	-59.2	173.7	0	0	0	107.3
130	S	47.4	Very low	45.2	Very low	98 Å²	98	153.8 Å²	153.8	69%	0.685	80%	0.798	S	S	*	*			trans	-64.8	143.9	177.2	-53	0	0	0	0	111.4
131	P	48.4	Very low	45.8	Very low	120 Å²	120	156.2 Å²	156.2	78%	0.779	80%	0.8	S	S	*	*			trans	-58.7	147.2	163.9	-20.7	33.3	0	0	0	111.1	E133	P131-E133 PolarHBondContact O-N 3.28Å
132	I	55.9	Low	46.2	Very low	137 Å²	137	154.5 Å²	154.5	70%	0.703	80%	0.799	S	S	*	*			trans	-85.3	95.9	174.6	-56.8	173.8	0	0	0	108.1
133	E	52.9	Low	46.3	Very low	170 Å²	170	154.5 Å²	154.5	79%	0.794	80%	0.799	S	S	*	*			trans	-72.7	131.3	159.7	-70.4	-74.4	-108.4	0	0	108.4	P131	P131-E133 PolarHBondContact O-N 3.28Å
134	W	54.8	Low	46.5	Very low	225 Å²	225	153 Å²	153	85%	0.852	79%	0.793	S	S	*	*			trans	-97.6	108.8	167.5	-72.7	84.6	0	0	0	107.6	R136	W134-R136 PolarHBondContact O-N 3.34Å
135	D	46.6	Very low	46.7	Very low	153 Å²	153	158.5 Å²	158.5	82%	0.818	80%	0.802	S	S	*	*			trans	-58.2	133	-176.5	-92.7	-46.2	0	0	0	112	V137	D135-V137 PolarHBondContact O-N 3.46Å
136	R	41.8	Very low	46.8	Very low	238 Å²	238	157.5 Å²	157.5	90%	0.898	80%	0.797	S	S	*	*			trans	-76.3	99.7	165.7	-75.3	-179.9	167.9	81.4	-2	108.2	W134	W134-R136 PolarHBondContact O-N 3.34Å
137	V	47	Very low	46.6	Very low	139 Å²	139	158.4 Å²	158.4	84%	0.842	80%	0.804	S	S	*	*			trans	-80.5	126	158.3	-161.5	0	0	0	0	106.8	D135	D135-V137 PolarHBondContact O-N 3.46Å
138	S	44.5	Very low	46.8	Very low	109 Å²	109	157.1 Å²	157.1	76%	0.762	81%	0.806	S	S	*	*			trans	-69.5	159.8	-172.9	-55.5	0	0	0	0	113.5
139	D	38.6	Very low	46.6	Very low	148 Å²	148	159.9 Å²	159.9	79%	0.791	80%	0.802	S	S	*	*			trans	-63	-172.7	158.9	-49.2	-86.1	0	0	0	111.9
140	E	46.6	Very low	46.5	Very low	180 Å²	180	158.6 Å²	158.6	84%	0.841	80%	0.801	S	S	*	*			trans	77.5	73.5	175.5	-44	-65.7	175.6	0	0	116.9
141	E	47.5	Very low	46.3	Very low	191 Å²	191	160.1 Å²	160.1	89%	0.893	80%	0.802	S	S	*	*				-169.5	148.8	127.7	-113.6	179.2	-172.8	0	0	115.8
142	S	48.7	Very low	46.3	Very low	109 Å²	109	158.6 Å²	158.6	76%	0.762	80%	0.8	S	S	*	*			trans	61.6	90.3	157.8	-60.7	0	0	0	0	120.1
143	E	40.6	Very low	45.7	Very low	170 Å²	170	158.6 Å²	158.6	79%	0.794	81%	0.808	S	S	*	*			trans	-55.3	173.5	148	-54.8	170.6	133.8	0	0	112.7
144	N	44.6	Very low	45	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	80%	0.803	S	S	*	*			trans	80	97.3	168.6	-44.1	-83	0	0	0	117.2
145	R	43	Very low	44.1	Very low	218 Å²	218	150.6 Å²	150.6	82%	0.823	80%	0.803	S	S	*	*				179.3	130.9	97.5	-94.5	-165.3	174.6	-142.5	1.9	115.4
146	D	45.6	Very low	43.7	Very low	120 Å²	120	151.8 Å²	151.8	64%	0.642	80%	0.804	S	S	*	*				56.7	98.9	127.1	-44.5	-11.3	0	0	0	120.2
147	E	41.5	Very low	43.6	Very low	187 Å²	187	149.5 Å²	149.5	87%	0.874	80%	0.801	S	S	*	*			trans	3.7	133.6	141.1	-53	-178.8	137.6	0	0	120.1
148	L	47.9	Very low	43.1	Very low	178 Å²	178	148.2 Å²	148.2	93%	0.932	80%	0.798	S	S	*	*			trans	-139.5	134	140.5	-86.2	-176.1	0	0	0	111.8
149	H	43.8	Very low	42.6	Very low	155 Å²	155	152.7 Å²	152.7	72%	0.718	80%	0.803	S	S	*	*			trans	-87.8	150.2	178.5	-134.5	93.3	0	0	0	111	D151	H149-D151 IonicContact CD2-OD1 2.95Å; H149-D151 IonicContact CD2-OD2 2.72Å; H149-D151 PolarHBondContact CD2-OD2 3.22Å
150	V	49.4	Very low	42.8	Very low	140 Å²	140	154.2 Å²	154.2	85%	0.848	81%	0.806	S	S	*	*			trans	-142	120.2	160.3	-174.1	0	0	0	0	109.1
151	D	42.7	Very low	42.5	Very low	131 Å²	131	153.9 Å²	153.9	70%	0.701	80%	0.804	S	S	*	*			trans	-85	172.4	-175.5	-75.1	-81.2	0	0	0	115	H149	H149-D151 IonicContact CD2-OD1 2.95Å; H149-D151 IonicContact CD2-OD2 2.72Å; H149-D151 PolarHBondContact CD2-OD2 3.22Å
152	A	47.4	Very low	41.9	Very low	88 Å²	88	154.1 Å²	154.1	73%	0.727	81%	0.805	S	S	*	*			trans	-63	171.4	-178.9	0	0	0	0	0	114.2
153	P	44.1	Very low	41.3	Very low	137 Å²	137	152.5 Å²	152.5	89%	0.89	80%	0.798	S	S	*	*				-119	173.3	69.8	39.2	-34.8	0	0	0	112.2
154	G	37.5	Very low	41.4	Very low	65 Å²	65	153.4 Å²	153.4	67%	0.67	80%	0.803	S	S	*	*			cis	166.1	135.7	0.9	0	0	0	0	0	107.3	E156	G154-E156 PolarHBondContact O-N 3Å
155	D	37.1	Very low	40.8	Very low	161 Å²	161	154.3 Å²	154.3	86%	0.861	81%	0.808	S	S	*	*			trans	-82.3	114.1	-161.8	-170.4	12	0	0	0	113.2
156	E	38.1	Very low	40.4	Very low	179 Å²	179	149.7 Å²	149.7	84%	0.836	81%	0.808	S	S	*	*			trans	-152.9	72.4	178.8	-167.5	175.1	-126	0	0	112.6	G154	G154-E156 PolarHBondContact O-N 3Å
157	F	38.4	Very low	40.3	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.833	82%	0.819	S	S	*	*	S	Bend	trans	-164.4	71	143.9	-130	-85.8	0	0	0	113.6
158	S	38.1	Very low	40.2	Very low	111 Å²	111	153 Å²	153	78%	0.776	82%	0.82	S	S	*	*			trans	-159.1	57.8	175.8	-82.8	0	0	0	0	113.4
159	K	34.3	Very low	39.7	Very low	203 Å²	203	150.8 Å²	150.8	88%	0.883	82%	0.816	S	S	*	*			trans	-158.1	50.1	174.4	-127.5	165.2	-170.1	172.9	0	118.8
160	E	42.1	Very low	39.5	Very low	180 Å²	180	148.9 Å²	148.9	84%	0.841	82%	0.82	S	S	*	*			trans	-135.1	129.1	162.6	-63.4	178.7	-167.5	0	0	107.6
161	E	40.2	Very low	38.8	Very low	173 Å²	173	148 Å²	148	81%	0.808	82%	0.82	S	S	*	*			cis	-126.7	134.7	-3.8	-61.5	176.7	93.2	0	0	110.6
162	E	34	Very low	38.9	Very low	197 Å²	197	148.3 Å²	148.3	92%	0.921	83%	0.826	S	S	*	*			trans	-125.8	61.6	166.2	-167	177.1	-150.3	0	0	109.4
163	A	36.5	Very low	38.3	Very low	74 Å²	74	154.9 Å²	154.9	61%	0.612	83%	0.832	S	S	*	*			trans	-142.8	35.5	-162.4	0	0	0	0	0	115.8
164	Q	42.7	Very low	37.9	Very low	189 Å²	189	151.6 Å²	151.6	88%	0.883	82%	0.824	S	S	*	*			trans	-160.7	84.9	166.5	-115.4	154.3	102.6	0	0	113.6
165	N	32.1	Very low	37.8	Very low	165 Å²	165	156.4 Å²	156.4	88%	0.882	83%	0.828	S	S	*	*			trans	-149.8	82.8	173.5	-168.8	12.6	0	0	0	112.5
166	S	34.7	Very low	37.7	Very low	120 Å²	120	154.4 Å²	154.4	84%	0.839	82%	0.822	S	S	*	*			trans	-164.9	76.9	169.2	-166.1	0	0	0	0	114.1
167	V	43.5	Very low	37.3	Very low	144 Å²	144	152.2 Å²	152.2	87%	0.873	83%	0.825	S	S	*	*			trans	-137.3	147.9	152	-175.2	0	0	0	0	108.1
168	R	39.3	Very low	36.9	Very low	233 Å²	233	148.6 Å²	148.6	88%	0.879	82%	0.819	S	S	*	*			trans	-82.7	152.3	-161.5	-66.2	177.4	177.7	-179.9	-1.9	114.3
169	P	37.7	Very low	36.8	Very low	131 Å²	131	148 Å²	148	85%	0.851	82%	0.815	S	S	*	*			trans	-82.3	149	-179.5	33.7	-35.9	0	0	0	113.3
170	S	40.4	Very low	37	Very low	116 Å²	116	147.5 Å²	147.5	81%	0.811	82%	0.815	S	S	*	*			trans	-139.9	135.5	163.2	58.5	0	0	0	0	111.2	V172	S170-V172 PolarHBondContact O-N 3.4Å
171	S	34	Very low	36.6	Very low	121 Å²	121	150 Å²	150	85%	0.846	82%	0.817	S	S	*	*			trans	-65.1	119.4	-169.5	157.2	0	0	0	0	114.2
172	V	43.9	Very low	36.7	Very low	137 Å²	137	149.1 Å²	149.1	83%	0.83	81%	0.813	S	S	*	*			trans	-132.6	123.9	148.6	-176.2	0	0	0	0	109.5	S170 G174	S170-V172 PolarHBondContact O-N 3.4Å; V172-G174 PolarHBondContact O-N 3.42Å
173	R	36.4	Very low	37.6	Very low	226 Å²	226	144.9 Å²	144.9	85%	0.853	80%	0.797	S	S	*	*			trans	-78.5	111	174.4	174.5	-175.7	-78	178.8	-6.4	109
174	G	35.2	Very low	38.4	Very low	69 Å²	69	148.3 Å²	148.3	71%	0.711	80%	0.795	S	S	*	*			trans	-130.3	132	176.6	0	0	0	0	0	111.8	V172	V172-G174 PolarHBondContact O-N 3.42Å
175	H	34.7	Very low	39.6	Very low	165 Å²	165	141 Å²	141	76%	0.764	76%	0.761	S	S	*	*			trans	-95.1	132.5	179.2	-63.9	-108.5	0	0	0	111.1
176	T	36.2	Very low	41.3	Very low	120 Å²	120	135.3 Å²	135.3	74%	0.736	73%	0.731	S	S	*	*			trans	-157	104.7	151.1	7.6	0	0	0	0	111.2	T178	T176-T178 HydrophobicContact CG2-CG2 3.9Å; T176-T178 PolarHBondContact O-N 3.35Å
177	C	28.7	Very low	43.1	Very low	133 Å²	133	131.5 Å²	131.5	90%	0.899	71%	0.705	S	S	*	*			trans	-87.5	97.5	169.7	-46.8	0	0	0	0	108.3
178	T	31	Very low	44.6	Very low	113 Å²	113	132.2 Å²	132.2	69%	0.693	69%	0.692	S	S	*	*			trans	-111.1	83.7	-169.3	47.9	0	0	0	0	114.4	T176	T176-T178 HydrophobicContact CG2-CG2 3.9Å; T176-T178 PolarHBondContact O-N 3.35Å
179	S	35.4	Very low	46.5	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	66%	0.66	S	S	*	*			trans	59.1	79.5	149.4	64.5	0	0	0	0	119.4	R181	S179-R181 PolarHBondContact O-N 3.15Å
180	E	39.3	Very low	48.6	Very low	192 Å²	192	117.5 Å²	117.5	90%	0.897	62%	0.622	S	S	*	*			trans	-68.3	76.2	144.5	-67.5	-176.1	135.9	0	0	109.4	E182	E180-E182 VanDerWaalsContact C-N 3.26Å; E180-E182 PolarHBondContact O-N 3.37Å
181	R	33.6	Very low	50.6	Low	233 Å²	233	121.4 Å²	121.4	88%	0.879	62%	0.619	S	S	*	*			trans	-83.4	73.5	-178.8	-156.7	174	-159.7	164.2	6.3	110.1	S179	S179-R181 PolarHBondContact O-N 3.15Å
182	E	42.3	Very low	53	Low	154 Å²	154	118.8 Å²	118.8	72%	0.72	60%	0.601	S	S	*	*			trans	-44.7	150.8	-170.4	-64.9	-166.5	118.3	0	0	115.1	E180 Y184	E180-E182 VanDerWaalsContact C-N 3.26Å; E180-E182 PolarHBondContact O-N 3.37Å; E182-Y184 PolarHBondContact O-N 3.01Å
183	N	51.2	Low	55.3	Low	108 Å²	108	112.6 Å²	112.6	58%	0.578	56%	0.563	S	S	*	*			trans	-73.4	63.4	179.8	-72.1	-64.3	0	0	0	112.3	I185	N183-I185 VanDerWaalsContact C-N 3.3Å; N183-I185 PolarHBondContact O-N 3.05Å
184	Y	54.9	Low	58.1	Low	147 Å²	147	103 Å²	103	58%	0.576	53%	0.528	S	S	*	.			trans	-72.8	80.5	-175.4	-154.6	-93.1	0	0	0	112.3	E182 D186 S187	E182-Y184 PolarHBondContact O-N 3.01Å; Y184-D186 PolarHBondContact O-N 3.48Å; Y184-S187 PolarHBondContact OH-OG 3.29Å
185	I	67.9	Low	61	Low	35 Å²	35	99.9 Å²	99.9	18%	0.179	50%	0.495	C	S	.	.			trans	-62.3	122.6	148.6	-59.6	163.4	0	0	0	105.7	N183 S187 L189 F190 F250 I285 C326	N183-I185 VanDerWaalsContact C-N 3.3Å; N183-I185 PolarHBondContact O-N 3.05Å; I185-S187 PolarHBondContact O-N 3.04Å; I185-L189 HydrophobicContact CG2-CD1 3.84Å; I185-F190 HydrophobicContact CB-CE2 4.15Å; I185-F190 HydrophobicContact CB-CZ 3.95Å; I185-F190 HydrophobicContact CD1-CZ 4.39Å; I185-F190 HydrophobicContact CG2-CE1 4.26Å; I185-F190 HydrophobicContact CG2-CE2 3.93Å; I185-F190 HydrophobicContact CG2-CZ 3.47Å; I185-F190 VanDerWaalsContact CG2-CZ 3.47Å; I185-F250 HydrophobicContact CD1-CZ 4.2Å; I185-I285 HydrophobicContact CG2-CG2 4.46Å; I185-C326 WeakPolarHBondContact CD1-O 3.38Å
186	D	68	Low	63.9	Low	45 Å²	45	92 Å²	92	24%	0.241	46%	0.458	C	S	.	.			trans	-51.8	112.4	-173.2	179.5	-7.4	0	0	0	111.7	Y184 R188 L189	Y184-D186 PolarHBondContact O-N 3.48Å; D186-R188 PolarHBondContact O-N 2.96Å; D186-R188 WeakPolarHBondContact OD1-CB 3.45Å; D186-R188 WeakPolarHBondContact OD1-CG 3.39Å; D186-R188 IonicContact OD1-CZ 3.73Å; D186-R188 PolarHBondContact OD1-N 3.45Å; D186-R188 IonicContact OD1-NE 3.22Å; D186-R188 PolarHBondContact OD1-NE 3.38Å; D186-R188 IonicContact OD1-NH2 3.76Å; D186-R188 IonicContact OD2-CZ 3.71Å; D186-R188 VanDerWaalsContact OD2-CZ 3.24Å; D186-R188 IonicContact OD2-NE 2.69Å; D186-R188 PolarHBondContact OD2-NE 3.04Å; D186-R188 IonicContact OD2-NH2 3.57Å; D186-R188 PolarHBondContact OD2-NH2 3.4Å; D186-L189 HydrophobicContact CB-CD1 4.13Å; D186-L189 HydrophobicContact CB-CG 4.25Å; D186-L189 WeakPolarHBondContact O-CB 3.37Å; D186-L189 WeakPolarHBondContact O-CG 3.47Å; D186-L189 PolarHBondContact O-N 3.48Å
187	S	72.6	Confident	66.8	Low	41 Å²	41	86.4 Å²	86.4	29%	0.287	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-58.1	-17.8	-176.7	-59.3	0	0	0	0	113.7	Y184 I185 L189 F190 R191	Y184-S187 PolarHBondContact OH-OG 3.29Å; I185-S187 PolarHBondContact O-N 3.04Å; S187-L189 PolarHBondContact O-N 3.45Å; S187-F190 PolarHBondContact O-N 3.45Å; S187-F190 VanDerWaalsContact O-N 3.11Å; S187-R191 PolarHBondContact O-N 3.44Å
188	R	73.8	Confident	70	Confident	159 Å²	159	80 Å²	80	60%	0.6	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.2	171.7	-57.1	175.8	-63.9	-171.9	2.8	112.8	D186	D186-R188 PolarHBondContact O-N 2.96Å; D186-R188 WeakPolarHBondContact OD1-CB 3.45Å; D186-R188 WeakPolarHBondContact OD1-CG 3.39Å; D186-R188 IonicContact OD1-CZ 3.73Å; D186-R188 PolarHBondContact OD1-N 3.45Å; D186-R188 IonicContact OD1-NE 3.22Å; D186-R188 PolarHBondContact OD1-NE 3.38Å; D186-R188 IonicContact OD1-NH2 3.76Å; D186-R188 IonicContact OD2-CZ 3.71Å; D186-R188 VanDerWaalsContact OD2-CZ 3.24Å; D186-R188 IonicContact OD2-NE 2.69Å; D186-R188 PolarHBondContact OD2-NE 3.04Å; D186-R188 IonicContact OD2-NH2 3.57Å; D186-R188 PolarHBondContact OD2-NH2 3.4Å
189	L	79.1	Confident	73.1	Confident	42 Å²	42	75.8 Å²	75.8	22%	0.22	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-74.7	-22.9	171.7	-65.3	169.7	0	0	0	113.1	I185 D186 S187 T193 N234 I285	I185-L189 HydrophobicContact CG2-CD1 3.84Å; D186-L189 HydrophobicContact CB-CD1 4.13Å; D186-L189 HydrophobicContact CB-CG 4.25Å; D186-L189 WeakPolarHBondContact O-CB 3.37Å; D186-L189 WeakPolarHBondContact O-CG 3.47Å; D186-L189 PolarHBondContact O-N 3.48Å; S187-L189 PolarHBondContact O-N 3.45Å; L189-T193 PolarHBondContact O-OG1 3.42Å; L189-N234 PolarHBondContact O-ND2 3.03Å; L189-I285 HydrophobicContact CD1-CD1 4.43Å
190	F	82.4	Confident	75.8	Confident	12 Å²	12	71.3 Å²	71.3	5%	0.053	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-24.9	-178.1	-54.4	-50.4	0	0	0	112.8	I185 S187 S192 T193 Y195 L236 E323 C326 R327	I185-F190 HydrophobicContact CB-CE2 4.15Å; I185-F190 HydrophobicContact CB-CZ 3.95Å; I185-F190 HydrophobicContact CD1-CZ 4.39Å; I185-F190 HydrophobicContact CG2-CE1 4.26Å; I185-F190 HydrophobicContact CG2-CE2 3.93Å; I185-F190 HydrophobicContact CG2-CZ 3.47Å; I185-F190 VanDerWaalsContact CG2-CZ 3.47Å; S187-F190 PolarHBondContact O-N 3.45Å; S187-F190 VanDerWaalsContact O-N 3.11Å; F190-S192 PolarHBondContact O-N 2.9Å; F190-T193 WeakPolarHBondContact CA-OG1 3.36Å; F190-T193 WeakPolarHBondContact O-CB 3.47Å; F190-T193 PolarHBondContact O-N 2.88Å; F190-T193 PolarHBondContact O-OG1 3.3Å; F190-Y195 HydrophobicContact CD1-CE1 4.49Å; F190-Y195 VanDerWaalsContact CD1-OH 3.29Å; F190-Y195 WeakPolarHBondContact CD1-OH 3.44Å; F190-L236 HydrophobicContact CD1-CD1 4.32Å; F190-L236 HydrophobicContact CE1-CD1 4.35Å; F190-E323 HydrophobicContact CB-CG 3.83Å; F190-E323 WeakPolarHBondContact CB-OE1 3.41Å; F190-E323 HydrophobicContact CD1-CG 4.08Å; F190-E323 HydrophobicContact CD2-CG 3.61Å; F190-E323 VanDerWaalsContact CD2-OE1 3.24Å; F190-E323 WeakPolarHBondContact CD2-OE1 3.47Å; F190-E323 HydrophobicContact CE2-CG 4.13Å; F190-E323 HydrophobicContact CG-CG 3.58Å; F190-E323 WeakPolarHBondContact CG-OE1 3.45Å; F190-C326 HydrophobicContact CE1-CB 3.55Å; F190-C326 HydrophobicContact CZ-CB 3.88Å; F190-R327 HydrophobicContact CE2-CG 4.45Å
191	R	81.2	Confident	78.3	Confident	198 Å²	198	67 Å²	67	75%	0.747	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	122.8	175	-173.4	173.1	-179.9	172	1	112.6	S187 T193	S187-R191 PolarHBondContact O-N 3.44Å; R191-T193 PolarHBondContact O-OG1 2.88Å
192	S	85.5	Confident	81	Confident	66 Å²	66	58.1 Å²	58.1	46%	0.462	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	48.7	-179.3	-51.1	0	0	0	0	113.3	F190 N233	F190-S192 PolarHBondContact O-N 2.9Å; S192-N233 PolarHBondContact O-N 3.34Å
193	T	92.6	Very high	83.5	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.043	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.2	-173.3	-58.1	0	0	0	0	111.6	L189 F190 R191 Y195 N234 L236	L189-T193 PolarHBondContact O-OG1 3.42Å; F190-T193 WeakPolarHBondContact CA-OG1 3.36Å; F190-T193 WeakPolarHBondContact O-CB 3.47Å; F190-T193 PolarHBondContact O-N 2.88Å; F190-T193 PolarHBondContact O-OG1 3.3Å; R191-T193 PolarHBondContact O-OG1 2.88Å; T193-Y195 HydrophobicContact CG2-CE1 4.3Å; T193-Y195 HydrophobicContact CG2-CE2 4.17Å; T193-N234 WeakPolarHBondContact CA-O 3.48Å; T193-N234 HydrophobicContact CG2-CB 3.87Å; T193-N234 PolarHBondContact OG1-ND2 2.9Å; T193-L236 HydrophobicContact CG2-CB 4.43Å; T193-L236 HydrophobicContact CG2-CD1 3.8Å; T193-L236 HydrophobicContact CG2-CG 3.68Å
194	K	94.4	Very high	85.5	Confident	26 Å²	26	54.6 Å²	54.6	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137.1	174.1	-166.4	167.7	-174.1	178	0	111.5	F196 A228 Y232 N234 V235 L236 E316	K194-F196 HydrophobicContact CB-CE2 4.2Å; K194-F196 HydrophobicContact CD-CE2 3.86Å; K194-F196 HydrophobicContact CD-CZ 3.8Å; K194-F196 HydrophobicContact CG-CD2 4.4Å; K194-F196 HydrophobicContact CG-CE2 3.69Å; K194-F196 HydrophobicContact CG-CZ 4.11Å; K194-A228 HydrophobicContact CD-CB 4.18Å; K194-Y232 HydrophobicContact CB-CD1 4.15Å; K194-Y232 HydrophobicContact CB-CD2 4Å; K194-Y232 HydrophobicContact CB-CE1 4.36Å; K194-Y232 HydrophobicContact CB-CE2 4.25Å; K194-Y232 HydrophobicContact CB-CG 3.97Å; K194-Y232 HydrophobicContact CD-CD2 4.09Å; K194-Y232 HydrophobicContact CD-CE2 3.65Å; K194-N234 PolarHBondContact N-O 3.31Å; K194-N234 VanDerWaalsContact N-O 3.08Å; K194-V235 WeakPolarHBondContact O-CA 3.37Å; K194-L236 PolarHBondContact O-N 3.38Å; K194-E316 VanDerWaalsContact CE-OE1 3.3Å; K194-E316 WeakPolarHBondContact CE-OE1 3.24Å; K194-E316 WeakPolarHBondContact CE-OE2 3.46Å; K194-E316 IonicContact NZ-OE1 2.63Å; K194-E316 PolarHBondContact NZ-OE1 3.35Å; K194-E316 IonicContact NZ-OE2 2.83Å; K194-E316 PolarHBondContact NZ-OE2 3.44Å
195	Y	96.2	Very high	87.3	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135	-173.6	-57	-96.3	0	0	0	110.7	F190 T193 L236 I238 I317 P319 G322 E323	F190-Y195 HydrophobicContact CD1-CE1 4.49Å; F190-Y195 VanDerWaalsContact CD1-OH 3.29Å; F190-Y195 WeakPolarHBondContact CD1-OH 3.44Å; T193-Y195 HydrophobicContact CG2-CE1 4.3Å; T193-Y195 HydrophobicContact CG2-CE2 4.17Å; Y195-L236 WeakPolarHBondContact CA-O 3.45Å; Y195-L236 HydrophobicContact CD1-CB 4.02Å; Y195-L236 HydrophobicContact CD1-CD1 4.12Å; Y195-L236 HydrophobicContact CE1-CB 4.42Å; Y195-L236 HydrophobicContact CE1-CD1 3.65Å; Y195-I238 HydrophobicContact CD1-CD1 4.28Å; Y195-I317 PolarHBondContact O-N 3.48Å; Y195-P319 HydrophobicContact CE2-CB 4.22Å; Y195-P319 WeakPolarHBondContact CE2-O 3.23Å; Y195-G322 WeakPolarHBondContact CE1-O 3.48Å; Y195-E323 WeakPolarHBondContact OH-CA 3.39Å; Y195-E323 WeakPolarHBondContact OH-CB 3.35Å; Y195-E323 PolarHBondContact OH-N 2.89Å
196	F	96.5	Very high	88.6	Confident	1 Å²	1	47 Å²	47	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.1	177.1	-66.3	-96.9	0	0	0	110.8	K194 L225 A228 V235 L236 L237 I238 Q315 E316	K194-F196 HydrophobicContact CB-CE2 4.2Å; K194-F196 HydrophobicContact CD-CE2 3.86Å; K194-F196 HydrophobicContact CD-CZ 3.8Å; K194-F196 HydrophobicContact CG-CD2 4.4Å; K194-F196 HydrophobicContact CG-CE2 3.69Å; K194-F196 HydrophobicContact CG-CZ 4.11Å; F196-L225 HydrophobicContact CB-CD2 4.08Å; F196-L225 HydrophobicContact CD1-CD2 3.75Å; F196-L225 HydrophobicContact CD2-CD2 3.56Å; F196-L225 HydrophobicContact CE1-CD2 3.98Å; F196-L225 HydrophobicContact CE2-CD2 3.81Å; F196-L225 HydrophobicContact CG-CD2 3.53Å; F196-L225 HydrophobicContact CZ-CD2 4.01Å; F196-A228 HydrophobicContact CE2-CB 3.72Å; F196-A228 HydrophobicContact CZ-CB 3.71Å; F196-V235 HydrophobicContact CD2-CG1 3.65Å; F196-V235 HydrophobicContact CE2-CG1 3.67Å; F196-L236 PolarHBondContact N-O 3.4Å; F196-L237 HydrophobicContact CB-CD2 3.93Å; F196-I238 PolarHBondContact O-N 2.87Å; F196-Q315 WeakPolarHBondContact CA-O 3.43Å; F196-E316 HydrophobicContact CD1-CG 4Å; F196-E316 HydrophobicContact CE1-CG 3.67Å; F196-E316 VanDerWaalsContact CE1-OE1 3.25Å; F196-E316 WeakPolarHBondContact CE1-OE1 3.24Å; F196-E316 HydrophobicContact CZ-CG 4.47Å
197	L	96.7	Very high	89.9	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	121.4	171.6	-175.7	61.7	0	0	0	110	K199 F247 G314 Q315 I317	L197-K199 HydrophobicContact CD1-CD 4.12Å; L197-K199 HydrophobicContact CD2-CD 3.98Å; L197-K199 HydrophobicContact CD2-CG 4.44Å; L197-K199 HydrophobicContact CG-CD 3.83Å; L197-K199 HydrophobicContact CG-CG 4.24Å; L197-F247 HydrophobicContact CD1-CD1 4.41Å; L197-F247 HydrophobicContact CD1-CE1 3.81Å; L197-G314 PolarHBondContact O-N 3.38Å; L197-Q315 HydrophobicContact CB-CB 4.25Å; L197-Q315 PolarHBondContact N-O 3.33Å; L197-I317 HydrophobicContact CB-CD1 4.12Å; L197-I317 HydrophobicContact CB-CG1 4.46Å
198	I	96.4	Very high	90.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.6	175.8	-62.5	-56.5	0	0	0	109.4	W215 L237 I238 F239 S240 D313	I198-W215 HydrophobicContact CG2-CD2 4.5Å; I198-W215 VanDerWaalsContact CG2-CE2 3.47Å; I198-W215 HydrophobicContact CG2-CH2 4.32Å; I198-W215 HydrophobicContact CG2-CZ2 3.36Å; I198-L237 HydrophobicContact CD1-CD2 4.19Å; I198-L237 HydrophobicContact CG1-CB 3.95Å; I198-L237 HydrophobicContact CG1-CD1 4.38Å; I198-L237 HydrophobicContact CG1-CD2 4.07Å; I198-L237 HydrophobicContact CG1-CG 4.35Å; I198-I238 PolarHBondContact N-O 3Å; I198-F239 HydrophobicContact CB-CD1 3.93Å; I198-F239 HydrophobicContact CB-CE1 4.13Å; I198-F239 HydrophobicContact CG1-CE1 4.38Å; I198-F239 HydrophobicContact CG2-CD1 3.64Å; I198-F239 HydrophobicContact CG2-CE1 3.74Å; I198-S240 PolarHBondContact O-N 3.26Å; I198-D313 WeakPolarHBondContact CA-OD1 3.33Å
199	K	94.4	Very high	91.9	Very high	24 Å²	24	42.7 Å²	42.7	10%	0.104	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	97.3	-177.1	-59.9	-59.5	-60.6	-168.5	0	110.6	L197 S240 R242 D313	L197-K199 HydrophobicContact CD1-CD 4.12Å; L197-K199 HydrophobicContact CD2-CD 3.98Å; L197-K199 HydrophobicContact CD2-CG 4.44Å; L197-K199 HydrophobicContact CG-CD 3.83Å; L197-K199 HydrophobicContact CG-CG 4.24Å; K199-S240 WeakPolarHBondContact CA-O 3.43Å; K199-S240 WeakPolarHBondContact CE-O 3.31Å; K199-S240 PolarHBondContact NZ-OG 2.89Å; K199-R242 PolarHBondContact O-NH1 3.43Å; K199-D313 HydrophobicContact CB-CB 4.18Å; K199-D313 PolarHBondContact N-OD1 3.33Å
200	S	93.1	Very high	92.6	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	150.3	171.8	-174.2	0	0	0	0	111.3	N202 S240 V241 R242	S200-N202 PolarHBondContact OG-N 3.24Å; S200-N202 VanDerWaalsContact OG-N 3.12Å; S200-N202 PolarHBondContact OG-O 2.91Å; S200-S240 PolarHBondContact N-O 3.43Å; S200-V241 WeakPolarHBondContact O-CA 3.29Å; S200-R242 PolarHBondContact O-N 3.22Å
201	N	90.8	Very high	93.2	Very high	102 Å²	102	45.9 Å²	45.9	55%	0.545	23%	0.226	S	C	.	.	S	Bend	trans	-82.7	-19.6	168.2	-71.4	-11.2	0	0	0	113	R242	N201-R242 WeakPolarHBondContact OD1-CD 3.3Å; N201-R242 PolarHBondContact OD1-NH1 3.49Å
202	N	91.7	Very high	93.7	Very high	45 Å²	45	42.2 Å²	42.2	24%	0.241	21%	0.213	C	C	.	.			trans	-144.5	146	-165.7	-170.6	-5.4	0	0	0	110.8	S200 E204	S200-N202 PolarHBondContact OG-N 3.24Å; S200-N202 VanDerWaalsContact OG-N 3.12Å; S200-N202 PolarHBondContact OG-O 2.91Å; N202-E204 PolarHBondContact ND2-OE2 2.95Å; N202-E204 PolarHBondContact OD1-N 2.9Å; N202-E204 VanDerWaalsContact OD1-N 3.16Å
203	F	93.8	Very high	94.2	Very high	97 Å²	97	42.4 Å²	42.4	43%	0.425	21%	0.208	S	C	.	.	H	α-helix	trans	-69.3	-38.9	174.7	-65.9	-89.4	0	0	0	111.7	N205 I206 E207 V241 S244	F203-N205 VanDerWaalsContact C-N 3.26Å; F203-N205 PolarHBondContact O-N 2.7Å; F203-I206 CarbonylContact O-C 3.6Å; F203-I206 WeakPolarHBondContact O-CA 3.41Å; F203-I206 WeakPolarHBondContact O-CB 3.41Å; F203-I206 PolarHBondContact O-N 3.41Å; F203-E207 PolarHBondContact O-N 3.38Å; F203-V241 HydrophobicContact CD1-CB 4.32Å; F203-V241 HydrophobicContact CD1-CG1 4.35Å; F203-V241 HydrophobicContact CD1-CG2 3.9Å; F203-V241 HydrophobicContact CD2-CG1 3.99Å; F203-V241 HydrophobicContact CE1-CB 4.17Å; F203-V241 HydrophobicContact CE1-CG1 4.3Å; F203-V241 HydrophobicContact CE1-CG2 4.19Å; F203-V241 HydrophobicContact CE2-CG1 3.93Å; F203-V241 HydrophobicContact CG-CG1 4.21Å; F203-V241 HydrophobicContact CG-CG2 4.25Å; F203-V241 HydrophobicContact CZ-CB 4.35Å; F203-V241 HydrophobicContact CZ-CG1 4.1Å; F203-S244 VanDerWaalsContact CZ-CB 3.43Å
204	E	93.6	Very high	94.3	Very high	92 Å²	92	42.5 Å²	42.5	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-55.2	-40.5	-178.8	-62.3	165.6	167.4	0	0	111.9	N202 I206 E207 I208 V266	N202-E204 PolarHBondContact ND2-OE2 2.95Å; N202-E204 PolarHBondContact OD1-N 2.9Å; N202-E204 VanDerWaalsContact OD1-N 3.16Å; E204-I206 VanDerWaalsContact C-N 3.32Å; E204-I206 PolarHBondContact O-N 3.31Å; E204-E207 PolarHBondContact O-N 2.94Å; E204-I208 VanDerWaalsContact O-CG1 3.29Å; E204-I208 WeakPolarHBondContact O-CG1 3.43Å; E204-I208 PolarHBondContact O-N 3.28Å; E204-V266 HydrophobicContact CB-CG2 4.2Å; E204-V266 WeakPolarHBondContact OE2-CG1 3.19Å
205	N	93.7	Very high	94.3	Very high	19 Å²	19	42 Å²	42	10%	0.102	21%	0.206	C	C	.	.	H	α-helix	trans	-68.2	-28.5	176	-71.9	-37.7	0	0	0	113.1	F203 A209 W215 W265 V266	F203-N205 VanDerWaalsContact C-N 3.26Å; F203-N205 PolarHBondContact O-N 2.7Å; N205-A209 WeakPolarHBondContact O-CB 3.33Å; N205-A209 PolarHBondContact O-N 3.28Å; N205-A209 VanDerWaalsContact O-N 3.1Å; N205-W215 HydrophobicContact CB-CZ3 4.4Å; N205-W265 HydrophobicContact CB-CE3 4.24Å; N205-V266 PolarHBondContact ND2-O 3.45Å; N205-V266 PolarHBondContact OD1-N 3.13Å
206	I	94.4	Very high	94.1	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-73.8	-35.6	171.6	-61.3	-57.3	0	0	0	110.7	F203 E204 A209 K210 W215 F239 V241 Q248 W284	F203-I206 CarbonylContact O-C 3.6Å; F203-I206 WeakPolarHBondContact O-CA 3.41Å; F203-I206 WeakPolarHBondContact O-CB 3.41Å; F203-I206 PolarHBondContact O-N 3.41Å; E204-I206 VanDerWaalsContact C-N 3.32Å; E204-I206 PolarHBondContact O-N 3.31Å; I206-A209 CarbonylContact O-C 3.4Å; I206-A209 WeakPolarHBondContact O-CB 3.42Å; I206-A209 PolarHBondContact O-N 3.25Å; I206-K210 HydrophobicContact CG2-CD 4.19Å; I206-K210 HydrophobicContact CG2-CG 4.3Å; I206-K210 WeakPolarHBondContact O-CB 3.44Å; I206-K210 WeakPolarHBondContact O-CG 3.46Å; I206-K210 PolarHBondContact O-N 3.02Å; I206-W215 HydrophobicContact CD1-CH2 4.03Å; I206-W215 HydrophobicContact CD1-CZ3 3.94Å; I206-F239 HydrophobicContact CD1-CB 4.05Å; I206-F239 HydrophobicContact CD1-CD1 3.63Å; I206-F239 HydrophobicContact CD1-CG 4.17Å; I206-V241 HydrophobicContact CG1-CG2 3.59Å; I206-Q248 HydrophobicContact CG2-CB 3.94Å; I206-W284 HydrophobicContact CG2-CH2 4.27Å
207	E	94.4	Very high	93.8	Very high	126 Å²	126	42.3 Å²	42.3	59%	0.589	21%	0.209	S	C	*	.	H	α-helix	trans	-69.4	-41.1	176.2	-67.1	176.6	174.1	0	0	112	F203 E204 A209 K210 S211	F203-E207 PolarHBondContact O-N 3.38Å; E204-E207 PolarHBondContact O-N 2.94Å; E207-A209 VanDerWaalsContact C-N 3.26Å; E207-A209 PolarHBondContact O-N 3.42Å; E207-K210 PolarHBondContact O-N 3.01Å; E207-S211 WeakPolarHBondContact O-CB 3.38Å; E207-S211 PolarHBondContact O-N 3.49Å; E207-S211 PolarHBondContact O-OG 3Å
208	I	93.7	Very high	93.5	Very high	29 Å²	29	45.4 Å²	45.4	15%	0.149	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-40.5	168.7	-67.8	165	0	0	0	110.4	E204 S211 R212 V263 W265 V266	E204-I208 VanDerWaalsContact O-CG1 3.29Å; E204-I208 WeakPolarHBondContact O-CG1 3.43Å; E204-I208 PolarHBondContact O-N 3.28Å; I208-S211 WeakPolarHBondContact CA-OG 3.36Å; I208-S211 PolarHBondContact O-OG 2.93Å; I208-S211 VanDerWaalsContact O-OG 3.11Å; I208-R212 WeakPolarHBondContact O-CB 3.29Å; I208-R212 PolarHBondContact O-N 3.39Å; I208-V263 HydrophobicContact CG2-CG1 3.6Å; I208-W265 HydrophobicContact CB-CE3 4.47Å; I208-W265 HydrophobicContact CB-CZ3 4.15Å; I208-W265 HydrophobicContact CG2-CE3 3.98Å; I208-W265 HydrophobicContact CG2-CH2 4.27Å; I208-W265 HydrophobicContact CG2-CZ3 3.67Å; I208-V266 HydrophobicContact CD1-CG2 4.04Å
209	A	95.2	Very high	93.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.2	-37.7	176.7	0	0	0	0	0	113.6	N205 I206 E207 S211 N213 V214 W215 W284	N205-A209 WeakPolarHBondContact O-CB 3.33Å; N205-A209 PolarHBondContact O-N 3.28Å; N205-A209 VanDerWaalsContact O-N 3.1Å; I206-A209 CarbonylContact O-C 3.4Å; I206-A209 WeakPolarHBondContact O-CB 3.42Å; I206-A209 PolarHBondContact O-N 3.25Å; E207-A209 VanDerWaalsContact C-N 3.26Å; E207-A209 PolarHBondContact O-N 3.42Å; A209-S211 VanDerWaalsContact C-N 3.33Å; A209-N213 WeakPolarHBondContact O-CA 3.28Å; A209-N213 PolarHBondContact O-N 3.3Å; A209-N213 VanDerWaalsContact O-N 3.11Å; A209-V214 WeakPolarHBondContact CA-O 3.36Å; A209-V214 VanDerWaalsContact CB-O 3.27Å; A209-V214 WeakPolarHBondContact CB-O 3.41Å; A209-W215 HydrophobicContact CB-CE3 3.77Å; A209-W215 HydrophobicContact CB-CZ3 4.21Å; A209-W284 HydrophobicContact CB-CZ2 3.93Å; A209-W284 PolarHBondContact O-NE1 2.88Å
210	K	94.3	Very high	92.7	Very high	40 Å²	40	51.9 Å²	51.9	17%	0.174	27%	0.269	C	S	.	.	H	α-helix	trans	-70.1	-25.4	176.2	-78.8	-177.1	-178.9	-173.3	0	113.3	I206 E207 Q248 W284 K287	I206-K210 HydrophobicContact CG2-CD 4.19Å; I206-K210 HydrophobicContact CG2-CG 4.3Å; I206-K210 WeakPolarHBondContact O-CB 3.44Å; I206-K210 WeakPolarHBondContact O-CG 3.46Å; I206-K210 PolarHBondContact O-N 3.02Å; E207-K210 PolarHBondContact O-N 3.01Å; K210-Q248 WeakPolarHBondContact CE-O 3.14Å; K210-Q248 PolarHBondContact NZ-O 3.2Å; K210-W284 HydrophobicContact CB-CZ2 4.42Å; K210-W284 HydrophobicContact CG-CD2 4.12Å; K210-W284 HydrophobicContact CG-CE3 4.28Å; K210-W284 HydrophobicContact CG-CH2 3.78Å; K210-W284 HydrophobicContact CG-CZ2 3.59Å; K210-W284 HydrophobicContact CG-CZ3 4.12Å; K210-K287 HydrophobicContact CB-CD 4.38Å; K210-K287 HydrophobicContact CD-CB 4.2Å; K210-K287 HydrophobicContact CD-CD 4.5Å; K210-K287 HydrophobicContact CD-CG 4.49Å; K210-K287 HydrophobicContact CG-CD 4.3Å; K210-K287 HydrophobicContact CG-CG 4.39Å; K210-K287 PolarHBondContact NZ-O 3.22Å; K210-K287 PolarHBondContact O-NZ 3.47Å
211	S	94	Very high	92.7	Very high	80 Å²	80	52.4 Å²	52.4	56%	0.559	27%	0.272	S	S	*	.	H	α-helix	trans	-94.1	-54.7	178.2	54	0	0	0	0	112.6	E207 I208 A209 N213	E207-S211 WeakPolarHBondContact O-CB 3.38Å; E207-S211 PolarHBondContact O-N 3.49Å; E207-S211 PolarHBondContact O-OG 3Å; I208-S211 WeakPolarHBondContact CA-OG 3.36Å; I208-S211 PolarHBondContact O-OG 2.93Å; I208-S211 VanDerWaalsContact O-OG 3.11Å; A209-S211 VanDerWaalsContact C-N 3.33Å; S211-N213 VanDerWaalsContact C-N 3.32Å; S211-N213 PolarHBondContact O-N 3.4Å
212	R	93.2	Very high	92.8	Very high	122 Å²	122	48.7 Å²	48.7	46%	0.46	25%	0.251	S	S	.	.	H	α-helix	trans	-79.7	-5.6	-178.3	-60.7	-168	-172.3	-170.9	10.4	114.2	I208 V214 D264	I208-R212 WeakPolarHBondContact O-CB 3.29Å; I208-R212 PolarHBondContact O-N 3.39Å; R212-V214 VanDerWaalsContact C-N 3.32Å; R212-V214 HydrophobicContact CB-CG2 3.65Å; R212-V214 PolarHBondContact O-N 2.95Å; R212-D264 IonicContact CZ-OD2 3.64Å; R212-D264 IonicContact NH1-OD2 3.71Å; R212-D264 PolarHBondContact NH1-OD2 3.42Å; R212-D264 IonicContact NH2-OD2 2.77Å; R212-D264 PolarHBondContact NH2-OD2 3.27Å
213	N	94.6	Very high	92.8	Very high	70 Å²	70	51 Å²	51	37%	0.374	27%	0.267	S	S	.	.			trans	55.9	39.5	179.9	-66.4	-59.7	0	0	0	114.2	A209 S211 I282	A209-N213 WeakPolarHBondContact O-CA 3.28Å; A209-N213 PolarHBondContact O-N 3.3Å; A209-N213 VanDerWaalsContact O-N 3.11Å; S211-N213 VanDerWaalsContact C-N 3.32Å; S211-N213 PolarHBondContact O-N 3.4Å; N213-I282 WeakPolarHBondContact O-CG1 3.48Å; N213-I282 PolarHBondContact O-N 2.92Å
214	V	94.6	Very high	92.7	Very high	9 Å²	9	52.7 Å²	52.7	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.2	-176.2	-70.7	0	0	0	0	111.4	A209 R212 I261 V263 W265 F280	A209-V214 WeakPolarHBondContact CA-O 3.36Å; A209-V214 VanDerWaalsContact CB-O 3.27Å; A209-V214 WeakPolarHBondContact CB-O 3.41Å; R212-V214 VanDerWaalsContact C-N 3.32Å; R212-V214 HydrophobicContact CB-CG2 3.65Å; R212-V214 PolarHBondContact O-N 2.95Å; V214-I261 HydrophobicContact CG1-CD1 4.48Å; V214-I261 HydrophobicContact CG1-CG2 4.18Å; V214-V263 HydrophobicContact CG2-CG2 3.72Å; V214-W265 HydrophobicContact CG2-CH2 4.38Å; V214-W265 HydrophobicContact CG2-CZ2 4.47Å; V214-F280 CarbonylContact C-O 3.58Å; V214-F280 WeakPolarHBondContact CA-O 3.29Å
215	W	95	Very high	92.8	Very high	15 Å²	15	48.4 Å²	48.4	6%	0.057	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	133.4	174.4	-175.9	-110.8	0	0	0	112.3	I198 N205 I206 A209 F239 W265 P279 F280 I282	I198-W215 HydrophobicContact CG2-CD2 4.5Å; I198-W215 VanDerWaalsContact CG2-CE2 3.47Å; I198-W215 HydrophobicContact CG2-CH2 4.32Å; I198-W215 HydrophobicContact CG2-CZ2 3.36Å; N205-W215 HydrophobicContact CB-CZ3 4.4Å; I206-W215 HydrophobicContact CD1-CH2 4.03Å; I206-W215 HydrophobicContact CD1-CZ3 3.94Å; A209-W215 HydrophobicContact CB-CE3 3.77Å; A209-W215 HydrophobicContact CB-CZ3 4.21Å; W215-F239 HydrophobicContact CB-CE1 4.5Å; W215-F239 HydrophobicContact CB-CZ 4.47Å; W215-F239 AromaticContact CD2-CE1 3.64Å; W215-F239 HydrophobicContact CD2-CE1 3.64Å; W215-F239 HydrophobicContact CD2-CZ 4.44Å; W215-F239 AromaticContact CE2-CE1 3.92Å; W215-F239 AromaticContact CE3-CE1 3.91Å; W215-F239 HydrophobicContact CE3-CE1 3.91Å; W215-F239 AromaticContact CG-CE1 3.89Å; W215-F239 HydrophobicContact CG-CE1 3.89Å; W215-F239 HydrophobicContact CG-CZ 4.27Å; W215-F239 HydrophobicContact CZ2-CE1 4.42Å; W215-F239 HydrophobicContact CZ3-CE1 4.39Å; W215-W265 HydrophobicContact CE3-CH2 4.06Å; W215-W265 HydrophobicContact CE3-CZ3 4.15Å; W215-W265 HydrophobicContact CZ3-CZ3 4.23Å; W215-P279 CarbonylContact O-C 3.57Å; W215-P279 WeakPolarHBondContact O-CA 3.37Å; W215-F280 PolarHBondContact N-O 3.23Å; W215-F280 PolarHBondContact O-N 3.43Å; W215-I282 HydrophobicContact CB-CD1 4.13Å; W215-I282 HydrophobicContact CB-CG2 4.45Å
216	A	92.4	Very high	92.8	Very high	6 Å²	6	48.7 Å²	48.7	5%	0.05	25%	0.252	C	S	.	.			trans	-110.8	144.7	168.3	0	0	0	0	0	110.2	W265 L276 P279	A216-W265 HydrophobicContact CB-CZ2 3.93Å; A216-L276 HydrophobicContact CB-CB 4.28Å; A216-L276 HydrophobicContact CB-CD1 3.87Å; A216-P279 HydrophobicContact CB-CB 4.21Å
217	T	90.6	Very high	92.7	Very high	4 Å²	4	54.5 Å²	54.5	3%	0.025	28%	0.277	C	S	.	.			trans	-129.5	-167.2	-179.5	-177.7	0	0	0	0	109.4	N221 L225 L276 S277 F280 D313	T217-N221 HydrophobicContact CG2-CB 3.76Å; T217-N221 WeakPolarHBondContact OG1-CB 3.36Å; T217-L225 HydrophobicContact CG2-CD1 4Å; T217-L276 CarbonylContact O-C 3.54Å; T217-L276 WeakPolarHBondContact O-CA 3.32Å; T217-S277 PolarHBondContact N-OG 3.32Å; T217-S277 WeakPolarHBondContact O-CB 3.41Å; T217-S277 PolarHBondContact O-N 2.95Å; T217-S277 PolarHBondContact O-OG 3.17Å; T217-F280 HydrophobicContact CG2-CE2 4.22Å; T217-D313 PolarHBondContact OG1-OD2 2.84Å
218	T	89.9	Confident	92.7	Very high	65 Å²	65	48.6 Å²	48.6	40%	0.399	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-74.4	151.9	172.7	68.5	0	0	0	0	110.7	G220 N221 E222	T218-G220 PolarHBondContact O-N 3.41Å; T218-G220 VanDerWaalsContact O-N 3.16Å; T218-N221 PolarHBondContact O-N 3.22Å; T218-N221 PolarHBondContact OG1-N 2.95Å; T218-N221 PolarHBondContact OG1-ND2 2.95Å; T218-E222 PolarHBondContact O-N 3.35Å
219	K	87.4	Confident	92.6	Very high	114 Å²	114	47.8 Å²	47.8	50%	0.496	25%	0.245	S	C	.	.	H	α-helix	trans	-59.7	-26.7	178.5	-62.7	177.2	-172.3	175.6	0	113.5	G274 L276	K219-G274 VanDerWaalsContact CE-O 3.28Å; K219-G274 WeakPolarHBondContact CE-O 3.11Å; K219-G274 PolarHBondContact NZ-O 3.48Å; K219-L276 WeakPolarHBondContact CE-O 3.47Å
220	G	87.4	Confident	92.4	Very high	46 Å²	46	51.2 Å²	51.2	47%	0.474	26%	0.26	S	S	.	.	H	α-helix	trans	-63.9	-48.1	170.2	0	0	0	0	0	112	T218 T223	T218-G220 PolarHBondContact O-N 3.41Å; T218-G220 VanDerWaalsContact O-N 3.16Å; G220-T223 PolarHBondContact O-N 3.05Å; G220-T223 PolarHBondContact O-OG1 2.9Å
221	N	92.6	Very high	92.2	Very high	17 Å²	17	53.7 Å²	53.7	9%	0.091	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-31.3	178.5	-70.3	-17.5	0	0	0	112.7	T217 T218 T223 R224 L225 D313	T217-N221 HydrophobicContact CG2-CB 3.76Å; T217-N221 WeakPolarHBondContact OG1-CB 3.36Å; T218-N221 PolarHBondContact O-N 3.22Å; T218-N221 PolarHBondContact OG1-N 2.95Å; T218-N221 PolarHBondContact OG1-ND2 2.95Å; N221-T223 VanDerWaalsContact C-N 3.33Å; N221-T223 PolarHBondContact O-N 3.44Å; N221-R224 PolarHBondContact O-N 3.27Å; N221-R224 VanDerWaalsContact O-N 3.16Å; N221-L225 WeakPolarHBondContact O-CG 3.46Å; N221-L225 PolarHBondContact O-N 3.5Å; N221-D313 VanDerWaalsContact ND2-C 3.28Å; N221-D313 PolarHBondContact ND2-O 2.95Å; N221-D313 PolarHBondContact ND2-OD2 3.43Å
222	E	92.4	Very high	92	Very high	23 Å²	23	54 Å²	54	11%	0.107	27%	0.265	C	S	.	.	H	α-helix	trans	-51.8	-48.4	172.2	-177.6	175.4	-154.4	0	0	112	T218 R224 L225 N226 S257 S277 N278 F280	T218-E222 PolarHBondContact O-N 3.35Å; E222-R224 VanDerWaalsContact C-N 3.34Å; E222-R224 PolarHBondContact O-N 3.48Å; E222-L225 PolarHBondContact O-N 2.94Å; E222-N226 VanDerWaalsContact O-CB 3.29Å; E222-N226 WeakPolarHBondContact O-CB 3.34Å; E222-N226 PolarHBondContact O-N 3.18Å; E222-N226 PolarHBondContact O-ND2 2.79Å; E222-S257 PolarHBondContact OE1-OG 3.25Å; E222-S277 WeakPolarHBondContact OE2-CA 3.42Å; E222-S277 VanDerWaalsContact OE2-CB 3.27Å; E222-S277 WeakPolarHBondContact OE2-CB 3.41Å; E222-N278 PolarHBondContact OE1-N 2.93Å; E222-N278 PolarHBondContact OE1-ND2 2.91Å; E222-F280 HydrophobicContact CB-CE2 4.4Å; E222-F280 HydrophobicContact CB-CZ 4.46Å; E222-F280 HydrophobicContact CG-CE2 4.22Å; E222-F280 HydrophobicContact CG-CZ 4.13Å
223	T	91.6	Very high	91.7	Very high	93 Å²	93	51.6 Å²	51.6	57%	0.571	26%	0.261	S	S	*	.	H	α-helix	trans	-63.1	-39.1	179.5	65.9	0	0	0	0	112.7	G220 N221 K227	G220-T223 PolarHBondContact O-N 3.05Å; G220-T223 PolarHBondContact O-OG1 2.9Å; N221-T223 VanDerWaalsContact C-N 3.33Å; N221-T223 PolarHBondContact O-N 3.44Å; T223-K227 WeakPolarHBondContact O-CB 3.34Å; T223-K227 PolarHBondContact O-N 3.33Å
224	R	92.8	Very high	91.6	Very high	133 Å²	133	48.6 Å²	48.6	50%	0.502	25%	0.245	S	C	.	.	H	α-helix	trans	-69	-46.5	178.6	-70.8	179.7	164.3	-163.8	-7.3	111.9	N221 E222 K227 A228	N221-R224 PolarHBondContact O-N 3.27Å; N221-R224 VanDerWaalsContact O-N 3.16Å; E222-R224 VanDerWaalsContact C-N 3.34Å; E222-R224 PolarHBondContact O-N 3.48Å; R224-K227 PolarHBondContact O-N 3.41Å; R224-A228 WeakPolarHBondContact O-CB 3.37Å; R224-A228 PolarHBondContact O-N 3.19Å
225	L	94.6	Very high	91.6	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-41.6	178.9	-67.8	-176.3	0	0	0	111.8	F196 T217 N221 E222 A228 F229 V235 L237 I253 F280	F196-L225 HydrophobicContact CB-CD2 4.08Å; F196-L225 HydrophobicContact CD1-CD2 3.75Å; F196-L225 HydrophobicContact CD2-CD2 3.56Å; F196-L225 HydrophobicContact CE1-CD2 3.98Å; F196-L225 HydrophobicContact CE2-CD2 3.81Å; F196-L225 HydrophobicContact CG-CD2 3.53Å; F196-L225 HydrophobicContact CZ-CD2 4.01Å; T217-L225 HydrophobicContact CG2-CD1 4Å; N221-L225 WeakPolarHBondContact O-CG 3.46Å; N221-L225 PolarHBondContact O-N 3.5Å; E222-L225 PolarHBondContact O-N 2.94Å; L225-A228 PolarHBondContact O-N 2.72Å; L225-F229 VanDerWaalsContact O-CB 3.29Å; L225-F229 WeakPolarHBondContact O-CB 3.48Å; L225-F229 PolarHBondContact O-N 3.25Å; L225-V235 HydrophobicContact CD2-CG1 4.37Å; L225-L237 HydrophobicContact CD1-CD2 4.07Å; L225-L237 HydrophobicContact CD2-CD2 3.68Å; L225-I253 HydrophobicContact CB-CD1 4.17Å; L225-I253 HydrophobicContact CD1-CD1 4.44Å; L225-I253 HydrophobicContact CD2-CD1 4.34Å; L225-F280 HydrophobicContact CB-CE1 3.84Å; L225-F280 HydrophobicContact CB-CE2 4.42Å; L225-F280 HydrophobicContact CB-CZ 3.69Å; L225-F280 HydrophobicContact CD1-CE2 4.26Å; L225-F280 HydrophobicContact CD1-CZ 4.34Å
226	N	93.3	Very high	91.7	Very high	25 Å²	25	47.5 Å²	47.5	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-45.4	174	-80.9	-36.4	0	0	0	111.5	E222 A228 F229 F230 S256 S257 F280	E222-N226 VanDerWaalsContact O-CB 3.29Å; E222-N226 WeakPolarHBondContact O-CB 3.34Å; E222-N226 PolarHBondContact O-N 3.18Å; E222-N226 PolarHBondContact O-ND2 2.79Å; N226-A228 PolarHBondContact O-N 3.48Å; N226-F229 PolarHBondContact O-N 3.3Å; N226-F230 WeakPolarHBondContact O-CD2 3.37Å; N226-F230 PolarHBondContact O-N 3.27Å; N226-S256 PolarHBondContact OD1-OG 3.37Å; N226-S257 PolarHBondContact ND2-OG 2.88Å; N226-S257 PolarHBondContact OD1-N 3.25Å; N226-F280 WeakPolarHBondContact OD1-CE1 3.49Å
227	K	93.3	Very high	91.8	Very high	126 Å²	126	47.2 Å²	47.2	55%	0.548	24%	0.238	S	C	.	.	H	α-helix	trans	-57.9	-49.8	175	-166.5	-165.1	-176.7	-54.4	0	111.2	T223 R224 F229 F230 D231	T223-K227 WeakPolarHBondContact O-CB 3.34Å; T223-K227 PolarHBondContact O-N 3.33Å; R224-K227 PolarHBondContact O-N 3.41Å; K227-F229 VanDerWaalsContact C-N 3.28Å; K227-F229 PolarHBondContact O-N 2.97Å; K227-F230 PolarHBondContact O-N 3.17Å; K227-D231 IonicContact NZ-OD1 3.89Å; K227-D231 PolarHBondContact NZ-OD1 3.12Å; K227-D231 IonicContact NZ-OD2 2.69Å; K227-D231 PolarHBondContact NZ-OD2 3.42Å; K227-D231 VanDerWaalsContact O-CG 3.25Å; K227-D231 PolarHBondContact O-N 3.44Å
228	A	93	Very high	92.1	Very high	2 Å²	2	47 Å²	47	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-33.5	178.8	0	0	0	0	0	113.1	K194 F196 R224 L225 N226 F230 D231 Y232 V235	K194-A228 HydrophobicContact CD-CB 4.18Å; F196-A228 HydrophobicContact CE2-CB 3.72Å; F196-A228 HydrophobicContact CZ-CB 3.71Å; R224-A228 WeakPolarHBondContact O-CB 3.37Å; R224-A228 PolarHBondContact O-N 3.19Å; L225-A228 PolarHBondContact O-N 2.72Å; N226-A228 PolarHBondContact O-N 3.48Å; A228-F230 VanDerWaalsContact C-N 3.29Å; A228-F230 PolarHBondContact O-N 2.62Å; A228-D231 PolarHBondContact O-N 3.41Å; A228-Y232 HydrophobicContact CB-CD2 4.33Å; A228-Y232 WeakPolarHBondContact O-CB 3.35Å; A228-Y232 PolarHBondContact O-N 2.95Å; A228-V235 VanDerWaalsContact C-CG2 3.47Å; A228-V235 HydrophobicContact CB-CG2 3.85Å; A228-V235 WeakPolarHBondContact O-CG2 3.23Å
229	F	92.3	Very high	92.5	Very high	11 Å²	11	44 Å²	44	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-27.2	178	176.6	-96.6	0	0	0	113.5	L225 N226 K227 I253 I254 A255 R353	L225-F229 VanDerWaalsContact O-CB 3.29Å; L225-F229 WeakPolarHBondContact O-CB 3.48Å; L225-F229 PolarHBondContact O-N 3.25Å; N226-F229 PolarHBondContact O-N 3.3Å; K227-F229 VanDerWaalsContact C-N 3.28Å; K227-F229 PolarHBondContact O-N 2.97Å; F229-I253 HydrophobicContact CD2-CB 4Å; F229-I253 HydrophobicContact CD2-CG2 3.49Å; F229-I253 VanDerWaalsContact CD2-CG2 3.49Å; F229-I253 HydrophobicContact CE2-CB 4.49Å; F229-I253 HydrophobicContact CE2-CG2 3.88Å; F229-I253 HydrophobicContact CG-CG2 4.26Å; F229-I254 VanDerWaalsContact CE2-O 3.3Å; F229-I254 WeakPolarHBondContact CE2-O 3.41Å; F229-I254 VanDerWaalsContact CZ-O 3.27Å; F229-I254 WeakPolarHBondContact CZ-O 3.47Å; F229-A255 VanDerWaalsContact CZ-CA 3.49Å; F229-R353 HydrophobicContact CE1-CG 4.11Å; F229-R353 HydrophobicContact CZ-CG 3.95Å; F229-R353 VanDerWaalsContact CZ-NE 3.29Å
230	F	90.3	Very high	92.9	Very high	73 Å²	73	38.5 Å²	38.5	32%	0.32	19%	0.194	S	C	.	.	H	α-helix	trans	-89	-35	172.3	-62.7	-63.1	0	0	0	112.9	N226 K227 A228 A356 L360	N226-F230 WeakPolarHBondContact O-CD2 3.37Å; N226-F230 PolarHBondContact O-N 3.27Å; K227-F230 PolarHBondContact O-N 3.17Å; A228-F230 VanDerWaalsContact C-N 3.29Å; A228-F230 PolarHBondContact O-N 2.62Å; F230-A356 HydrophobicContact CE1-CB 4.3Å; F230-L360 HydrophobicContact CZ-CD1 4.29Å
231	D	90.7	Very high	93.3	Very high	91 Å²	91	36.4 Å²	36.4	49%	0.487	17%	0.172	S	C	.	.	H	α-helix	trans	-72.4	-34.5	179	-65.9	-19.5	0	0	0	113.3	K227 A228	K227-D231 IonicContact NZ-OD1 3.89Å; K227-D231 PolarHBondContact NZ-OD1 3.12Å; K227-D231 IonicContact NZ-OD2 2.69Å; K227-D231 PolarHBondContact NZ-OD2 3.42Å; K227-D231 VanDerWaalsContact O-CG 3.25Å; K227-D231 PolarHBondContact O-N 3.44Å; A228-D231 PolarHBondContact O-N 3.41Å
232	Y	90.3	Very high	93.3	Very high	86 Å²	86	40 Å²	40	34%	0.337	19%	0.185	S	C	.	.	S	Bend	trans	-118.8	150.5	-169.1	-66.3	-93.8	0	0	0	113.7	K194 A228	K194-Y232 HydrophobicContact CB-CD1 4.15Å; K194-Y232 HydrophobicContact CB-CD2 4Å; K194-Y232 HydrophobicContact CB-CE1 4.36Å; K194-Y232 HydrophobicContact CB-CE2 4.25Å; K194-Y232 HydrophobicContact CB-CG 3.97Å; K194-Y232 HydrophobicContact CD-CD2 4.09Å; K194-Y232 HydrophobicContact CD-CE2 3.65Å; A228-Y232 HydrophobicContact CB-CD2 4.33Å; A228-Y232 WeakPolarHBondContact O-CB 3.35Å; A228-Y232 PolarHBondContact O-N 2.95Å
233	N	87.1	Confident	93.3	Very high	73 Å²	73	48.4 Å²	48.4	39%	0.39	22%	0.224	S	C	.	.	S	Bend	trans	-64.6	-41.8	178.5	-82	-51	0	0	0	112	S192 R353	S192-N233 PolarHBondContact O-N 3.34Å; N233-R353 PolarHBondContact O-NH1 2.85Å
234	N	92.3	Very high	93.3	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.5	174	-50.1	-64.1	0	0	0	109.9	L189 T193 K194 R252	L189-N234 PolarHBondContact O-ND2 3.03Å; T193-N234 WeakPolarHBondContact CA-O 3.48Å; T193-N234 HydrophobicContact CG2-CB 3.87Å; T193-N234 PolarHBondContact OG1-ND2 2.9Å; K194-N234 PolarHBondContact N-O 3.31Å; K194-N234 VanDerWaalsContact N-O 3.08Å; N234-R252 HydrophobicContact CB-CG 4.37Å; N234-R252 WeakPolarHBondContact OD1-CD 3.13Å; N234-R252 PolarHBondContact OD1-NH1 3.31Å
235	V	94.9	Very high	93.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.7	166.3	178.2	0	0	0	0	107.2	K194 F196 L225 A228 L237 R252 I253	K194-V235 WeakPolarHBondContact O-CA 3.37Å; F196-V235 HydrophobicContact CD2-CG1 3.65Å; F196-V235 HydrophobicContact CE2-CG1 3.67Å; L225-V235 HydrophobicContact CD2-CG1 4.37Å; A228-V235 VanDerWaalsContact C-CG2 3.47Å; A228-V235 HydrophobicContact CB-CG2 3.85Å; A228-V235 WeakPolarHBondContact O-CG2 3.23Å; V235-L237 HydrophobicContact CG1-CD2 4.49Å; V235-R252 CarbonylContact O-C 3.51Å; V235-R252 WeakPolarHBondContact O-CA 3.46Å; V235-I253 HydrophobicContact CB-CB 4.37Å; V235-I253 HydrophobicContact CB-CD1 4.04Å; V235-I253 HydrophobicContact CB-CG1 4.2Å; V235-I253 HydrophobicContact CG1-CD1 3.65Å; V235-I253 HydrophobicContact CG1-CG1 4.13Å; V235-I253 PolarHBondContact O-N 3.34Å
236	L	95.8	Very high	93.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.7	-179.3	-62.7	-175.7	0	0	0	110.3	F190 T193 K194 Y195 F196 F250 A251 R252 I285	F190-L236 HydrophobicContact CD1-CD1 4.32Å; F190-L236 HydrophobicContact CE1-CD1 4.35Å; T193-L236 HydrophobicContact CG2-CB 4.43Å; T193-L236 HydrophobicContact CG2-CD1 3.8Å; T193-L236 HydrophobicContact CG2-CG 3.68Å; K194-L236 PolarHBondContact O-N 3.38Å; Y195-L236 WeakPolarHBondContact CA-O 3.45Å; Y195-L236 HydrophobicContact CD1-CB 4.02Å; Y195-L236 HydrophobicContact CD1-CD1 4.12Å; Y195-L236 HydrophobicContact CE1-CB 4.42Å; Y195-L236 HydrophobicContact CE1-CD1 3.65Å; F196-L236 PolarHBondContact N-O 3.4Å; L236-F250 HydrophobicContact CD1-CD2 4.38Å; L236-F250 HydrophobicContact CD1-CE2 4.39Å; L236-A251 WeakPolarHBondContact CA-O 3.43Å; L236-R252 HydrophobicContact CD2-CB 3.57Å; L236-R252 HydrophobicContact CD2-CG 3.86Å; L236-I285 HydrophobicContact CD2-CD1 3.73Å
237	L	96.3	Very high	93.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.2	174.1	-57.6	-172.7	0	0	0	108.2	F196 I198 L225 V235 F239 F250 A251 I253 I282	F196-L237 HydrophobicContact CB-CD2 3.93Å; I198-L237 HydrophobicContact CD1-CD2 4.19Å; I198-L237 HydrophobicContact CG1-CB 3.95Å; I198-L237 HydrophobicContact CG1-CD1 4.38Å; I198-L237 HydrophobicContact CG1-CD2 4.07Å; I198-L237 HydrophobicContact CG1-CG 4.35Å; L225-L237 HydrophobicContact CD1-CD2 4.07Å; L225-L237 HydrophobicContact CD2-CD2 3.68Å; V235-L237 HydrophobicContact CG1-CD2 4.49Å; L237-F239 HydrophobicContact CB-CE2 3.72Å; L237-F239 HydrophobicContact CB-CZ 3.77Å; L237-F239 HydrophobicContact CD1-CZ 4.12Å; L237-F239 WeakPolarHBondContact O-CD2 3.31Å; L237-F239 WeakPolarHBondContact O-CE2 3.04Å; L237-F250 CarbonylContact O-C 3.49Å; L237-F250 WeakPolarHBondContact O-CA 3.46Å; L237-F250 WeakPolarHBondContact O-CB 3.29Å; L237-A251 PolarHBondContact N-O 3.28Å; L237-A251 PolarHBondContact O-N 2.97Å; L237-I253 HydrophobicContact CD1-CD1 4.29Å; L237-I253 HydrophobicContact CD1-CG1 4.1Å; L237-I253 HydrophobicContact CD2-CD1 4.19Å; L237-I253 HydrophobicContact CD2-CG1 4.46Å; L237-I253 HydrophobicContact CG-CD1 4.3Å; L237-I253 HydrophobicContact CG-CG1 4.06Å; L237-I282 HydrophobicContact CD1-CG2 4.15Å
238	I	96.5	Very high	93.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.3	178.1	-52.4	-177	0	0	0	107.8	Y195 F196 I198 F247 F250 I317 L325 F329	Y195-I238 HydrophobicContact CD1-CD1 4.28Å; F196-I238 PolarHBondContact O-N 2.87Å; I198-I238 PolarHBondContact N-O 3Å; I238-F247 HydrophobicContact CG2-CD1 3.7Å; I238-F247 HydrophobicContact CG2-CE1 4.17Å; I238-F247 HydrophobicContact CG2-CG 4.36Å; I238-F250 HydrophobicContact CB-CB 4.46Å; I238-F250 HydrophobicContact CG1-CB 4.11Å; I238-I317 HydrophobicContact CD1-CD1 4.1Å; I238-L325 HydrophobicContact CD1-CD2 3.7Å; I238-L325 HydrophobicContact CD1-CG 4.14Å; I238-L325 HydrophobicContact CG2-CD2 4.17Å; I238-F329 HydrophobicContact CG2-CE2 4.47Å; I238-F329 HydrophobicContact CG2-CZ 4.2Å
239	F	97.1	Very high	93.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132	-170	-65.8	-89.7	0	0	0	111.6	I198 I206 W215 L237 F247 Q248 G249 A251 I282 W284	I198-F239 HydrophobicContact CB-CD1 3.93Å; I198-F239 HydrophobicContact CB-CE1 4.13Å; I198-F239 HydrophobicContact CG1-CE1 4.38Å; I198-F239 HydrophobicContact CG2-CD1 3.64Å; I198-F239 HydrophobicContact CG2-CE1 3.74Å; I206-F239 HydrophobicContact CD1-CB 4.05Å; I206-F239 HydrophobicContact CD1-CD1 3.63Å; I206-F239 HydrophobicContact CD1-CG 4.17Å; W215-F239 HydrophobicContact CB-CE1 4.5Å; W215-F239 HydrophobicContact CB-CZ 4.47Å; W215-F239 AromaticContact CD2-CE1 3.64Å; W215-F239 HydrophobicContact CD2-CE1 3.64Å; W215-F239 HydrophobicContact CD2-CZ 4.44Å; W215-F239 AromaticContact CE2-CE1 3.92Å; W215-F239 AromaticContact CE3-CE1 3.91Å; W215-F239 HydrophobicContact CE3-CE1 3.91Å; W215-F239 AromaticContact CG-CE1 3.89Å; W215-F239 HydrophobicContact CG-CE1 3.89Å; W215-F239 HydrophobicContact CG-CZ 4.27Å; W215-F239 HydrophobicContact CZ2-CE1 4.42Å; W215-F239 HydrophobicContact CZ3-CE1 4.39Å; L237-F239 HydrophobicContact CB-CE2 3.72Å; L237-F239 HydrophobicContact CB-CZ 3.77Å; L237-F239 HydrophobicContact CD1-CZ 4.12Å; L237-F239 WeakPolarHBondContact O-CD2 3.31Å; L237-F239 WeakPolarHBondContact O-CE2 3.04Å; F239-F247 CarbonylContact O-C 3.55Å; F239-F247 VanDerWaalsContact O-CA 3.24Å; F239-F247 WeakPolarHBondContact O-CA 3.48Å; F239-F247 WeakPolarHBondContact O-CB 3.41Å; F239-Q248 PolarHBondContact O-N 3.32Å; F239-G249 PolarHBondContact N-O 3.4Å; F239-A251 HydrophobicContact CE2-CB 3.85Å; F239-I282 HydrophobicContact CE2-CD1 4.36Å; F239-I282 HydrophobicContact CZ-CD1 3.94Å; F239-W284 HydrophobicContact CB-CH2 4.34Å; F239-W284 HydrophobicContact CD1-CH2 4.38Å; F239-W284 AromaticContact CD2-CH2 3.38Å; F239-W284 HydrophobicContact CD2-CH2 3.38Å; F239-W284 HydrophobicContact CD2-CZ2 4.22Å; F239-W284 AromaticContact CD2-CZ3 3.62Å; F239-W284 HydrophobicContact CD2-CZ3 3.62Å; F239-W284 AromaticContact CE2-CH2 3.69Å; F239-W284 HydrophobicContact CE2-CH2 3.69Å; F239-W284 HydrophobicContact CE2-CZ2 4.08Å; F239-W284 HydrophobicContact CE2-CZ3 4.07Å; F239-W284 AromaticContact CG-CH2 3.78Å; F239-W284 HydrophobicContact CG-CH2 3.78Å; F239-W284 HydrophobicContact CG-CZ3 4.3Å; F239-W284 HydrophobicContact CZ-CH2 4.31Å; F239-W284 HydrophobicContact CZ-CZ2 4.39Å
240	S	96.1	Very high	93.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	114.4	171.6	176.3	0	0	0	0	111.5	I198 K199 S200 R246 Q248 F292	I198-S240 PolarHBondContact O-N 3.26Å; K199-S240 WeakPolarHBondContact CA-O 3.43Å; K199-S240 WeakPolarHBondContact CE-O 3.31Å; K199-S240 PolarHBondContact NZ-OG 2.89Å; S200-S240 PolarHBondContact N-O 3.43Å; S240-R246 PolarHBondContact OG-O 3.12Å; S240-Q248 VanDerWaalsContact CA-OE1 3.24Å; S240-F292 WeakPolarHBondContact OG-CZ 3.39Å
241	V	95.5	Very high	94.2	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	136.9	170.8	-174.8	0	0	0	0	109	S200 F203 I206 S244 Q248	S200-V241 WeakPolarHBondContact O-CA 3.29Å; F203-V241 HydrophobicContact CD1-CB 4.32Å; F203-V241 HydrophobicContact CD1-CG1 4.35Å; F203-V241 HydrophobicContact CD1-CG2 3.9Å; F203-V241 HydrophobicContact CD2-CG1 3.99Å; F203-V241 HydrophobicContact CE1-CB 4.17Å; F203-V241 HydrophobicContact CE1-CG1 4.3Å; F203-V241 HydrophobicContact CE1-CG2 4.19Å; F203-V241 HydrophobicContact CE2-CG1 3.93Å; F203-V241 HydrophobicContact CG-CG1 4.21Å; F203-V241 HydrophobicContact CG-CG2 4.25Å; F203-V241 HydrophobicContact CZ-CB 4.35Å; F203-V241 HydrophobicContact CZ-CG1 4.1Å; I206-V241 HydrophobicContact CG1-CG2 3.59Å; V241-S244 WeakPolarHBondContact O-CB 3.27Å; V241-S244 PolarHBondContact O-N 2.85Å; V241-S244 PolarHBondContact O-OG 3.35Å; V241-Q248 HydrophobicContact CG2-CG 4.31Å
242	R	93.8	Very high	94.3	Very high	93 Å²	93	30.7 Å²	30.7	35%	0.351	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	148.3	172.2	-71.9	-179.8	174.8	73.6	10.7	110.5	K199 S200 N201 S244	K199-R242 PolarHBondContact O-NH1 3.43Å; S200-R242 PolarHBondContact O-N 3.22Å; N201-R242 WeakPolarHBondContact OD1-CD 3.3Å; N201-R242 PolarHBondContact OD1-NH1 3.49Å; R242-S244 PolarHBondContact O-N 3.36Å
243	E	91.3	Very high	94.6	Very high	198 Å²	198	26.6 Å²	26.6	93%	0.925	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	-9.7	-177.3	-70.5	132.8	-120.9	0	0	118	G245	E243-G245 PolarHBondContact O-N 3.16Å; E243-G245 VanDerWaalsContact O-N 3.07Å
244	S	93.3	Very high	94.8	Very high	20 Å²	20	24.6 Å²	24.6	14%	0.14	12%	0.119	C	C	.	.	S	Bend	trans	-68	-8.5	-174.7	69.8	0	0	0	0	117.3	F203 V241 R242 R246 Q248	F203-S244 VanDerWaalsContact CZ-CB 3.43Å; V241-S244 WeakPolarHBondContact O-CB 3.27Å; V241-S244 PolarHBondContact O-N 2.85Å; V241-S244 PolarHBondContact O-OG 3.35Å; R242-S244 PolarHBondContact O-N 3.36Å; S244-R246 WeakPolarHBondContact O-CG 3.25Å; S244-R246 PolarHBondContact O-N 3.04Å; S244-R246 VanDerWaalsContact O-N 3.13Å; S244-R246 PolarHBondContact O-NE 3.04Å; S244-R246 PolarHBondContact OG-O 3.35Å; S244-Q248 VanDerWaalsContact CB-NE2 3.33Å; S244-Q248 PolarHBondContact OG-NE2 3.49Å
245	G	93.5	Very high	94.8	Very high	38 Å²	38	25.7 Å²	25.7	39%	0.392	13%	0.129	S	C	.	.	S	Bend	trans	65.3	9	-177.5	0	0	0	0	0	115.8	E243 F292	E243-G245 PolarHBondContact O-N 3.16Å; E243-G245 VanDerWaalsContact O-N 3.07Å; G245-F292 WeakPolarHBondContact O-CB 3.36Å; G245-F292 WeakPolarHBondContact O-CD2 3.46Å; G245-F292 WeakPolarHBondContact O-CG 3.36Å; G245-F292 PolarHBondContact O-N 3.01Å
246	R	95	Very high	94.5	Very high	106 Å²	106	27.5 Å²	27.5	40%	0.4	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	169.5	-171.9	70.4	-172.3	72.7	-172.7	-2.1	113.4	S240 S244 D289 L290 F292	S240-R246 PolarHBondContact OG-O 3.12Å; S244-R246 WeakPolarHBondContact O-CG 3.25Å; S244-R246 PolarHBondContact O-N 3.04Å; S244-R246 VanDerWaalsContact O-N 3.13Å; S244-R246 PolarHBondContact O-NE 3.04Å; S244-R246 PolarHBondContact OG-O 3.35Å; R246-D289 WeakPolarHBondContact CD-OD2 3.33Å; R246-D289 IonicContact CZ-OD2 3.49Å; R246-D289 IonicContact NE-OD2 2.94Å; R246-D289 IonicContact NH1-OD2 3.86Å; R246-D289 PolarHBondContact NH1-OD2 3.24Å; R246-L290 WeakPolarHBondContact CA-O 3.11Å; R246-L290 WeakPolarHBondContact CB-O 3.3Å; R246-F292 WeakPolarHBondContact O-CE1 3.35Å; R246-F292 WeakPolarHBondContact O-CZ 3.49Å
247	F	96.5	Very high	94.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	148.7	159.4	-55.5	-87.4	0	0	0	109.1	L197 I238 F239 D289 L290 F292 T295 V308 K309 L325 F329	L197-F247 HydrophobicContact CD1-CD1 4.41Å; L197-F247 HydrophobicContact CD1-CE1 3.81Å; I238-F247 HydrophobicContact CG2-CD1 3.7Å; I238-F247 HydrophobicContact CG2-CE1 4.17Å; I238-F247 HydrophobicContact CG2-CG 4.36Å; F239-F247 CarbonylContact O-C 3.55Å; F239-F247 VanDerWaalsContact O-CA 3.24Å; F239-F247 WeakPolarHBondContact O-CA 3.48Å; F239-F247 WeakPolarHBondContact O-CB 3.41Å; F247-D289 CarbonylContact O-C 3.49Å; F247-D289 WeakPolarHBondContact O-CA 3.42Å; F247-L290 HydrophobicContact CB-CB 4.34Å; F247-L290 HydrophobicContact CD2-CB 4.48Å; F247-L290 HydrophobicContact CD2-CD2 4.44Å; F247-L290 HydrophobicContact CD2-CG 4.36Å; F247-L290 PolarHBondContact N-O 2.77Å; F247-L290 PolarHBondContact O-N 3.22Å; F247-F292 HydrophobicContact CD1-CE1 4.26Å; F247-F292 AromaticContact CD2-CD1 3.76Å; F247-F292 HydrophobicContact CD2-CD1 3.76Å; F247-F292 AromaticContact CD2-CE1 3.7Å; F247-F292 HydrophobicContact CD2-CE1 3.7Å; F247-F292 HydrophobicContact CE1-CE1 4.12Å; F247-F292 AromaticContact CE2-CD1 3.49Å; F247-F292 HydrophobicContact CE2-CD1 3.49Å; F247-F292 VanDerWaalsContact CE2-CD1 3.49Å; F247-F292 AromaticContact CE2-CE1 3.54Å; F247-F292 HydrophobicContact CE2-CE1 3.54Å; F247-F292 HydrophobicContact CG-CE1 4.06Å; F247-F292 HydrophobicContact CZ-CD1 4.1Å; F247-F292 AromaticContact CZ-CE1 3.77Å; F247-F292 HydrophobicContact CZ-CE1 3.77Å; F247-T295 HydrophobicContact CD2-CG2 4.25Å; F247-T295 HydrophobicContact CE2-CG2 3.87Å; F247-V308 HydrophobicContact CZ-CG1 4.33Å; F247-K309 HydrophobicContact CZ-CB 4.29Å; F247-L325 HydrophobicContact CD2-CD1 4.27Å; F247-L325 HydrophobicContact CE1-CD2 4.23Å; F247-L325 HydrophobicContact CE2-CD1 3.9Å; F247-L325 HydrophobicContact CE2-CD2 4.48Å; F247-L325 HydrophobicContact CZ-CD1 4.27Å; F247-L325 HydrophobicContact CZ-CD2 4.03Å; F247-F329 HydrophobicContact CB-CE1 4.03Å; F247-F329 HydrophobicContact CB-CZ 3.76Å; F247-F329 HydrophobicContact CG-CZ 4.35Å
248	Q	95.3	Very high	93.7	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.023	15%	0.154	C	C	.	.			trans	-106.7	22.4	-179.2	-72.8	77.4	20.1	0	0	112.9	I206 K210 F239 S240 V241 S244 S288 D289	I206-Q248 HydrophobicContact CG2-CB 3.94Å; K210-Q248 WeakPolarHBondContact CE-O 3.14Å; K210-Q248 PolarHBondContact NZ-O 3.2Å; F239-Q248 PolarHBondContact O-N 3.32Å; S240-Q248 VanDerWaalsContact CA-OE1 3.24Å; V241-Q248 HydrophobicContact CG2-CG 4.31Å; S244-Q248 VanDerWaalsContact CB-NE2 3.33Å; S244-Q248 PolarHBondContact OG-NE2 3.49Å; Q248-S288 CarbonylContact C-O 3.55Å; Q248-D289 WeakPolarHBondContact CA-OD1 3.07Å
249	G	95	Very high	93.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.			trans	109.8	-176.1	-179.4	0	0	0	0	0	113.5	F239 S286 S288 F329	F239-G249 PolarHBondContact N-O 3.4Å; G249-S286 CarbonylContact C-O 3.6Å; G249-S286 WeakPolarHBondContact CA-O 3.21Å; G249-S288 WeakPolarHBondContact CA-O 3.27Å; G249-S288 PolarHBondContact N-O 3.4Å; G249-S288 VanDerWaalsContact N-O 3.13Å; G249-F329 VanDerWaalsContact CA-CE1 3.47Å
250	F	95.6	Very high	92.6	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	149.7	179.5	69.9	-80.5	0	0	0	112.8	I185 L236 L237 I238 I285 S286 C326 F329	I185-F250 HydrophobicContact CD1-CZ 4.2Å; L236-F250 HydrophobicContact CD1-CD2 4.38Å; L236-F250 HydrophobicContact CD1-CE2 4.39Å; L237-F250 CarbonylContact O-C 3.49Å; L237-F250 WeakPolarHBondContact O-CA 3.46Å; L237-F250 WeakPolarHBondContact O-CB 3.29Å; I238-F250 HydrophobicContact CB-CB 4.46Å; I238-F250 HydrophobicContact CG1-CB 4.11Å; F250-I285 HydrophobicContact CD2-CB 4.08Å; F250-I285 HydrophobicContact CD2-CD1 4.33Å; F250-I285 HydrophobicContact CE2-CB 3.57Å; F250-I285 HydrophobicContact CE2-CD1 3.88Å; F250-I285 HydrophobicContact CE2-CG1 4.29Å; F250-I285 HydrophobicContact CE2-CG2 3.6Å; F250-I285 HydrophobicContact CZ-CB 3.91Å; F250-I285 HydrophobicContact CZ-CG2 3.57Å; F250-I285 PolarHBondContact O-N 3.36Å; F250-S286 PolarHBondContact N-O 3.32Å; F250-S286 PolarHBondContact O-N 3.24Å; F250-C326 VanDerWaalsContact CD2-SG 3.57Å; F250-C326 HydrophobicContact CE1-CB 4.44Å; F250-C326 HydrophobicContact CE2-CB 4.21Å; F250-C326 VanDerWaalsContact CE2-SG 3.59Å; F250-C326 HydrophobicContact CZ-CB 4.07Å; F250-F329 HydrophobicContact CD1-CB 4.48Å; F250-F329 HydrophobicContact CD1-CD1 4.25Å; F250-F329 AromaticContact CD1-CD2 3.58Å; F250-F329 HydrophobicContact CD1-CD2 3.58Å; F250-F329 HydrophobicContact CD1-CE1 4.43Å; F250-F329 AromaticContact CD1-CE2 3.76Å; F250-F329 HydrophobicContact CD1-CE2 3.76Å; F250-F329 AromaticContact CD1-CG 3.84Å; F250-F329 HydrophobicContact CD1-CG 3.84Å; F250-F329 HydrophobicContact CD1-CZ 4.19Å; F250-F329 HydrophobicContact CE1-CB 3.99Å; F250-F329 AromaticContact CE1-CD2 3.68Å; F250-F329 HydrophobicContact CE1-CD2 3.68Å; F250-F329 HydrophobicContact CE1-CE2 4.32Å; F250-F329 AromaticContact CE1-CG 3.83Å; F250-F329 HydrophobicContact CE1-CG 3.83Å
251	A	95.6	Very high	92.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	148	-176.4	0	0	0	0	0	112.6	L236 L237 F239 I282 K283 W284	L236-A251 WeakPolarHBondContact CA-O 3.43Å; L237-A251 PolarHBondContact N-O 3.28Å; L237-A251 PolarHBondContact O-N 2.97Å; F239-A251 HydrophobicContact CE2-CB 3.85Å; A251-I282 HydrophobicContact CB-CB 3.97Å; A251-I282 HydrophobicContact CB-CD1 3.89Å; A251-I282 HydrophobicContact CB-CG1 4.33Å; A251-K283 CarbonylContact C-O 3.57Å; A251-K283 VanDerWaalsContact CA-O 3.24Å; A251-K283 WeakPolarHBondContact CA-O 3.39Å; A251-K283 WeakPolarHBondContact CB-O 3.39Å; A251-W284 HydrophobicContact CB-CB 4.5Å; A251-W284 HydrophobicContact CB-CD2 3.93Å; A251-W284 HydrophobicContact CB-CE3 4.19Å; A251-W284 HydrophobicContact CB-CG 4.1Å
252	R	94.8	Very high	91.6	Very high	14 Å²	14	54.4 Å²	54.4	5%	0.053	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	134.4	175.9	-170.9	176.1	70.6	105.5	15.2	111.1	N234 V235 L236 I254 I282 K283 I285 E349	N234-R252 HydrophobicContact CB-CG 4.37Å; N234-R252 WeakPolarHBondContact OD1-CD 3.13Å; N234-R252 PolarHBondContact OD1-NH1 3.31Å; V235-R252 CarbonylContact O-C 3.51Å; V235-R252 WeakPolarHBondContact O-CA 3.46Å; L236-R252 HydrophobicContact CD2-CB 3.57Å; L236-R252 HydrophobicContact CD2-CG 3.86Å; R252-I254 PolarHBondContact O-N 2.99Å; R252-I282 CarbonylContact O-C 3.54Å; R252-I282 VanDerWaalsContact O-CA 3.32Å; R252-I282 WeakPolarHBondContact O-CA 3.4Å; R252-K283 PolarHBondContact N-O 3.1Å; R252-K283 PolarHBondContact O-N 3.41Å; R252-I285 HydrophobicContact CB-CD1 4.03Å; R252-E349 IonicContact CZ-OE2 2.71Å; R252-E349 VanDerWaalsContact CZ-OE2 3.26Å; R252-E349 IonicContact NH1-OE2 3.3Å; R252-E349 PolarHBondContact NH1-OE2 3.46Å; R252-E349 VanDerWaalsContact NH2-CD 3.31Å; R252-E349 IonicContact NH2-OE1 2.93Å; R252-E349 PolarHBondContact NH2-OE1 3.28Å; R252-E349 IonicContact NH2-OE2 3.13Å; R252-E349 PolarHBondContact NH2-OE2 2.86Å
253	I	94.7	Very high	91.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121.4	170.8	-55.3	-175.5	0	0	0	109.2	L225 F229 V235 L237 A255 F280	L225-I253 HydrophobicContact CB-CD1 4.17Å; L225-I253 HydrophobicContact CD1-CD1 4.44Å; L225-I253 HydrophobicContact CD2-CD1 4.34Å; F229-I253 HydrophobicContact CD2-CB 4Å; F229-I253 HydrophobicContact CD2-CG2 3.49Å; F229-I253 VanDerWaalsContact CD2-CG2 3.49Å; F229-I253 HydrophobicContact CE2-CB 4.49Å; F229-I253 HydrophobicContact CE2-CG2 3.88Å; F229-I253 HydrophobicContact CG-CG2 4.26Å; V235-I253 HydrophobicContact CB-CB 4.37Å; V235-I253 HydrophobicContact CB-CD1 4.04Å; V235-I253 HydrophobicContact CB-CG1 4.2Å; V235-I253 HydrophobicContact CG1-CD1 3.65Å; V235-I253 HydrophobicContact CG1-CG1 4.13Å; V235-I253 PolarHBondContact O-N 3.34Å; L237-I253 HydrophobicContact CD1-CD1 4.29Å; L237-I253 HydrophobicContact CD1-CG1 4.1Å; L237-I253 HydrophobicContact CD2-CD1 4.19Å; L237-I253 HydrophobicContact CD2-CG1 4.46Å; L237-I253 HydrophobicContact CG-CD1 4.3Å; L237-I253 HydrophobicContact CG-CG1 4.06Å; I253-A255 WeakPolarHBondContact CG2-O 3.29Å; I253-F280 HydrophobicContact CD1-CD1 4.15Å; I253-F280 HydrophobicContact CG2-CD1 4.05Å
254	I	92.2	Very high	90.9	Very high	32 Å²	32	46.5 Å²	46.5	16%	0.164	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-45.8	175.8	-59.1	172.4	0	0	0	109.9	F229 R252 R281 K283	F229-I254 VanDerWaalsContact CE2-O 3.3Å; F229-I254 WeakPolarHBondContact CE2-O 3.41Å; F229-I254 VanDerWaalsContact CZ-O 3.27Å; F229-I254 WeakPolarHBondContact CZ-O 3.47Å; R252-I254 PolarHBondContact O-N 2.99Å; I254-R281 HydrophobicContact CB-CB 4.32Å; I254-R281 WeakPolarHBondContact CB-O 3.45Å; I254-R281 PolarHBondContact N-O 3.47Å; I254-K283 HydrophobicContact CD1-CB 3.81Å; I254-K283 HydrophobicContact CG1-CB 3.82Å
255	A	91.5	Very high	90.6	Very high	29 Å²	29	46.6 Å²	46.6	24%	0.24	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.6	-173.2	0	0	0	0	0	111.4	F229 I253 R281	F229-A255 VanDerWaalsContact CZ-CA 3.49Å; I253-A255 WeakPolarHBondContact CG2-O 3.29Å; A255-R281 HydrophobicContact CB-CB 4.23Å
256	S	89.6	Confident	90.1	Very high	39 Å²	39	47.7 Å²	47.7	27%	0.273	24%	0.235	S	C	.	.	S	Bend	trans	-48.8	156.8	164.9	-176.1	0	0	0	0	112.2	N226 D258	N226-S256 PolarHBondContact OD1-OG 3.37Å; S256-D258 PolarHBondContact O-N 3Å
257	S	88.7	Confident	89.2	Confident	19 Å²	19	45.3 Å²	45.3	13%	0.133	23%	0.228	C	C	.	.			trans	-56.2	127	-179.7	59.8	0	0	0	0	112.9	E222 N226 P279	E222-S257 PolarHBondContact OE1-OG 3.25Å; N226-S257 PolarHBondContact ND2-OG 2.88Å; N226-S257 PolarHBondContact OD1-N 3.25Å; S257-P279 WeakPolarHBondContact CA-O 3.18Å
258	D	87.3	Confident	87.8	Confident	24 Å²	24	49.6 Å²	49.6	13%	0.128	26%	0.258	C	S	.	.			trans	-116.2	113.5	-172.8	-168.5	-24.2	0	0	0	112.2	S256 R260 I261 P279	S256-D258 PolarHBondContact O-N 3Å; D258-R260 PolarHBondContact O-N 2.85Å; D258-R260 VanDerWaalsContact O-N 3.15Å; D258-R260 VanDerWaalsContact OD1-CB 3.29Å; D258-R260 WeakPolarHBondContact OD1-CB 3.42Å; D258-R260 WeakPolarHBondContact OD1-CG 3.19Å; D258-R260 IonicContact OD1-CZ 2.77Å; D258-R260 PolarHBondContact OD1-N 3.47Å; D258-R260 IonicContact OD1-NE 3.03Å; D258-R260 PolarHBondContact OD1-NE 3.49Å; D258-R260 IonicContact OD1-NH2 2.67Å; D258-R260 IonicContact OD2-CZ 3.4Å; D258-R260 IonicContact OD2-NE 2.58Å; D258-R260 PolarHBondContact OD2-NE 3.21Å; D258-R260 IonicContact OD2-NH2 3.29Å; D258-R260 PolarHBondContact OD2-NH2 3.1Å; D258-I261 HydrophobicContact CB-CD1 4.08Å; D258-I261 HydrophobicContact CB-CG1 4.32Å; D258-I261 PolarHBondContact O-N 3.45Å; D258-P279 PolarHBondContact N-O 3.3Å
259	P	85	Confident	86.1	Confident	89 Å²	89	55.7 Å²	55.7	58%	0.578	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.6	-177.8	28.6	-36.4	0	0	0	114.2	N278	P259-N278 WeakPolarHBondContact CA-OD1 3.18Å; P259-N278 VanDerWaalsContact CB-OD1 3.31Å; P259-N278 WeakPolarHBondContact CB-OD1 3.36Å
260	R	85.5	Confident	84.4	Confident	203 Å²	203	67.4 Å²	67.4	77%	0.766	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-22.8	-178.5	-59	172	-66.7	177.8	3.2	112.5	D258 K262	D258-R260 PolarHBondContact O-N 2.85Å; D258-R260 VanDerWaalsContact O-N 3.15Å; D258-R260 VanDerWaalsContact OD1-CB 3.29Å; D258-R260 WeakPolarHBondContact OD1-CB 3.42Å; D258-R260 WeakPolarHBondContact OD1-CG 3.19Å; D258-R260 IonicContact OD1-CZ 2.77Å; D258-R260 PolarHBondContact OD1-N 3.47Å; D258-R260 IonicContact OD1-NE 3.03Å; D258-R260 PolarHBondContact OD1-NE 3.49Å; D258-R260 IonicContact OD1-NH2 2.67Å; D258-R260 IonicContact OD2-CZ 3.4Å; D258-R260 IonicContact OD2-NE 2.58Å; D258-R260 PolarHBondContact OD2-NE 3.21Å; D258-R260 IonicContact OD2-NH2 3.29Å; D258-R260 PolarHBondContact OD2-NH2 3.1Å; R260-K262 PolarHBondContact O-N 3.36Å
261	I	86.4	Confident	82.8	Confident	48 Å²	48	72.3 Å²	72.3	25%	0.246	37%	0.369	C	S	.	.			trans	-83	113.3	-179.2	-64.2	175.6	0	0	0	108.2	V214 D258 V263 P279 R281	V214-I261 HydrophobicContact CG1-CD1 4.48Å; V214-I261 HydrophobicContact CG1-CG2 4.18Å; D258-I261 HydrophobicContact CB-CD1 4.08Å; D258-I261 HydrophobicContact CB-CG1 4.32Å; D258-I261 PolarHBondContact O-N 3.45Å; I261-V263 HydrophobicContact CG2-CG2 3.95Å; I261-P279 HydrophobicContact CB-CG 3.78Å; I261-P279 HydrophobicContact CG2-CB 4.47Å; I261-P279 HydrophobicContact CG2-CG 3.69Å; I261-P279 WeakPolarHBondContact O-CG 3.5Å; I261-R281 HydrophobicContact CD1-CG 3.65Å
262	K	83.4	Confident	81.2	Confident	184 Å²	184	77.3 Å²	77.3	80%	0.8	40%	0.396	S	S	*	.			trans	-96.9	135.5	172.6	-64.2	-175.5	-179.5	-179	0	110	R260	R260-K262 PolarHBondContact O-N 3.36Å
263	V	84.7	Confident	79.9	Confident	13 Å²	13	80.9 Å²	80.9	8%	0.079	42%	0.42	C	S	.	.			trans	-139.4	131.5	179.2	-174.6	0	0	0	0	109.1	I208 V214 I261 W265	I208-V263 HydrophobicContact CG2-CG1 3.6Å; V214-V263 HydrophobicContact CG2-CG2 3.72Å; I261-V263 HydrophobicContact CG2-CG2 3.95Å; V263-W265 VanDerWaalsContact C-N 3.29Å; V263-W265 HydrophobicContact CB-CD2 4.31Å; V263-W265 HydrophobicContact CB-CZ2 3.96Å; V263-W265 HydrophobicContact CG1-CD2 3.77Å; V263-W265 HydrophobicContact CG1-CE3 4.12Å; V263-W265 HydrophobicContact CG1-CG 4.28Å; V263-W265 HydrophobicContact CG1-CH2 4.05Å; V263-W265 HydrophobicContact CG1-CZ2 3.7Å; V263-W265 HydrophobicContact CG1-CZ3 4.25Å; V263-W265 HydrophobicContact CG2-CZ2 4.2Å; V263-W265 PolarHBondContact O-N 3.01Å; V263-W265 VanDerWaalsContact O-N 3.08Å
264	D	85.3	Confident	78.4	Confident	112 Å²	112	83 Å²	83	60%	0.599	44%	0.442	S	S	*	.			trans	-88.7	71.9	-174.9	-36	-76.4	0	0	0	108.1	R212	R212-D264 IonicContact CZ-OD2 3.64Å; R212-D264 IonicContact NH1-OD2 3.71Å; R212-D264 PolarHBondContact NH1-OD2 3.42Å; R212-D264 IonicContact NH2-OD2 2.77Å; R212-D264 PolarHBondContact NH2-OD2 3.27Å
265	W	86.7	Confident	77.5	Confident	23 Å²	23	86.3 Å²	86.3	9%	0.087	46%	0.459	C	S	.	.			trans	-65.4	139.7	179.9	-60.2	108.5	0	0	0	111.1	N205 I208 V214 W215 A216 V263 F267 L276	N205-W265 HydrophobicContact CB-CE3 4.24Å; I208-W265 HydrophobicContact CB-CE3 4.47Å; I208-W265 HydrophobicContact CB-CZ3 4.15Å; I208-W265 HydrophobicContact CG2-CE3 3.98Å; I208-W265 HydrophobicContact CG2-CH2 4.27Å; I208-W265 HydrophobicContact CG2-CZ3 3.67Å; V214-W265 HydrophobicContact CG2-CH2 4.38Å; V214-W265 HydrophobicContact CG2-CZ2 4.47Å; W215-W265 HydrophobicContact CE3-CH2 4.06Å; W215-W265 HydrophobicContact CE3-CZ3 4.15Å; W215-W265 HydrophobicContact CZ3-CZ3 4.23Å; A216-W265 HydrophobicContact CB-CZ2 3.93Å; V263-W265 VanDerWaalsContact C-N 3.29Å; V263-W265 HydrophobicContact CB-CD2 4.31Å; V263-W265 HydrophobicContact CB-CZ2 3.96Å; V263-W265 HydrophobicContact CG1-CD2 3.77Å; V263-W265 HydrophobicContact CG1-CE3 4.12Å; V263-W265 HydrophobicContact CG1-CG 4.28Å; V263-W265 HydrophobicContact CG1-CH2 4.05Å; V263-W265 HydrophobicContact CG1-CZ2 3.7Å; V263-W265 HydrophobicContact CG1-CZ3 4.25Å; V263-W265 HydrophobicContact CG2-CZ2 4.2Å; V263-W265 PolarHBondContact O-N 3.01Å; V263-W265 VanDerWaalsContact O-N 3.08Å; W265-F267 HydrophobicContact CB-CD2 4.45Å; W265-F267 HydrophobicContact CB-CE1 4.45Å; W265-F267 HydrophobicContact CB-CE2 3.8Å; W265-F267 HydrophobicContact CB-CZ 3.8Å; W265-F267 HydrophobicContact CG-CZ 4.5Å; W265-F267 WeakPolarHBondContact O-CD2 3.4Å; W265-F267 WeakPolarHBondContact O-CE2 3.33Å; W265-F267 PolarHBondContact O-N 3.31Å; W265-L276 HydrophobicContact CB-CD1 4.46Å; W265-L276 HydrophobicContact CG-CD1 4.05Å
266	V	84.2	Confident	76.9	Confident	61 Å²	61	86.8 Å²	86.8	37%	0.37	46%	0.458	S	S	.	.			trans	-80.7	111.9	176.7	-169.5	0	0	0	0	109.5	E204 N205 I208	E204-V266 HydrophobicContact CB-CG2 4.2Å; E204-V266 WeakPolarHBondContact OE2-CG1 3.19Å; N205-V266 PolarHBondContact ND2-O 3.45Å; N205-V266 PolarHBondContact OD1-N 3.13Å; I208-V266 HydrophobicContact CD1-CG2 4.04Å
267	F	75.7	Confident	76.6	Confident	55 Å²	55	85.5 Å²	85.5	24%	0.241	45%	0.448	C	S	.	.			trans	-103.7	144.1	174.7	-61.4	-76.2	0	0	0	110.9	W265 S269 M271 T273 L276	W265-F267 HydrophobicContact CB-CD2 4.45Å; W265-F267 HydrophobicContact CB-CE1 4.45Å; W265-F267 HydrophobicContact CB-CE2 3.8Å; W265-F267 HydrophobicContact CB-CZ 3.8Å; W265-F267 HydrophobicContact CG-CZ 4.5Å; W265-F267 WeakPolarHBondContact O-CD2 3.4Å; W265-F267 WeakPolarHBondContact O-CE2 3.33Å; W265-F267 PolarHBondContact O-N 3.31Å; F267-S269 PolarHBondContact O-N 3.48Å; F267-M271 HydrophobicContact CB-CB 4.22Å; F267-M271 HydrophobicContact CD1-CB 4.12Å; F267-M271 HydrophobicContact CG-CB 4.43Å; F267-T273 HydrophobicContact CE2-CG2 4.01Å; F267-T273 HydrophobicContact CZ-CG2 4.24Å; F267-L276 HydrophobicContact CE1-CD1 3.69Å; F267-L276 HydrophobicContact CE1-CD2 4.28Å; F267-L276 HydrophobicContact CE1-CG 3.79Å; F267-L276 HydrophobicContact CZ-CD1 3.53Å; F267-L276 HydrophobicContact CZ-CG 3.81Å
268	S	67.6	Low	76.6	Confident	90 Å²	90	87.6 Å²	87.6	63%	0.629	46%	0.458	S	S	*	.			trans	-61.9	132	159.3	-47.9	0	0	0	0	108.7	R270 M271	S268-R270 PolarHBondContact O-N 3.22Å; S268-M271 PolarHBondContact O-N 3.2Å
269	S	58	Low	76.8	Confident	133 Å²	133	86.9 Å²	86.9	93%	0.93	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-8.5	-163.9	-168.9	0	0	0	0	119	F267	F267-S269 PolarHBondContact O-N 3.48Å
270	R	60.2	Low	77.2	Confident	247 Å²	247	82.7 Å²	82.7	93%	0.932	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.6	174.5	-73.5	-169.4	-75.3	-119.9	1	115.3	S268	S268-R270 PolarHBondContact O-N 3.22Å
271	M	62.2	Low	77.6	Confident	103 Å²	103	79 Å²	79	51%	0.507	41%	0.414	S	S	.	.			trans	-109.7	129.1	-178.4	-67.2	-179.7	178.8	0	0	111.5	F267 S268 L275	F267-M271 HydrophobicContact CB-CB 4.22Å; F267-M271 HydrophobicContact CD1-CB 4.12Å; F267-M271 HydrophobicContact CG-CB 4.43Å; S268-M271 PolarHBondContact O-N 3.2Å; M271-L275 HydrophobicContact CB-CD1 4.15Å; M271-L275 HydrophobicContact CG-CD1 4.26Å
272	N	62.4	Low	78	Confident	105 Å²	105	76.7 Å²	76.7	56%	0.561	40%	0.402	S	S	*	.			trans	-91.1	152.6	174.5	70.7	56.4	0	0	0	111.8	G274 L275	N272-G274 PolarHBondContact O-N 3.27Å; N272-G274 VanDerWaalsContact O-N 3.12Å; N272-G274 VanDerWaalsContact OD1-CA 3.29Å; N272-G274 WeakPolarHBondContact OD1-CA 3.45Å; N272-G274 PolarHBondContact OD1-N 3.03Å; N272-L275 WeakPolarHBondContact O-CB 3.48Å; N272-L275 PolarHBondContact O-N 2.96Å; N272-L275 VanDerWaalsContact O-N 3.14Å; N272-L275 PolarHBondContact OD1-N 3.28Å
273	T	65.8	Low	78.5	Confident	89 Å²	89	68.9 Å²	68.9	55%	0.546	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-58.4	-25.7	179	-39.7	0	0	0	0	113	F267 L275 L276	F267-T273 HydrophobicContact CE2-CG2 4.01Å; F267-T273 HydrophobicContact CZ-CG2 4.24Å; T273-L275 PolarHBondContact O-N 2.58Å; T273-L276 PolarHBondContact O-N 3.03Å
274	G	64.6	Low	79	Confident	46 Å²	46	69.4 Å²	69.4	47%	0.474	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-68	-8.4	178.4	0	0	0	0	0	115.1	K219 N272	K219-G274 VanDerWaalsContact CE-O 3.28Å; K219-G274 WeakPolarHBondContact CE-O 3.11Å; K219-G274 PolarHBondContact NZ-O 3.48Å; N272-G274 PolarHBondContact O-N 3.27Å; N272-G274 VanDerWaalsContact O-N 3.12Å; N272-G274 VanDerWaalsContact OD1-CA 3.29Å; N272-G274 WeakPolarHBondContact OD1-CA 3.45Å; N272-G274 PolarHBondContact OD1-N 3.03Å
275	L	72.4	Confident	79.3	Confident	100 Å²	100	66.4 Å²	66.4	52%	0.524	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-76.6	-26.7	171.2	-69.6	171.9	0	0	0	113.2	M271 N272 T273	M271-L275 HydrophobicContact CB-CD1 4.15Å; M271-L275 HydrophobicContact CG-CD1 4.26Å; N272-L275 WeakPolarHBondContact O-CB 3.48Å; N272-L275 PolarHBondContact O-N 2.96Å; N272-L275 VanDerWaalsContact O-N 3.14Å; N272-L275 PolarHBondContact OD1-N 3.28Å; T273-L275 PolarHBondContact O-N 2.58Å
276	L	79.1	Confident	79.5	Confident	40 Å²	40	65.6 Å²	65.6	21%	0.209	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-80.3	164.2	-179.6	-63.6	-167	0	0	0	113	A216 T217 K219 W265 F267 T273	A216-L276 HydrophobicContact CB-CB 4.28Å; A216-L276 HydrophobicContact CB-CD1 3.87Å; T217-L276 CarbonylContact O-C 3.54Å; T217-L276 WeakPolarHBondContact O-CA 3.32Å; K219-L276 WeakPolarHBondContact CE-O 3.47Å; W265-L276 HydrophobicContact CB-CD1 4.46Å; W265-L276 HydrophobicContact CG-CD1 4.05Å; F267-L276 HydrophobicContact CE1-CD1 3.69Å; F267-L276 HydrophobicContact CE1-CD2 4.28Å; F267-L276 HydrophobicContact CE1-CG 3.79Å; F267-L276 HydrophobicContact CZ-CD1 3.53Å; F267-L276 HydrophobicContact CZ-CG 3.81Å; T273-L276 PolarHBondContact O-N 3.03Å
277	S	82.9	Confident	79.9	Confident	11 Å²	11	66.6 Å²	66.6	8%	0.077	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.6	169.7	166.8	73.1	0	0	0	0	112.1	T217 E222	T217-S277 PolarHBondContact N-OG 3.32Å; T217-S277 WeakPolarHBondContact O-CB 3.41Å; T217-S277 PolarHBondContact O-N 2.95Å; T217-S277 PolarHBondContact O-OG 3.17Å; E222-S277 WeakPolarHBondContact OE2-CA 3.42Å; E222-S277 VanDerWaalsContact OE2-CB 3.27Å; E222-S277 WeakPolarHBondContact OE2-CB 3.41Å
278	N	88.7	Confident	80.7	Confident	64 Å²	64	65.2 Å²	65.2	34%	0.342	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-64.2	144	158.6	-49.7	-77.9	0	0	0	108.7	E222 P259	E222-N278 PolarHBondContact OE1-N 2.93Å; E222-N278 PolarHBondContact OE1-ND2 2.91Å; P259-N278 WeakPolarHBondContact CA-OD1 3.18Å; P259-N278 VanDerWaalsContact CB-OD1 3.31Å; P259-N278 WeakPolarHBondContact CB-OD1 3.36Å
279	P	91.9	Very high	81.9	Confident	9 Å²	9	64 Å²	64	6%	0.058	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-74.2	140.2	-177.8	28.6	-34.2	0	0	0	112.3	W215 A216 S257 D258 I261	W215-P279 CarbonylContact O-C 3.57Å; W215-P279 WeakPolarHBondContact O-CA 3.37Å; A216-P279 HydrophobicContact CB-CB 4.21Å; S257-P279 WeakPolarHBondContact CA-O 3.18Å; D258-P279 PolarHBondContact N-O 3.3Å; I261-P279 HydrophobicContact CB-CG 3.78Å; I261-P279 HydrophobicContact CG2-CB 4.47Å; I261-P279 HydrophobicContact CG2-CG 3.69Å; I261-P279 WeakPolarHBondContact O-CG 3.5Å
280	F	93.8	Very high	83.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	147.2	169.6	-66.8	-99.5	0	0	0	110.2	V214 W215 T217 E222 L225 N226 I253	V214-F280 CarbonylContact C-O 3.58Å; V214-F280 WeakPolarHBondContact CA-O 3.29Å; W215-F280 PolarHBondContact N-O 3.23Å; W215-F280 PolarHBondContact O-N 3.43Å; T217-F280 HydrophobicContact CG2-CE2 4.22Å; E222-F280 HydrophobicContact CB-CE2 4.4Å; E222-F280 HydrophobicContact CB-CZ 4.46Å; E222-F280 HydrophobicContact CG-CE2 4.22Å; E222-F280 HydrophobicContact CG-CZ 4.13Å; L225-F280 HydrophobicContact CB-CE1 3.84Å; L225-F280 HydrophobicContact CB-CE2 4.42Å; L225-F280 HydrophobicContact CB-CZ 3.69Å; L225-F280 HydrophobicContact CD1-CE2 4.26Å; L225-F280 HydrophobicContact CD1-CZ 4.34Å; N226-F280 WeakPolarHBondContact OD1-CE1 3.49Å; I253-F280 HydrophobicContact CD1-CD1 4.15Å; I253-F280 HydrophobicContact CG2-CD1 4.05Å
281	R	94.1	Very high	85.3	Confident	126 Å²	126	48.3 Å²	48.3	48%	0.475	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.1	169.2	-61.7	178.9	67.2	-176.9	-0.5	109.3	I254 A255 I261	I254-R281 HydrophobicContact CB-CB 4.32Å; I254-R281 WeakPolarHBondContact CB-O 3.45Å; I254-R281 PolarHBondContact N-O 3.47Å; A255-R281 HydrophobicContact CB-CB 4.23Å; I261-R281 HydrophobicContact CD1-CG 3.65Å
282	I	94.9	Very high	86.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.6	-174.2	59	166.8	0	0	0	111.9	N213 W215 L237 F239 A251 R252 W284	N213-I282 WeakPolarHBondContact O-CG1 3.48Å; N213-I282 PolarHBondContact O-N 2.92Å; W215-I282 HydrophobicContact CB-CD1 4.13Å; W215-I282 HydrophobicContact CB-CG2 4.45Å; L237-I282 HydrophobicContact CD1-CG2 4.15Å; F239-I282 HydrophobicContact CE2-CD1 4.36Å; F239-I282 HydrophobicContact CZ-CD1 3.94Å; A251-I282 HydrophobicContact CB-CB 3.97Å; A251-I282 HydrophobicContact CB-CD1 3.89Å; A251-I282 HydrophobicContact CB-CG1 4.33Å; R252-I282 CarbonylContact O-C 3.54Å; R252-I282 VanDerWaalsContact O-CA 3.32Å; R252-I282 WeakPolarHBondContact O-CA 3.4Å; I282-W284 HydrophobicContact CD1-CZ2 4.02Å
283	K	94.1	Very high	88.3	Confident	20 Å²	20	46.2 Å²	46.2	9%	0.087	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	112.3	169.8	-156.9	168.1	-167.4	175.4	0	108.7	A251 R252 I254 I285 N342	A251-K283 CarbonylContact C-O 3.57Å; A251-K283 VanDerWaalsContact CA-O 3.24Å; A251-K283 WeakPolarHBondContact CA-O 3.39Å; A251-K283 WeakPolarHBondContact CB-O 3.39Å; R252-K283 PolarHBondContact N-O 3.1Å; R252-K283 PolarHBondContact O-N 3.41Å; I254-K283 HydrophobicContact CD1-CB 3.81Å; I254-K283 HydrophobicContact CG1-CB 3.82Å; K283-I285 PolarHBondContact O-N 3.42Å; K283-N342 VanDerWaalsContact CE-OD1 3.29Å; K283-N342 WeakPolarHBondContact CE-OD1 3.47Å; K283-N342 PolarHBondContact NZ-OD1 3.29Å
284	W	94	Very high	89.6	Confident	23 Å²	23	46.8 Å²	46.8	9%	0.087	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	135.2	172.7	-68.1	86.1	0	0	0	109.9	I206 A209 K210 F239 A251 I282 K287	I206-W284 HydrophobicContact CG2-CH2 4.27Å; A209-W284 HydrophobicContact CB-CZ2 3.93Å; A209-W284 PolarHBondContact O-NE1 2.88Å; K210-W284 HydrophobicContact CB-CZ2 4.42Å; K210-W284 HydrophobicContact CG-CD2 4.12Å; K210-W284 HydrophobicContact CG-CE3 4.28Å; K210-W284 HydrophobicContact CG-CH2 3.78Å; K210-W284 HydrophobicContact CG-CZ2 3.59Å; K210-W284 HydrophobicContact CG-CZ3 4.12Å; F239-W284 HydrophobicContact CB-CH2 4.34Å; F239-W284 HydrophobicContact CD1-CH2 4.38Å; F239-W284 AromaticContact CD2-CH2 3.38Å; F239-W284 HydrophobicContact CD2-CH2 3.38Å; F239-W284 HydrophobicContact CD2-CZ2 4.22Å; F239-W284 AromaticContact CD2-CZ3 3.62Å; F239-W284 HydrophobicContact CD2-CZ3 3.62Å; F239-W284 AromaticContact CE2-CH2 3.69Å; F239-W284 HydrophobicContact CE2-CH2 3.69Å; F239-W284 HydrophobicContact CE2-CZ2 4.08Å; F239-W284 HydrophobicContact CE2-CZ3 4.07Å; F239-W284 AromaticContact CG-CH2 3.78Å; F239-W284 HydrophobicContact CG-CH2 3.78Å; F239-W284 HydrophobicContact CG-CZ3 4.3Å; F239-W284 HydrophobicContact CZ-CH2 4.31Å; F239-W284 HydrophobicContact CZ-CZ2 4.39Å; A251-W284 HydrophobicContact CB-CB 4.5Å; A251-W284 HydrophobicContact CB-CD2 3.93Å; A251-W284 HydrophobicContact CB-CE3 4.19Å; A251-W284 HydrophobicContact CB-CG 4.1Å; I282-W284 HydrophobicContact CD1-CZ2 4.02Å; W284-K287 HydrophobicContact CB-CD 4.35Å; W284-K287 HydrophobicContact CB-CG 3.76Å; W284-K287 HydrophobicContact CD2-CG 4.08Å; W284-K287 HydrophobicContact CE3-CG 4.05Å; W284-K287 HydrophobicContact CG-CD 4.4Å; W284-K287 HydrophobicContact CG-CG 3.96Å
285	I	91.4	Very high	91	Very high	50 Å²	50	44.7 Å²	44.7	26%	0.256	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-40.6	175.3	-64.2	173.8	0	0	0	109.4	I185 L189 L236 F250 R252 K283	I185-I285 HydrophobicContact CG2-CG2 4.46Å; L189-I285 HydrophobicContact CD1-CD1 4.43Å; L236-I285 HydrophobicContact CD2-CD1 3.73Å; F250-I285 HydrophobicContact CD2-CB 4.08Å; F250-I285 HydrophobicContact CD2-CD1 4.33Å; F250-I285 HydrophobicContact CE2-CB 3.57Å; F250-I285 HydrophobicContact CE2-CD1 3.88Å; F250-I285 HydrophobicContact CE2-CG1 4.29Å; F250-I285 HydrophobicContact CE2-CG2 3.6Å; F250-I285 HydrophobicContact CZ-CB 3.91Å; F250-I285 HydrophobicContact CZ-CG2 3.57Å; F250-I285 PolarHBondContact O-N 3.36Å; R252-I285 HydrophobicContact CB-CD1 4.03Å; K283-I285 PolarHBondContact O-N 3.42Å
286	S	91.9	Very high	91.9	Very high	5 Å²	5	41.9 Å²	41.9	4%	0.035	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.3	162	176.5	0	0	0	0	109.4	G249 F250 S288 N330 D332	G249-S286 CarbonylContact C-O 3.6Å; G249-S286 WeakPolarHBondContact CA-O 3.21Å; F250-S286 PolarHBondContact N-O 3.32Å; F250-S286 PolarHBondContact O-N 3.24Å; S286-S288 WeakPolarHBondContact OG-CB 3.39Å; S286-S288 PolarHBondContact OG-N 3.15Å; S286-S288 VanDerWaalsContact OG-N 3.14Å; S286-S288 PolarHBondContact OG-OG 3Å; S286-N330 PolarHBondContact OG-O 3.45Å; S286-D332 VanDerWaalsContact CA-OD1 3.27Å; S286-D332 WeakPolarHBondContact CA-OD1 3.28Å; S286-D332 VanDerWaalsContact CB-OD1 3.3Å; S286-D332 WeakPolarHBondContact CB-OD1 3.01Å; S286-D332 PolarHBondContact OG-OD1 2.82Å
287	K	92.3	Very high	92.5	Very high	83 Å²	83	46 Å²	46	36%	0.361	24%	0.239	S	C	.	.			trans	-99.2	1.7	169.7	-57.6	-175.2	-174.1	-174.2	0	111.5	K210 W284 D332	K210-K287 HydrophobicContact CB-CD 4.38Å; K210-K287 HydrophobicContact CD-CB 4.2Å; K210-K287 HydrophobicContact CD-CD 4.5Å; K210-K287 HydrophobicContact CD-CG 4.49Å; K210-K287 HydrophobicContact CG-CD 4.3Å; K210-K287 HydrophobicContact CG-CG 4.39Å; K210-K287 PolarHBondContact NZ-O 3.22Å; K210-K287 PolarHBondContact O-NZ 3.47Å; W284-K287 HydrophobicContact CB-CD 4.35Å; W284-K287 HydrophobicContact CB-CG 3.76Å; W284-K287 HydrophobicContact CD2-CG 4.08Å; W284-K287 HydrophobicContact CE3-CG 4.05Å; W284-K287 HydrophobicContact CG-CD 4.4Å; W284-K287 HydrophobicContact CG-CG 3.96Å; K287-D332 WeakPolarHBondContact CB-OD2 3.33Å; K287-D332 VanDerWaalsContact N-CG 3.34Å; K287-D332 PolarHBondContact N-OD1 3.26Å; K287-D332 VanDerWaalsContact N-OD1 3.16Å; K287-D332 PolarHBondContact N-OD2 2.69Å
288	S	91.6	Very high	93.1	Very high	25 Å²	25	46.2 Å²	46.2	18%	0.175	24%	0.239	C	C	.	.			trans	-65	152.2	177.1	76.2	0	0	0	0	112.8	Q248 G249 S286 N330 D332	Q248-S288 CarbonylContact C-O 3.55Å; G249-S288 WeakPolarHBondContact CA-O 3.27Å; G249-S288 PolarHBondContact N-O 3.4Å; G249-S288 VanDerWaalsContact N-O 3.13Å; S286-S288 WeakPolarHBondContact OG-CB 3.39Å; S286-S288 PolarHBondContact OG-N 3.15Å; S286-S288 VanDerWaalsContact OG-N 3.14Å; S286-S288 PolarHBondContact OG-OG 3Å; S288-N330 PolarHBondContact OG-N 2.76Å; S288-N330 PolarHBondContact OG-O 3.44Å; S288-N330 VanDerWaalsContact OG-O 3.14Å; S288-D332 PolarHBondContact N-OD1 2.93Å
289	D	93.3	Very high	93.4	Very high	66 Å²	66	47.4 Å²	47.4	35%	0.353	25%	0.245	S	C	.	.			trans	-87.4	132.4	175	-87.9	12.7	0	0	0	110.7	R246 F247 Q248	R246-D289 WeakPolarHBondContact CD-OD2 3.33Å; R246-D289 IonicContact CZ-OD2 3.49Å; R246-D289 IonicContact NE-OD2 2.94Å; R246-D289 IonicContact NH1-OD2 3.86Å; R246-D289 PolarHBondContact NH1-OD2 3.24Å; F247-D289 CarbonylContact O-C 3.49Å; F247-D289 WeakPolarHBondContact O-CA 3.42Å; Q248-D289 WeakPolarHBondContact CA-OD1 3.07Å
290	L	94.3	Very high	93.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.2	177.2	175.5	57.4	0	0	0	110.3	R246 F247 K294 T295 L325 L328 F329	R246-L290 WeakPolarHBondContact CA-O 3.11Å; R246-L290 WeakPolarHBondContact CB-O 3.3Å; F247-L290 HydrophobicContact CB-CB 4.34Å; F247-L290 HydrophobicContact CD2-CB 4.48Å; F247-L290 HydrophobicContact CD2-CD2 4.44Å; F247-L290 HydrophobicContact CD2-CG 4.36Å; F247-L290 PolarHBondContact N-O 2.77Å; F247-L290 PolarHBondContact O-N 3.22Å; L290-K294 HydrophobicContact CD1-CB 3.88Å; L290-K294 HydrophobicContact CD1-CD 3.81Å; L290-K294 HydrophobicContact CD1-CG 4.43Å; L290-T295 HydrophobicContact CD1-CG2 4.19Å; L290-T295 HydrophobicContact CD2-CG2 3.68Å; L290-T295 HydrophobicContact CG-CG2 3.75Å; L290-L325 HydrophobicContact CD2-CD1 3.79Å; L290-L328 HydrophobicContact CD1-CB 4.23Å; L290-L328 WeakPolarHBondContact CD1-O 3.25Å; L290-L328 HydrophobicContact CD2-CB 3.8Å; L290-F329 HydrophobicContact CB-CD1 3.72Å; L290-F329 HydrophobicContact CB-CE1 3.5Å; L290-F329 VanDerWaalsContact CB-CE1 3.5Å; L290-F329 HydrophobicContact CB-CG 4.34Å; L290-F329 HydrophobicContact CB-CZ 3.99Å; L290-F329 HydrophobicContact CD2-CD1 4.2Å; L290-F329 HydrophobicContact CD2-CD2 3.74Å; L290-F329 HydrophobicContact CD2-CE1 4.08Å; L290-F329 HydrophobicContact CD2-CE2 3.63Å; L290-F329 HydrophobicContact CD2-CG 4.04Å; L290-F329 HydrophobicContact CD2-CZ 3.81Å; L290-F329 HydrophobicContact CG-CE1 4.45Å
291	P	95.2	Very high	93.6	Very high	49 Å²	49	49.8 Å²	49.8	32%	0.318	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	143.2	-178.5	27.8	-35.5	0	0	0	112.4	T293 K294	P291-T293 PolarHBondContact O-N 2.94Å; P291-K294 HydrophobicContact CG-CD 4.41Å; P291-K294 HydrophobicContact CG-CG 4.32Å; P291-K294 PolarHBondContact O-N 2.94Å
292	F	95.1	Very high	93.5	Very high	39 Å²	39	49.3 Å²	49.3	17%	0.171	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.5	-177.8	-66	-20.8	0	0	0	114.7	S240 G245 R246 F247 T295 G296 K309	S240-F292 WeakPolarHBondContact OG-CZ 3.39Å; G245-F292 WeakPolarHBondContact O-CB 3.36Å; G245-F292 WeakPolarHBondContact O-CD2 3.46Å; G245-F292 WeakPolarHBondContact O-CG 3.36Å; G245-F292 PolarHBondContact O-N 3.01Å; R246-F292 WeakPolarHBondContact O-CE1 3.35Å; R246-F292 WeakPolarHBondContact O-CZ 3.49Å; F247-F292 HydrophobicContact CD1-CE1 4.26Å; F247-F292 AromaticContact CD2-CD1 3.76Å; F247-F292 HydrophobicContact CD2-CD1 3.76Å; F247-F292 AromaticContact CD2-CE1 3.7Å; F247-F292 HydrophobicContact CD2-CE1 3.7Å; F247-F292 HydrophobicContact CE1-CE1 4.12Å; F247-F292 AromaticContact CE2-CD1 3.49Å; F247-F292 HydrophobicContact CE2-CD1 3.49Å; F247-F292 VanDerWaalsContact CE2-CD1 3.49Å; F247-F292 AromaticContact CE2-CE1 3.54Å; F247-F292 HydrophobicContact CE2-CE1 3.54Å; F247-F292 HydrophobicContact CG-CE1 4.06Å; F247-F292 HydrophobicContact CZ-CD1 4.1Å; F247-F292 AromaticContact CZ-CE1 3.77Å; F247-F292 HydrophobicContact CZ-CE1 3.77Å; F292-T295 PolarHBondContact O-N 2.95Å; F292-T295 PolarHBondContact O-OG1 3.25Å; F292-G296 PolarHBondContact O-N 3.33Å; F292-K309 HydrophobicContact CB-CD 3.9Å; F292-K309 HydrophobicContact CD1-CB 3.79Å; F292-K309 HydrophobicContact CD2-CB 4.06Å; F292-K309 HydrophobicContact CD2-CD 3.99Å; F292-K309 HydrophobicContact CE1-CB 3.84Å; F292-K309 HydrophobicContact CE2-CB 4.12Å; F292-K309 HydrophobicContact CG-CB 3.91Å; F292-K309 HydrophobicContact CG-CD 3.96Å; F292-K309 HydrophobicContact CZ-CB 4.01Å
293	T	93.8	Very high	93.5	Very high	124 Å²	124	50.4 Å²	50.4	76%	0.761	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-42.4	171.7	48.7	0	0	0	0	111.2	P291 T295	P291-T293 PolarHBondContact O-N 2.94Å; T293-T295 VanDerWaalsContact C-N 3.3Å; T293-T295 PolarHBondContact O-N 3.3Å
294	K	92.3	Very high	93.5	Very high	102 Å²	102	56.2 Å²	56.2	44%	0.443	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.6	176.6	-72.4	-172.7	173.7	-172.1	0	112.9	L290 P291 H297	L290-K294 HydrophobicContact CD1-CB 3.88Å; L290-K294 HydrophobicContact CD1-CD 3.81Å; L290-K294 HydrophobicContact CD1-CG 4.43Å; P291-K294 HydrophobicContact CG-CD 4.41Å; P291-K294 HydrophobicContact CG-CG 4.32Å; P291-K294 PolarHBondContact O-N 2.94Å; K294-H297 PolarHBondContact O-CE1 2.82Å; K294-H297 PolarHBondContact O-ND1 3.36Å
295	T	93.8	Very high	93.4	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	14.9	-174	75.1	0	0	0	0	113.5	F247 L290 F292 T293 H297 L298 L325 L328	F247-T295 HydrophobicContact CD2-CG2 4.25Å; F247-T295 HydrophobicContact CE2-CG2 3.87Å; L290-T295 HydrophobicContact CD1-CG2 4.19Å; L290-T295 HydrophobicContact CD2-CG2 3.68Å; L290-T295 HydrophobicContact CG-CG2 3.75Å; F292-T295 PolarHBondContact O-N 2.95Å; F292-T295 PolarHBondContact O-OG1 3.25Å; T293-T295 VanDerWaalsContact C-N 3.3Å; T293-T295 PolarHBondContact O-N 3.3Å; T295-H297 VanDerWaalsContact C-N 3.25Å; T295-H297 PolarHBondContact O-N 3.14Å; T295-L298 PolarHBondContact O-N 3.36Å; T295-L325 HydrophobicContact CG2-CD1 3.61Å; T295-L328 HydrophobicContact CG2-CD1 4.13Å
296	G	90.6	Very high	93.6	Very high	41 Å²	41	60.7 Å²	60.7	42%	0.423	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.2	-176.4	0	0	0	0	0	114.3	F292	F292-G296 PolarHBondContact O-N 3.33Å
297	H	93.1	Very high	93.7	Very high	127 Å²	127	62.2 Å²	62.2	59%	0.588	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.7	-179.3	62.5	-94.6	0	0	0	114.2	K294 T295	K294-H297 PolarHBondContact O-CE1 2.82Å; K294-H297 PolarHBondContact O-ND1 3.36Å; T295-H297 VanDerWaalsContact C-N 3.25Å; T295-H297 PolarHBondContact O-N 3.14Å
298	L	94.9	Very high	93.8	Very high	16 Å²	16	58.4 Å²	58.4	8%	0.084	31%	0.313	C	S	.	.			trans	-95.9	111	-177.7	-64.7	-177.8	0	0	0	111.2	T295 P307 V308 A324 L325 L328	T295-L298 PolarHBondContact O-N 3.36Å; L298-P307 CarbonylContact O-C 3.59Å; L298-P307 WeakPolarHBondContact O-CA 3.22Å; L298-V308 HydrophobicContact CB-CB 4.33Å; L298-V308 HydrophobicContact CB-CG1 3.72Å; L298-V308 HydrophobicContact CD1-CG1 4.48Å; L298-V308 PolarHBondContact O-N 3.41Å; L298-A324 HydrophobicContact CD1-CB 4.34Å; L298-A324 HydrophobicContact CD2-CB 3.72Å; L298-L325 HydrophobicContact CD1-CB 3.76Å; L298-L325 HydrophobicContact CD1-CD1 4.13Å; L298-L328 HydrophobicContact CD1-CD1 3.65Å; L298-L328 HydrophobicContact CG-CD1 4.37Å
299	L	95.3	Very high	93.9	Very high	89 Å²	89	60.9 Å²	60.9	47%	0.466	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	143	176.9	-54.3	-172.7	0	0	0	110.1	D305 P307 C321	L299-D305 WeakPolarHBondContact CB-O 3.45Å; L299-P307 HydrophobicContact CD2-CB 4.3Å; L299-P307 HydrophobicContact CD2-CG 3.85Å; L299-C321 PolarHBondContact O-SG 2.97Å
300	N	95.3	Very high	93.9	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	103.7	179.5	-179	19.4	0	0	0	111.1	W302 N303 D305 K306 E316 E318	N300-W302 PolarHBondContact O-N 3.47Å; N300-W302 VanDerWaalsContact O-N 3.08Å; N300-W302 PolarHBondContact OD1-N 3.48Å; N300-N303 HydrophobicContact CB-CB 4.39Å; N300-N303 CarbonylContact O-C 3.51Å; N300-N303 PolarHBondContact O-N 3.41Å; N300-D305 WeakPolarHBondContact O-CA 3.35Å; N300-D305 PolarHBondContact O-N 3.46Å; N300-K306 PolarHBondContact N-O 2.89Å; N300-E316 PolarHBondContact ND2-O 3.25Å; N300-E318 PolarHBondContact OD1-N 3.26Å; N300-E318 VanDerWaalsContact OD1-N 3.1Å
301	A	94.5	Very high	93.8	Very high	56 Å²	56	62.9 Å²	62.9	46%	0.463	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-55.9	-25.8	177.4	0	0	0	0	0	113.8	N303 D305	A301-N303 PolarHBondContact O-N 2.91Å; A301-D305 VanDerWaalsContact CA-OD1 3.27Å; A301-D305 WeakPolarHBondContact CA-OD1 3.4Å
302	W	92.8	Very high	93.7	Very high	115 Å²	115	70.5 Å²	70.5	44%	0.436	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-82.3	10.1	175.5	-61.9	-3	0	0	0	113.9	N300 Q315 E316 I317 E318 P319	N300-W302 PolarHBondContact O-N 3.47Å; N300-W302 VanDerWaalsContact O-N 3.08Å; N300-W302 PolarHBondContact OD1-N 3.48Å; W302-Q315 PolarHBondContact O-NE2 3.42Å; W302-Q315 VanDerWaalsContact O-NE2 3.1Å; W302-E316 HydrophobicContact CE3-CB 3.84Å; W302-E316 HydrophobicContact CZ3-CB 4.18Å; W302-I317 VanDerWaalsContact CE3-C 3.49Å; W302-I317 WeakPolarHBondContact CZ3-O 3.37Å; W302-E318 HydrophobicContact CD2-CB 3.9Å; W302-E318 HydrophobicContact CE3-CB 4.48Å; W302-E318 HydrophobicContact CG-CB 3.97Å; W302-P319 HydrophobicContact CH2-CG 4.17Å; W302-P319 HydrophobicContact CZ2-CG 4.45Å
303	N	93.3	Very high	93.7	Very high	23 Å²	23	70.2 Å²	70.2	12%	0.123	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-144.4	48.9	175.9	-170	35.3	0	0	0	111.2	N300 A301 D305 K306 I310	N300-N303 HydrophobicContact CB-CB 4.39Å; N300-N303 CarbonylContact O-C 3.51Å; N300-N303 PolarHBondContact O-N 3.41Å; A301-N303 PolarHBondContact O-N 2.91Å; N303-D305 VanDerWaalsContact C-N 3.3Å; N303-D305 PolarHBondContact O-N 3.01Å; N303-K306 VanDerWaalsContact O-CB 3.27Å; N303-K306 WeakPolarHBondContact O-CB 3.41Å; N303-K306 VanDerWaalsContact O-CD 3.32Å; N303-K306 WeakPolarHBondContact O-CD 3.29Å; N303-K306 VanDerWaalsContact O-CG 3.25Å; N303-K306 WeakPolarHBondContact O-CG 3.27Å; N303-K306 PolarHBondContact O-N 2.93Å; N303-K306 VanDerWaalsContact O-N 3.12Å; N303-I310 PolarHBondContact ND2-O 3.16Å
304	E	94.2	Very high	93.6	Very high	143 Å²	143	64.5 Å²	64.5	67%	0.668	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	40.6	177.7	-55.7	154.3	-107.2	0	0	112.8	K306	E304-K306 HydrophobicContact CB-CD 4.39Å; E304-K306 PolarHBondContact O-N 2.82Å; E304-K306 IonicContact OE1-NZ 3.83Å; E304-K306 PolarHBondContact OE1-NZ 3.28Å; E304-K306 WeakPolarHBondContact OE2-CE 3.49Å; E304-K306 IonicContact OE2-NZ 3.24Å; E304-K306 PolarHBondContact OE2-NZ 2.88Å
305	D	92.4	Very high	93.8	Very high	96 Å²	96	61.4 Å²	61.4	51%	0.513	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	21.8	-176.6	-65	-63.7	0	0	0	115.1	L299 N300 A301 N303	L299-D305 WeakPolarHBondContact CB-O 3.45Å; N300-D305 WeakPolarHBondContact O-CA 3.35Å; N300-D305 PolarHBondContact O-N 3.46Å; A301-D305 VanDerWaalsContact CA-OD1 3.27Å; A301-D305 WeakPolarHBondContact CA-OD1 3.4Å; N303-D305 VanDerWaalsContact C-N 3.3Å; N303-D305 PolarHBondContact O-N 3.01Å
306	K	94.7	Very high	93.9	Very high	70 Å²	70	63.6 Å²	63.6	30%	0.304	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	144.3	176.2	-67.8	164	-170.8	162.3	0	110.1	N300 N303 E304 V308 I310	N300-K306 PolarHBondContact N-O 2.89Å; N303-K306 VanDerWaalsContact O-CB 3.27Å; N303-K306 WeakPolarHBondContact O-CB 3.41Å; N303-K306 VanDerWaalsContact O-CD 3.32Å; N303-K306 WeakPolarHBondContact O-CD 3.29Å; N303-K306 VanDerWaalsContact O-CG 3.25Å; N303-K306 WeakPolarHBondContact O-CG 3.27Å; N303-K306 PolarHBondContact O-N 2.93Å; N303-K306 VanDerWaalsContact O-N 3.12Å; E304-K306 HydrophobicContact CB-CD 4.39Å; E304-K306 PolarHBondContact O-N 2.82Å; E304-K306 IonicContact OE1-NZ 3.83Å; E304-K306 PolarHBondContact OE1-NZ 3.28Å; E304-K306 WeakPolarHBondContact OE2-CE 3.49Å; E304-K306 IonicContact OE2-NZ 3.24Å; E304-K306 PolarHBondContact OE2-NZ 2.88Å; K306-V308 PolarHBondContact O-N 3.2Å; K306-I310 HydrophobicContact CB-CB 4.39Å
307	P	94.8	Very high	94.2	Very high	38 Å²	38	61.7 Å²	61.7	25%	0.247	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	135.3	174.8	-29.3	34.6	0	0	0	112.3	L298 L299 K309 I310	L298-P307 CarbonylContact O-C 3.59Å; L298-P307 WeakPolarHBondContact O-CA 3.22Å; L299-P307 HydrophobicContact CD2-CB 4.3Å; L299-P307 HydrophobicContact CD2-CG 3.85Å; P307-K309 HydrophobicContact CB-CG 4.28Å; P307-K309 PolarHBondContact O-N 2.93Å; P307-I310 WeakPolarHBondContact O-CB 3.27Å; P307-I310 PolarHBondContact O-N 3.37Å
308	V	95.2	Very high	94.2	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.012	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-18.5	-166.8	71.4	0	0	0	0	115.2	F247 L298 K306 I310 I317 L325	F247-V308 HydrophobicContact CZ-CG1 4.33Å; L298-V308 HydrophobicContact CB-CB 4.33Å; L298-V308 HydrophobicContact CB-CG1 3.72Å; L298-V308 HydrophobicContact CD1-CG1 4.48Å; L298-V308 PolarHBondContact O-N 3.41Å; K306-V308 PolarHBondContact O-N 3.2Å; V308-I310 PolarHBondContact O-N 3.08Å; V308-I317 HydrophobicContact CG2-CD1 3.83Å; V308-I317 HydrophobicContact CG2-CG1 4.19Å; V308-I317 HydrophobicContact CG2-CG2 3.93Å; V308-L325 HydrophobicContact CG1-CD1 4.36Å; V308-L325 HydrophobicContact CG1-CD2 3.95Å; V308-L325 HydrophobicContact CG2-CD2 3.72Å
309	K	93.3	Very high	94.2	Very high	78 Å²	78	59.3 Å²	59.3	34%	0.339	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.9	169.9	67.3	-171	179.3	-174.6	0	114	F247 F292 P307	F247-K309 HydrophobicContact CZ-CB 4.29Å; F292-K309 HydrophobicContact CB-CD 3.9Å; F292-K309 HydrophobicContact CD1-CB 3.79Å; F292-K309 HydrophobicContact CD2-CB 4.06Å; F292-K309 HydrophobicContact CD2-CD 3.99Å; F292-K309 HydrophobicContact CE1-CB 3.84Å; F292-K309 HydrophobicContact CE2-CB 4.12Å; F292-K309 HydrophobicContact CG-CB 3.91Å; F292-K309 HydrophobicContact CG-CD 3.96Å; F292-K309 HydrophobicContact CZ-CB 4.01Å; P307-K309 HydrophobicContact CB-CG 4.28Å; P307-K309 PolarHBondContact O-N 2.93Å
310	I	93.2	Very high	94.1	Very high	85 Å²	85	59.7 Å²	59.7	44%	0.436	30%	0.301	S	S	.	.			trans	-93.9	118	-179.2	-52.4	-176.2	0	0	0	108.9	N303 K306 P307 V308	N303-I310 PolarHBondContact ND2-O 3.16Å; K306-I310 HydrophobicContact CB-CB 4.39Å; P307-I310 WeakPolarHBondContact O-CB 3.27Å; P307-I310 PolarHBondContact O-N 3.37Å; V308-I310 PolarHBondContact O-N 3.08Å
311	G	92.6	Very high	94	Very high	24 Å²	24	60 Å²	60	25%	0.247	30%	0.304	C	S	.	.			trans	176.1	161.7	175.5	0	0	0	0	0	111.9
312	R	93.5	Very high	94	Very high	209 Å²	209	57.4 Å²	57.4	79%	0.789	28%	0.282	S	S	*	.			trans	-81.1	167.5	173.7	-64.4	-177.2	176.3	114	-4.2	110.6	G314 Q315	R312-G314 PolarHBondContact O-N 2.77Å; R312-Q315 VanDerWaalsContact O-CB 3.25Å; R312-Q315 WeakPolarHBondContact O-CB 3.35Å; R312-Q315 PolarHBondContact O-N 2.87Å; R312-Q315 VanDerWaalsContact O-N 3.11Å
313	D	93.8	Very high	94.1	Very high	33 Å²	33	54 Å²	54	18%	0.176	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	127.6	171.2	-173.6	60.9	0	0	0	110	I198 K199 T217 N221	I198-D313 WeakPolarHBondContact CA-OD1 3.33Å; K199-D313 HydrophobicContact CB-CB 4.18Å; K199-D313 PolarHBondContact N-OD1 3.33Å; T217-D313 PolarHBondContact OG1-OD2 2.84Å; N221-D313 VanDerWaalsContact ND2-C 3.28Å; N221-D313 PolarHBondContact ND2-O 2.95Å; N221-D313 PolarHBondContact ND2-OD2 3.43Å
314	G	92.7	Very high	94.1	Very high	3 Å²	3	54.4 Å²	54.4	3%	0.031	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	17.3	-173.8	0	0	0	0	0	114.5	L197 R312	L197-G314 PolarHBondContact O-N 3.38Å; R312-G314 PolarHBondContact O-N 2.77Å
315	Q	96	Very high	94.1	Very high	37 Å²	37	47.6 Å²	47.6	17%	0.173	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	132	168.2	175.2	60.2	47	0	0	109.8	F196 L197 W302 R312	F196-Q315 WeakPolarHBondContact CA-O 3.43Å; L197-Q315 HydrophobicContact CB-CB 4.25Å; L197-Q315 PolarHBondContact N-O 3.33Å; W302-Q315 PolarHBondContact O-NE2 3.42Å; W302-Q315 VanDerWaalsContact O-NE2 3.1Å; R312-Q315 VanDerWaalsContact O-CB 3.25Å; R312-Q315 WeakPolarHBondContact O-CB 3.35Å; R312-Q315 PolarHBondContact O-N 2.87Å; R312-Q315 VanDerWaalsContact O-N 3.11Å
316	E	95.8	Very high	94.1	Very high	47 Å²	47	43 Å²	43	22%	0.22	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.3	176.2	-47.7	-162.3	146.9	0	0	109.8	K194 F196 N300 W302	K194-E316 VanDerWaalsContact CE-OE1 3.3Å; K194-E316 WeakPolarHBondContact CE-OE1 3.24Å; K194-E316 WeakPolarHBondContact CE-OE2 3.46Å; K194-E316 IonicContact NZ-OE1 2.63Å; K194-E316 PolarHBondContact NZ-OE1 3.35Å; K194-E316 IonicContact NZ-OE2 2.83Å; K194-E316 PolarHBondContact NZ-OE2 3.44Å; F196-E316 HydrophobicContact CD1-CG 4Å; F196-E316 HydrophobicContact CE1-CG 3.67Å; F196-E316 VanDerWaalsContact CE1-OE1 3.25Å; F196-E316 WeakPolarHBondContact CE1-OE1 3.24Å; F196-E316 HydrophobicContact CZ-CG 4.47Å; N300-E316 PolarHBondContact ND2-O 3.25Å; W302-E316 HydrophobicContact CE3-CB 3.84Å; W302-E316 HydrophobicContact CZ3-CB 4.18Å
317	I	96.1	Very high	94	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.2	176.9	-55	166.6	0	0	0	108.6	Y195 L197 I238 W302 V308 C321 L325	Y195-I317 PolarHBondContact O-N 3.48Å; L197-I317 HydrophobicContact CB-CD1 4.12Å; L197-I317 HydrophobicContact CB-CG1 4.46Å; I238-I317 HydrophobicContact CD1-CD1 4.1Å; W302-I317 VanDerWaalsContact CE3-C 3.49Å; W302-I317 WeakPolarHBondContact CZ3-O 3.37Å; V308-I317 HydrophobicContact CG2-CD1 3.83Å; V308-I317 HydrophobicContact CG2-CG1 4.19Å; V308-I317 HydrophobicContact CG2-CG2 3.93Å; I317-C321 HydrophobicContact CG2-CB 4.04Å; I317-L325 HydrophobicContact CD1-CD2 4.48Å
318	E	94.7	Very high	93.8	Very high	40 Å²	40	45.9 Å²	45.9	19%	0.187	23%	0.229	C	C	.	.			trans	-55.9	140.6	175.6	-177.2	-74.3	135	0	0	111	N300 W302 T320 C321 G322	N300-E318 PolarHBondContact OD1-N 3.26Å; N300-E318 VanDerWaalsContact OD1-N 3.1Å; W302-E318 HydrophobicContact CD2-CB 3.9Å; W302-E318 HydrophobicContact CE3-CB 4.48Å; W302-E318 HydrophobicContact CG-CB 3.97Å; E318-T320 PolarHBondContact O-N 2.8Å; E318-T320 VanDerWaalsContact OE1-CB 3.3Å; E318-T320 WeakPolarHBondContact OE1-CB 3.12Å; E318-T320 PolarHBondContact OE1-N 3.07Å; E318-T320 PolarHBondContact OE1-OG1 2.85Å; E318-T320 WeakPolarHBondContact OE2-CA 3.23Å; E318-T320 WeakPolarHBondContact OE2-CB 3.35Å; E318-T320 PolarHBondContact OE2-N 3Å; E318-C321 HydrophobicContact CB-CB 4.46Å; E318-C321 PolarHBondContact O-N 3.11Å; E318-C321 WeakPolarHBondContact OE2-CB 3.29Å; E318-C321 PolarHBondContact OE2-N 3.28Å; E318-G322 PolarHBondContact O-N 2.96Å
319	P	93.4	Very high	93.6	Very high	54 Å²	54	46 Å²	46	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-59.6	-36.2	-169.1	-28.8	37	0	0	0	116.2	Y195 W302 E323	Y195-P319 HydrophobicContact CE2-CB 4.22Å; Y195-P319 WeakPolarHBondContact CE2-O 3.23Å; W302-P319 HydrophobicContact CH2-CG 4.17Å; W302-P319 HydrophobicContact CZ2-CG 4.45Å; P319-E323 VanDerWaalsContact O-CB 3.27Å; P319-E323 WeakPolarHBondContact O-CB 3.36Å; P319-E323 PolarHBondContact O-N 3.28Å
320	T	93.1	Very high	93.1	Very high	97 Å²	97	46.8 Å²	46.8	60%	0.595	24%	0.237	S	C	*	.	H	α-helix	trans	-70.3	-46.7	-179.8	-40.2	0	0	0	0	110.7	E318 E323 A324	E318-T320 PolarHBondContact O-N 2.8Å; E318-T320 VanDerWaalsContact OE1-CB 3.3Å; E318-T320 WeakPolarHBondContact OE1-CB 3.12Å; E318-T320 PolarHBondContact OE1-N 3.07Å; E318-T320 PolarHBondContact OE1-OG1 2.85Å; E318-T320 WeakPolarHBondContact OE2-CA 3.23Å; E318-T320 WeakPolarHBondContact OE2-CB 3.35Å; E318-T320 PolarHBondContact OE2-N 3Å; T320-E323 PolarHBondContact O-N 2.69Å; T320-A324 WeakPolarHBondContact O-CB 3.32Å; T320-A324 PolarHBondContact O-N 3.41Å
321	C	94.8	Very high	91.7	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-42.9	173.3	-178.9	0	0	0	0	111.9	L299 I317 E318 L325	L299-C321 PolarHBondContact O-SG 2.97Å; I317-C321 HydrophobicContact CG2-CB 4.04Å; E318-C321 HydrophobicContact CB-CB 4.46Å; E318-C321 PolarHBondContact O-N 3.11Å; E318-C321 WeakPolarHBondContact OE2-CB 3.29Å; E318-C321 PolarHBondContact OE2-N 3.28Å; C321-L325 VanDerWaalsContact O-CB 3.31Å; C321-L325 WeakPolarHBondContact O-CB 3.49Å; C321-L325 PolarHBondContact O-N 2.81Å
322	G	94.3	Very high	90.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-41.1	176.6	0	0	0	0	0	113	Y195 E318 L325 C326	Y195-G322 WeakPolarHBondContact CE1-O 3.48Å; E318-G322 PolarHBondContact O-N 2.96Å; G322-L325 PolarHBondContact O-N 2.95Å; G322-C326 WeakPolarHBondContact O-CB 3.44Å; G322-C326 PolarHBondContact O-N 3.04Å
323	E	93.9	Very high	88.6	Confident	45 Å²	45	48.8 Å²	48.8	21%	0.21	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-46.7	175.5	-167.4	-176.5	-142	0	0	111.3	F190 Y195 P319 T320 L325 C326 R327	F190-E323 HydrophobicContact CB-CG 3.83Å; F190-E323 WeakPolarHBondContact CB-OE1 3.41Å; F190-E323 HydrophobicContact CD1-CG 4.08Å; F190-E323 HydrophobicContact CD2-CG 3.61Å; F190-E323 VanDerWaalsContact CD2-OE1 3.24Å; F190-E323 WeakPolarHBondContact CD2-OE1 3.47Å; F190-E323 HydrophobicContact CE2-CG 4.13Å; F190-E323 HydrophobicContact CG-CG 3.58Å; F190-E323 WeakPolarHBondContact CG-OE1 3.45Å; Y195-E323 WeakPolarHBondContact OH-CA 3.39Å; Y195-E323 WeakPolarHBondContact OH-CB 3.35Å; Y195-E323 PolarHBondContact OH-N 2.89Å; P319-E323 VanDerWaalsContact O-CB 3.27Å; P319-E323 WeakPolarHBondContact O-CB 3.36Å; P319-E323 PolarHBondContact O-N 3.28Å; T320-E323 PolarHBondContact O-N 2.69Å; E323-L325 VanDerWaalsContact C-N 3.34Å; E323-L325 PolarHBondContact O-N 3.14Å; E323-C326 PolarHBondContact O-N 3.14Å; E323-R327 WeakPolarHBondContact O-CG 3.21Å; E323-R327 PolarHBondContact O-N 2.89Å; E323-R327 IonicContact OE1-CZ 2.88Å; E323-R327 IonicContact OE1-NH1 2.66Å; E323-R327 IonicContact OE1-NH2 2.73Å; E323-R327 PolarHBondContact OE1-NH2 3.41Å; E323-R327 IonicContact OE2-CZ 2.64Å; E323-R327 VanDerWaalsContact OE2-CZ 3.3Å; E323-R327 IonicContact OE2-NH1 3.37Å; E323-R327 PolarHBondContact OE2-NH1 2.75Å; E323-R327 IonicContact OE2-NH2 2.88Å; E323-R327 PolarHBondContact OE2-NH2 3.16Å; E323-R327 VanDerWaalsContact OE2-NH2 3.13Å
324	A	93.5	Very high	86.5	Confident	31 Å²	31	55.7 Å²	55.7	26%	0.256	28%	0.283	S	S	.	.	H	α-helix	trans	-59.4	-43.5	175.3	0	0	0	0	0	111.8	L298 T320 C326 R327 L328	L298-A324 HydrophobicContact CD1-CB 4.34Å; L298-A324 HydrophobicContact CD2-CB 3.72Å; T320-A324 WeakPolarHBondContact O-CB 3.32Å; T320-A324 PolarHBondContact O-N 3.41Å; A324-C326 PolarHBondContact O-N 3.49Å; A324-R327 PolarHBondContact O-N 2.96Å; A324-L328 WeakPolarHBondContact O-CG 3.3Å; A324-L328 PolarHBondContact O-N 3.42Å
325	L	94.5	Very high	84.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-42.2	175.1	-179.4	55.9	0	0	0	112	I238 F247 L290 T295 L298 V308 I317 C321 G322 E323 L328 F329	I238-L325 HydrophobicContact CD1-CD2 3.7Å; I238-L325 HydrophobicContact CD1-CG 4.14Å; I238-L325 HydrophobicContact CG2-CD2 4.17Å; F247-L325 HydrophobicContact CD2-CD1 4.27Å; F247-L325 HydrophobicContact CE1-CD2 4.23Å; F247-L325 HydrophobicContact CE2-CD1 3.9Å; F247-L325 HydrophobicContact CE2-CD2 4.48Å; F247-L325 HydrophobicContact CZ-CD1 4.27Å; F247-L325 HydrophobicContact CZ-CD2 4.03Å; L290-L325 HydrophobicContact CD2-CD1 3.79Å; T295-L325 HydrophobicContact CG2-CD1 3.61Å; L298-L325 HydrophobicContact CD1-CB 3.76Å; L298-L325 HydrophobicContact CD1-CD1 4.13Å; V308-L325 HydrophobicContact CG1-CD1 4.36Å; V308-L325 HydrophobicContact CG1-CD2 3.95Å; V308-L325 HydrophobicContact CG2-CD2 3.72Å; I317-L325 HydrophobicContact CD1-CD2 4.48Å; C321-L325 VanDerWaalsContact O-CB 3.31Å; C321-L325 WeakPolarHBondContact O-CB 3.49Å; C321-L325 PolarHBondContact O-N 2.81Å; G322-L325 PolarHBondContact O-N 2.95Å; E323-L325 VanDerWaalsContact C-N 3.34Å; E323-L325 PolarHBondContact O-N 3.14Å; L325-L328 PolarHBondContact O-N 3.11Å; L325-F329 HydrophobicContact CD1-CE2 4.47Å; L325-F329 HydrophobicContact CG-CE2 4.37Å; L325-F329 VanDerWaalsContact O-CD2 3.23Å; L325-F329 WeakPolarHBondContact O-CD2 3.47Å; L325-F329 WeakPolarHBondContact O-CE2 3.48Å
326	C	92.9	Very high	82	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-35.7	175.1	-82	0	0	0	0	113.1	I185 F190 F250 G322 E323 A324 L328 F329	I185-C326 WeakPolarHBondContact CD1-O 3.38Å; F190-C326 HydrophobicContact CE1-CB 3.55Å; F190-C326 HydrophobicContact CZ-CB 3.88Å; F250-C326 VanDerWaalsContact CD2-SG 3.57Å; F250-C326 HydrophobicContact CE1-CB 4.44Å; F250-C326 HydrophobicContact CE2-CB 4.21Å; F250-C326 VanDerWaalsContact CE2-SG 3.59Å; F250-C326 HydrophobicContact CZ-CB 4.07Å; G322-C326 WeakPolarHBondContact O-CB 3.44Å; G322-C326 PolarHBondContact O-N 3.04Å; E323-C326 PolarHBondContact O-N 3.14Å; A324-C326 PolarHBondContact O-N 3.49Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.7Å; C326-F329 PolarHBondContact O-N 2.89Å
327	R	91	Very high	79.7	Confident	116 Å²	116	67 Å²	67	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-67	-22.1	175.1	-74.4	-178.7	177	115.2	10.3	114.1	F190 E323 A324	F190-R327 HydrophobicContact CE2-CG 4.45Å; E323-R327 WeakPolarHBondContact O-CG 3.21Å; E323-R327 PolarHBondContact O-N 2.89Å; E323-R327 IonicContact OE1-CZ 2.88Å; E323-R327 IonicContact OE1-NH1 2.66Å; E323-R327 IonicContact OE1-NH2 2.73Å; E323-R327 PolarHBondContact OE1-NH2 3.41Å; E323-R327 IonicContact OE2-CZ 2.64Å; E323-R327 VanDerWaalsContact OE2-CZ 3.3Å; E323-R327 IonicContact OE2-NH1 3.37Å; E323-R327 PolarHBondContact OE2-NH1 2.75Å; E323-R327 IonicContact OE2-NH2 2.88Å; E323-R327 PolarHBondContact OE2-NH2 3.16Å; E323-R327 VanDerWaalsContact OE2-NH2 3.13Å; A324-R327 PolarHBondContact O-N 2.96Å
328	L	92	Very high	77.6	Confident	51 Å²	51	71.1 Å²	71.1	27%	0.267	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.6	179.7	-71.2	177.4	0	0	0	114.6	L290 T295 L298 A324 L325 C326	L290-L328 HydrophobicContact CD1-CB 4.23Å; L290-L328 WeakPolarHBondContact CD1-O 3.25Å; L290-L328 HydrophobicContact CD2-CB 3.8Å; T295-L328 HydrophobicContact CG2-CD1 4.13Å; L298-L328 HydrophobicContact CD1-CD1 3.65Å; L298-L328 HydrophobicContact CG-CD1 4.37Å; A324-L328 WeakPolarHBondContact O-CG 3.3Å; A324-L328 PolarHBondContact O-N 3.42Å; L325-L328 PolarHBondContact O-N 3.11Å; C326-L328 VanDerWaalsContact C-N 3.28Å; C326-L328 PolarHBondContact O-N 2.7Å
329	F	91.3	Very high	75.6	Confident	6 Å²	6	74 Å²	74	3%	0.026	37%	0.373	C	S	.	.	S	Bend	trans	-71.4	141.5	176.4	-76.3	-91.3	0	0	0	111.1	I238 F247 G249 F250 L290 L325 C326	I238-F329 HydrophobicContact CG2-CE2 4.47Å; I238-F329 HydrophobicContact CG2-CZ 4.2Å; F247-F329 HydrophobicContact CB-CE1 4.03Å; F247-F329 HydrophobicContact CB-CZ 3.76Å; F247-F329 HydrophobicContact CG-CZ 4.35Å; G249-F329 VanDerWaalsContact CA-CE1 3.47Å; F250-F329 HydrophobicContact CD1-CB 4.48Å; F250-F329 HydrophobicContact CD1-CD1 4.25Å; F250-F329 AromaticContact CD1-CD2 3.58Å; F250-F329 HydrophobicContact CD1-CD2 3.58Å; F250-F329 HydrophobicContact CD1-CE1 4.43Å; F250-F329 AromaticContact CD1-CE2 3.76Å; F250-F329 HydrophobicContact CD1-CE2 3.76Å; F250-F329 AromaticContact CD1-CG 3.84Å; F250-F329 HydrophobicContact CD1-CG 3.84Å; F250-F329 HydrophobicContact CD1-CZ 4.19Å; F250-F329 HydrophobicContact CE1-CB 3.99Å; F250-F329 AromaticContact CE1-CD2 3.68Å; F250-F329 HydrophobicContact CE1-CD2 3.68Å; F250-F329 HydrophobicContact CE1-CE2 4.32Å; F250-F329 AromaticContact CE1-CG 3.83Å; F250-F329 HydrophobicContact CE1-CG 3.83Å; L290-F329 HydrophobicContact CB-CD1 3.72Å; L290-F329 HydrophobicContact CB-CE1 3.5Å; L290-F329 VanDerWaalsContact CB-CE1 3.5Å; L290-F329 HydrophobicContact CB-CG 4.34Å; L290-F329 HydrophobicContact CB-CZ 3.99Å; L290-F329 HydrophobicContact CD2-CD1 4.2Å; L290-F329 HydrophobicContact CD2-CD2 3.74Å; L290-F329 HydrophobicContact CD2-CE1 4.08Å; L290-F329 HydrophobicContact CD2-CE2 3.63Å; L290-F329 HydrophobicContact CD2-CG 4.04Å; L290-F329 HydrophobicContact CD2-CZ 3.81Å; L290-F329 HydrophobicContact CG-CE1 4.45Å; L325-F329 HydrophobicContact CD1-CE2 4.47Å; L325-F329 HydrophobicContact CG-CE2 4.37Å; L325-F329 VanDerWaalsContact O-CD2 3.23Å; L325-F329 WeakPolarHBondContact O-CD2 3.47Å; L325-F329 WeakPolarHBondContact O-CE2 3.48Å; C326-F329 PolarHBondContact O-N 2.89Å
330	N	81.1	Confident	73.3	Confident	93 Å²	93	79.3 Å²	79.3	50%	0.497	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-64.6	145.9	170.8	-74.4	18	0	0	0	109.4	S286 S288 D332	S286-N330 PolarHBondContact OG-O 3.45Å; S288-N330 PolarHBondContact OG-N 2.76Å; S288-N330 PolarHBondContact OG-O 3.44Å; S288-N330 VanDerWaalsContact OG-O 3.14Å; N330-D332 PolarHBondContact O-N 2.67Å
331	K	65.5	Low	71.3	Confident	120 Å²	120	79.8 Å²	79.8	52%	0.522	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-70.2	120.8	176.9	-157.9	178.9	-171	178.7	0	109.7	E333	K331-E333 PolarHBondContact O-N 3.16Å
332	D	63.3	Low	69.5	Low	49 Å²	49	82.2 Å²	82.2	26%	0.262	40%	0.403	S	S	.	.			trans	-66.4	115.6	172.3	-74.6	36.7	0	0	0	109.3	S286 K287 S288 N330 L334	S286-D332 VanDerWaalsContact CA-OD1 3.27Å; S286-D332 WeakPolarHBondContact CA-OD1 3.28Å; S286-D332 VanDerWaalsContact CB-OD1 3.3Å; S286-D332 WeakPolarHBondContact CB-OD1 3.01Å; S286-D332 PolarHBondContact OG-OD1 2.82Å; K287-D332 WeakPolarHBondContact CB-OD2 3.33Å; K287-D332 VanDerWaalsContact N-CG 3.34Å; K287-D332 PolarHBondContact N-OD1 3.26Å; K287-D332 VanDerWaalsContact N-OD1 3.16Å; K287-D332 PolarHBondContact N-OD2 2.69Å; S288-D332 PolarHBondContact N-OD1 2.93Å; N330-D332 PolarHBondContact O-N 2.67Å; D332-L334 PolarHBondContact O-N 2.77Å
333	E	56.3	Low	67.6	Low	191 Å²	191	86.6 Å²	86.6	89%	0.893	43%	0.426	S	S	*	.	S	Bend	trans	-68.8	-13.8	179.7	-61.2	-175.3	138.7	0	0	113	K331 G335	K331-E333 PolarHBondContact O-N 3.16Å; E333-G335 VanDerWaalsContact C-N 3.25Å; E333-G335 PolarHBondContact O-N 3.25Å
334	L	50.5	Low	65.5	Low	179 Å²	179	89.9 Å²	89.9	94%	0.937	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	33.4	-179.2	-60.6	170.2	0	0	0	113.2	D332	D332-L334 PolarHBondContact O-N 2.77Å
335	G	48.2	Very low	63.9	Low	26 Å²	26	91.4 Å²	91.4	27%	0.268	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	-10.5	-161.5	0	0	0	0	0	118.6	E333 E337 Q338	E333-G335 VanDerWaalsContact C-N 3.25Å; E333-G335 PolarHBondContact O-N 3.25Å; G335-E337 PolarHBondContact O-N 2.98Å; G335-Q338 WeakPolarHBondContact O-CB 3.37Å; G335-Q338 PolarHBondContact O-N 2.79Å; G335-Q338 VanDerWaalsContact O-N 3.14Å
336	E	45.7	Very low	62.2	Low	118 Å²	118	92.6 Å²	92.6	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-63.9	-45.2	-169.1	-70.4	-61.6	142.8	0	0	113.7	Q338 K339	E336-Q338 PolarHBondContact O-N 2.82Å; E336-Q338 VanDerWaalsContact O-N 3.11Å; E336-K339 WeakPolarHBondContact O-CB 3.31Å; E336-K339 PolarHBondContact O-N 2.88Å; E336-K339 VanDerWaalsContact O-N 3.14Å; E336-K339 WeakPolarHBondContact OE1-CE 3.34Å; E336-K339 IonicContact OE1-NZ 2.76Å; E336-K339 PolarHBondContact OE1-NZ 2.89Å; E336-K339 WeakPolarHBondContact OE2-CD 3.48Å; E336-K339 VanDerWaalsContact OE2-CE 3.23Å; E336-K339 WeakPolarHBondContact OE2-CE 3.41Å; E336-K339 IonicContact OE2-NZ 3.26Å; E336-K339 PolarHBondContact OE2-NZ 3.49Å
337	E	48.4	Very low	60.5	Low	180 Å²	180	97.1 Å²	97.1	84%	0.841	48%	0.483	S	S	*	.	H	α-helix	trans	-56.4	-29.6	175.5	-62	-173.3	151.1	0	0	112.9	G335 K339	G335-E337 PolarHBondContact O-N 2.98Å; E337-K339 VanDerWaalsContact C-N 3.31Å; E337-K339 PolarHBondContact O-N 2.93Å
338	Q	50.4	Low	59	Low	88 Å²	88	93.4 Å²	93.4	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-77.3	-16.5	-175.1	-154.6	81.4	133.1	0	0	113.2	G335 E336 N342	G335-Q338 WeakPolarHBondContact O-CB 3.37Å; G335-Q338 PolarHBondContact O-N 2.79Å; G335-Q338 VanDerWaalsContact O-N 3.14Å; E336-Q338 PolarHBondContact O-N 2.82Å; E336-Q338 VanDerWaalsContact O-N 3.11Å; Q338-N342 PolarHBondContact O-N 2.71Å; Q338-N342 VanDerWaalsContact O-N 3.14Å; Q338-N342 PolarHBondContact O-ND2 3.37Å; Q338-N342 VanDerWaalsContact O-ND2 3.16Å
339	K	53.1	Low	57.7	Low	99 Å²	99	91.9 Å²	91.9	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-43.9	-178.3	-69.6	-177.7	-176.3	166.7	0	113.2	E336 E337 N342	E336-K339 WeakPolarHBondContact O-CB 3.31Å; E336-K339 PolarHBondContact O-N 2.88Å; E336-K339 VanDerWaalsContact O-N 3.14Å; E336-K339 WeakPolarHBondContact OE1-CE 3.34Å; E336-K339 IonicContact OE1-NZ 2.76Å; E336-K339 PolarHBondContact OE1-NZ 2.89Å; E336-K339 WeakPolarHBondContact OE2-CD 3.48Å; E336-K339 VanDerWaalsContact OE2-CE 3.23Å; E336-K339 WeakPolarHBondContact OE2-CE 3.41Å; E336-K339 IonicContact OE2-NZ 3.26Å; E336-K339 PolarHBondContact OE2-NZ 3.49Å; E337-K339 VanDerWaalsContact C-N 3.31Å; E337-K339 PolarHBondContact O-N 2.93Å; K339-N342 WeakPolarHBondContact O-CB 3.49Å; K339-N342 PolarHBondContact O-N 3.13Å
340	Q	45.8	Very low	56.3	Low	167 Å²	167	96.6 Å²	96.6	78%	0.78	49%	0.491	S	S	*	.	H	α-helix	trans	-67.8	-46.4	-177.7	-63.3	-171	3.1	0	0	111	N342 I343	Q340-N342 PolarHBondContact O-N 2.95Å; Q340-I343 PolarHBondContact O-N 2.8Å
341	L	51.2	Low	55.3	Low	106 Å²	106	96.4 Å²	96.4	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-58.4	-34.3	175.7	-70.2	169.7	0	0	0	112.8	I343 Q345	L341-I343 VanDerWaalsContact C-N 3.32Å; L341-I343 PolarHBondContact O-N 2.83Å; L341-Q345 WeakPolarHBondContact O-CB 3.22Å; L341-Q345 PolarHBondContact O-N 3.49Å
342	N	56.3	Low	55.2	Low	61 Å²	61	94.4 Å²	94.4	33%	0.326	49%	0.49	S	S	.	.	H	α-helix	trans	-59.7	-36	-179.5	-83.2	-29	0	0	0	113.8	K283 Q338 K339 Q340 A346	K283-N342 VanDerWaalsContact CE-OD1 3.29Å; K283-N342 WeakPolarHBondContact CE-OD1 3.47Å; K283-N342 PolarHBondContact NZ-OD1 3.29Å; Q338-N342 PolarHBondContact O-N 2.71Å; Q338-N342 VanDerWaalsContact O-N 3.14Å; Q338-N342 PolarHBondContact O-ND2 3.37Å; Q338-N342 VanDerWaalsContact O-ND2 3.16Å; K339-N342 WeakPolarHBondContact O-CB 3.49Å; K339-N342 PolarHBondContact O-N 3.13Å; Q340-N342 PolarHBondContact O-N 2.95Å; N342-A346 WeakPolarHBondContact O-CB 3.2Å; N342-A346 PolarHBondContact O-N 3.46Å
343	I	55.1	Low	55.2	Low	93 Å²	93	93.6 Å²	93.6	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-72.7	-52.9	-174.2	-60.6	177.5	0	0	0	110.6	Q340 L341 Q345 A346 I347	Q340-I343 PolarHBondContact O-N 2.8Å; L341-I343 VanDerWaalsContact C-N 3.32Å; L341-I343 PolarHBondContact O-N 2.83Å; I343-Q345 VanDerWaalsContact C-N 3.35Å; I343-Q345 PolarHBondContact O-N 2.87Å; I343-A346 PolarHBondContact O-N 3.41Å; I343-I347 HydrophobicContact CG2-CD1 4.22Å; I343-I347 WeakPolarHBondContact O-CG1 3.39Å; I343-I347 PolarHBondContact O-N 2.81Å; I343-I347 VanDerWaalsContact O-N 3.13Å
344	V	50	Low	55.5	Low	114 Å²	114	92 Å²	92	69%	0.691	47%	0.469	S	S	*	.	H	α-helix	trans	-62.4	-44.1	178.2	-177.5	0	0	0	0	110.5	A346 I347 G348	V344-A346 PolarHBondContact O-N 3.11Å; V344-I347 PolarHBondContact O-N 3.19Å; V344-G348 PolarHBondContact O-N 2.64Å
345	Q	59.1	Low	55.9	Low	63 Å²	63	87.5 Å²	87.5	29%	0.294	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-43.5	177.5	-168.5	-169.5	-24.2	0	0	111.7	L341 I343 I347 G348 E349	L341-Q345 WeakPolarHBondContact O-CB 3.22Å; L341-Q345 PolarHBondContact O-N 3.49Å; I343-Q345 VanDerWaalsContact C-N 3.35Å; I343-Q345 PolarHBondContact O-N 2.87Å; Q345-I347 VanDerWaalsContact C-N 3.33Å; Q345-I347 PolarHBondContact O-N 2.63Å; Q345-G348 PolarHBondContact O-N 3.1Å; Q345-E349 HydrophobicContact CG-CG 4.42Å; Q345-E349 WeakPolarHBondContact CG-OE1 3.35Å; Q345-E349 PolarHBondContact NE2-OE1 3.14Å; Q345-E349 WeakPolarHBondContact O-CB 3.43Å; Q345-E349 VanDerWaalsContact O-CG 3.25Å; Q345-E349 WeakPolarHBondContact O-CG 3.38Å; Q345-E349 PolarHBondContact O-N 3.3Å
346	A	58.1	Low	56.4	Low	24 Å²	24	87.9 Å²	87.9	20%	0.198	45%	0.446	C	S	.	.	H	α-helix	trans	-66	-32	178.7	0	0	0	0	0	113.3	N342 I343 V344 R350	N342-A346 WeakPolarHBondContact O-CB 3.2Å; N342-A346 PolarHBondContact O-N 3.46Å; I343-A346 PolarHBondContact O-N 3.41Å; V344-A346 PolarHBondContact O-N 3.11Å; A346-R350 WeakPolarHBondContact O-CB 3.38Å; A346-R350 WeakPolarHBondContact O-CD 3.46Å; A346-R350 VanDerWaalsContact O-CG 3.23Å; A346-R350 WeakPolarHBondContact O-CG 3.4Å; A346-R350 PolarHBondContact O-N 2.92Å; A346-R350 VanDerWaalsContact O-N 3.1Å
347	I	57.8	Low	56.8	Low	95 Å²	95	88.9 Å²	88.9	49%	0.487	45%	0.449	S	S	.	.	H	α-helix	trans	-70.2	-48.1	174.3	-66	166.7	0	0	0	110.3	I343 V344 Q345 E349 R350 I351	I343-I347 HydrophobicContact CG2-CD1 4.22Å; I343-I347 WeakPolarHBondContact O-CG1 3.39Å; I343-I347 PolarHBondContact O-N 2.81Å; I343-I347 VanDerWaalsContact O-N 3.13Å; V344-I347 PolarHBondContact O-N 3.19Å; Q345-I347 VanDerWaalsContact C-N 3.33Å; Q345-I347 PolarHBondContact O-N 2.63Å; I347-E349 PolarHBondContact O-N 3.19Å; I347-R350 PolarHBondContact O-N 3.11Å; I347-I351 HydrophobicContact CG2-CD1 4.24Å; I347-I351 WeakPolarHBondContact O-CG1 3.38Å; I347-I351 PolarHBondContact O-N 3.1Å; I347-I351 VanDerWaalsContact O-N 3.1Å
348	G	60.1	Low	57.3	Low	39 Å²	39	85 Å²	85	40%	0.402	43%	0.431	S	S	.	.	H	α-helix	trans	-60.9	-42.6	176.3	0	0	0	0	0	113.2	V344 Q345 R350 I351 S352	V344-G348 PolarHBondContact O-N 2.64Å; Q345-G348 PolarHBondContact O-N 3.1Å; G348-R350 PolarHBondContact O-N 3.03Å; G348-I351 PolarHBondContact O-N 3.21Å; G348-S352 WeakPolarHBondContact O-CB 3.3Å; G348-S352 PolarHBondContact O-N 3Å
349	E	65.4	Low	57.5	Low	19 Å²	19	90.3 Å²	90.3	9%	0.089	45%	0.448	C	S	.	.	H	α-helix	trans	-57.8	-46.4	172.4	-78.5	172.6	-160.7	0	0	111.9	R252 Q345 I347 I351 S352 R353	R252-E349 IonicContact CZ-OE2 2.71Å; R252-E349 VanDerWaalsContact CZ-OE2 3.26Å; R252-E349 IonicContact NH1-OE2 3.3Å; R252-E349 PolarHBondContact NH1-OE2 3.46Å; R252-E349 VanDerWaalsContact NH2-CD 3.31Å; R252-E349 IonicContact NH2-OE1 2.93Å; R252-E349 PolarHBondContact NH2-OE1 3.28Å; R252-E349 IonicContact NH2-OE2 3.13Å; R252-E349 PolarHBondContact NH2-OE2 2.86Å; Q345-E349 HydrophobicContact CG-CG 4.42Å; Q345-E349 WeakPolarHBondContact CG-OE1 3.35Å; Q345-E349 PolarHBondContact NE2-OE1 3.14Å; Q345-E349 WeakPolarHBondContact O-CB 3.43Å; Q345-E349 VanDerWaalsContact O-CG 3.25Å; Q345-E349 WeakPolarHBondContact O-CG 3.38Å; Q345-E349 PolarHBondContact O-N 3.3Å; I347-E349 PolarHBondContact O-N 3.19Å; E349-I351 VanDerWaalsContact C-N 3.32Å; E349-I351 PolarHBondContact O-N 3.08Å; E349-S352 PolarHBondContact O-N 2.85Å; E349-R353 WeakPolarHBondContact O-CG 3.27Å; E349-R353 PolarHBondContact O-N 2.87Å; E349-R353 IonicContact OE2-NH2 2.88Å; E349-R353 PolarHBondContact OE2-NH2 2.92Å
350	R	60.9	Low	57.6	Low	105 Å²	105	90.5 Å²	90.5	40%	0.396	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-38.2	178.6	-79.6	169.7	173.5	177.5	1	112.4	A346 I347 G348 R354	A346-R350 WeakPolarHBondContact O-CB 3.38Å; A346-R350 WeakPolarHBondContact O-CD 3.46Å; A346-R350 VanDerWaalsContact O-CG 3.23Å; A346-R350 WeakPolarHBondContact O-CG 3.4Å; A346-R350 PolarHBondContact O-N 2.92Å; A346-R350 VanDerWaalsContact O-N 3.1Å; I347-R350 PolarHBondContact O-N 3.11Å; G348-R350 PolarHBondContact O-N 3.03Å; R350-R354 WeakPolarHBondContact O-CG 3.25Å; R350-R354 PolarHBondContact O-N 3Å; R350-R354 PolarHBondContact O-NH1 3.02Å
351	I	59.6	Low	57.8	Low	88 Å²	88	85 Å²	85	45%	0.451	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-48.3	174.8	-64.2	165.5	0	0	0	110	I347 G348 E349 R353 R354 N355	I347-I351 HydrophobicContact CG2-CD1 4.24Å; I347-I351 WeakPolarHBondContact O-CG1 3.38Å; I347-I351 PolarHBondContact O-N 3.1Å; I347-I351 VanDerWaalsContact O-N 3.1Å; G348-I351 PolarHBondContact O-N 3.21Å; E349-I351 VanDerWaalsContact C-N 3.32Å; E349-I351 PolarHBondContact O-N 3.08Å; I351-R353 PolarHBondContact O-N 3.12Å; I351-R354 PolarHBondContact O-N 3.19Å; I351-N355 PolarHBondContact O-N 3.33Å
352	S	63.9	Low	57.8	Low	78 Å²	78	87.4 Å²	87.4	55%	0.545	45%	0.447	S	S	.	.	H	α-helix	trans	-59.3	-42.6	179.6	-170	0	0	0	0	113.1	G348 E349 N355 A356	G348-S352 WeakPolarHBondContact O-CB 3.3Å; G348-S352 PolarHBondContact O-N 3Å; E349-S352 PolarHBondContact O-N 2.85Å; S352-N355 PolarHBondContact O-N 3Å; S352-A356 PolarHBondContact O-N 3.27Å
353	R	63.7	Low	57.4	Low	33 Å²	33	91.1 Å²	91.1	13%	0.125	47%	0.465	C	S	.	.	H	α-helix	trans	-65.2	-39.9	178.3	-69.2	-175.2	-150.5	178.6	9.3	113.2	F229 N233 E349 I351 N355 A356 F357	F229-R353 HydrophobicContact CE1-CG 4.11Å; F229-R353 HydrophobicContact CZ-CG 3.95Å; F229-R353 VanDerWaalsContact CZ-NE 3.29Å; N233-R353 PolarHBondContact O-NH1 2.85Å; E349-R353 WeakPolarHBondContact O-CG 3.27Å; E349-R353 PolarHBondContact O-N 2.87Å; E349-R353 IonicContact OE2-NH2 2.88Å; E349-R353 PolarHBondContact OE2-NH2 2.92Å; I351-R353 PolarHBondContact O-N 3.12Å; R353-N355 VanDerWaalsContact C-N 3.34Å; R353-N355 PolarHBondContact O-N 2.87Å; R353-A356 WeakPolarHBondContact O-CB 3.25Å; R353-A356 PolarHBondContact O-N 2.7Å; R353-F357 PolarHBondContact O-N 2.84Å
354	R	61.6	Low	57	Low	156 Å²	156	93.3 Å²	93.3	59%	0.589	48%	0.483	S	S	*	.	H	α-helix	trans	-61.5	-43.4	174.6	-68.7	-178.2	-163.7	111.3	-10.7	111.4	R350 I351 A356 F357 E358	R350-R354 WeakPolarHBondContact O-CG 3.25Å; R350-R354 PolarHBondContact O-N 3Å; R350-R354 PolarHBondContact O-NH1 3.02Å; I351-R354 PolarHBondContact O-N 3.19Å; R354-A356 VanDerWaalsContact C-N 3.28Å; R354-A356 PolarHBondContact O-N 2.79Å; R354-F357 WeakPolarHBondContact O-CB 3.27Å; R354-F357 PolarHBondContact O-N 3.08Å; R354-F357 VanDerWaalsContact O-N 3.16Å; R354-E358 PolarHBondContact O-N 2.92Å
355	N	59	Low	56.5	Low	85 Å²	85	90.8 Å²	90.8	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-31.1	177.4	-65.3	-10.5	0	0	0	112.5	I351 S352 R353 R359	I351-N355 PolarHBondContact O-N 3.33Å; S352-N355 PolarHBondContact O-N 3Å; R353-N355 VanDerWaalsContact C-N 3.34Å; R353-N355 PolarHBondContact O-N 2.87Å; N355-R359 WeakPolarHBondContact O-CG 3.27Å; N355-R359 PolarHBondContact O-N 3.47Å
356	A	60.1	Low	55.3	Low	34 Å²	34	99 Å²	99	28%	0.281	51%	0.508	S	S	.	.	H	α-helix	trans	-70.4	-41.9	172.1	0	0	0	0	0	112.3	F230 S352 R353 R354 E358 R359 L360	F230-A356 HydrophobicContact CE1-CB 4.3Å; S352-A356 PolarHBondContact O-N 3.27Å; R353-A356 WeakPolarHBondContact O-CB 3.25Å; R353-A356 PolarHBondContact O-N 2.7Å; R354-A356 VanDerWaalsContact C-N 3.28Å; R354-A356 PolarHBondContact O-N 2.79Å; A356-E358 PolarHBondContact O-N 2.96Å; A356-R359 PolarHBondContact O-N 2.94Å; A356-L360 PolarHBondContact O-N 2.9Å; A356-L360 VanDerWaalsContact O-N 3.12Å
357	F	52.9	Low	54.2	Low	139 Å²	139	107.7 Å²	107.7	61%	0.61	54%	0.544	S	S	*	.	H	α-helix	trans	-59.8	-45	175.7	-177.9	-94.6	0	0	0	111.9	R353 R354 R359 L360 G361	R353-F357 PolarHBondContact O-N 2.84Å; R354-F357 WeakPolarHBondContact O-CB 3.27Å; R354-F357 PolarHBondContact O-N 3.08Å; R354-F357 VanDerWaalsContact O-N 3.16Å; F357-R359 VanDerWaalsContact C-N 3.3Å; F357-R359 PolarHBondContact O-N 3.41Å; F357-L360 PolarHBondContact O-N 2.88Å; F357-G361 PolarHBondContact O-N 2.88Å
358	E	59.7	Low	53	Low	100 Å²	100	106.8 Å²	106.8	47%	0.467	56%	0.558	S	S	.	*	H	α-helix	trans	-60.1	-37.4	175.5	-81	-158.9	-137.4	0	0	113.6	R354 A356 K362	R354-E358 PolarHBondContact O-N 2.92Å; A356-E358 PolarHBondContact O-N 2.96Å; E358-K362 WeakPolarHBondContact O-CB 3.47Å; E358-K362 WeakPolarHBondContact O-CD 3.2Å; E358-K362 WeakPolarHBondContact O-CG 3.33Å; E358-K362 PolarHBondContact O-N 3.39Å; E358-K362 IonicContact OE2-NZ 2.62Å; E358-K362 PolarHBondContact OE2-NZ 2.94Å
359	R	54.1	Low	52.2	Low	199 Å²	199	114.5 Å²	114.5	75%	0.751	58%	0.584	S	S	*	*	H	α-helix	trans	-70	-33.6	178.8	-73.9	176.5	179.7	-140.8	-0.5	112.7	N355 A356 F357 I363	N355-R359 WeakPolarHBondContact O-CG 3.27Å; N355-R359 PolarHBondContact O-N 3.47Å; A356-R359 PolarHBondContact O-N 2.94Å; F357-R359 VanDerWaalsContact C-N 3.3Å; F357-R359 PolarHBondContact O-N 3.41Å; R359-I363 WeakPolarHBondContact O-CD1 3.29Å
360	L	56.2	Low	50.8	Low	103 Å²	103	120.1 Å²	120.1	54%	0.539	62%	0.619	S	S	.	*	H	α-helix	trans	-79.7	-44.2	176	-68.2	170.5	0	0	0	111.9	F230 A356 F357 K362 I363	F230-L360 HydrophobicContact CZ-CD1 4.29Å; A356-L360 PolarHBondContact O-N 2.9Å; A356-L360 VanDerWaalsContact O-N 3.12Å; F357-L360 PolarHBondContact O-N 2.88Å; L360-K362 VanDerWaalsContact C-N 3.31Å; L360-K362 PolarHBondContact O-N 3.24Å; L360-I363 PolarHBondContact O-N 3.43Å
361	G	48.4	Very low	49.6	Very low	52 Å²	52	120.7 Å²	120.7	54%	0.536	64%	0.64	S	S	.	*	H	α-helix	trans	-64.3	-29.8	-177.8	0	0	0	0	0	114.4	F357 I363	F357-G361 PolarHBondContact O-N 2.88Å; G361-I363 VanDerWaalsContact C-N 3.31Å; G361-I363 PolarHBondContact O-N 3.1Å
362	K	51.9	Low	48.8	Very low	156 Å²	156	125 Å²	125	68%	0.678	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-7.1	180	-75.3	169.3	176.6	166	0	114.7	E358 L360	E358-K362 WeakPolarHBondContact O-CB 3.47Å; E358-K362 WeakPolarHBondContact O-CD 3.2Å; E358-K362 WeakPolarHBondContact O-CG 3.33Å; E358-K362 PolarHBondContact O-N 3.39Å; E358-K362 IonicContact OE2-NZ 2.62Å; E358-K362 PolarHBondContact OE2-NZ 2.94Å; L360-K362 VanDerWaalsContact C-N 3.31Å; L360-K362 PolarHBondContact O-N 3.24Å
363	I	48.7	Very low	47.8	Very low	138 Å²	138	129.2 Å²	129.2	71%	0.708	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-27.2	-173.9	-65.1	177.4	0	0	0	113	R359 L360 G361 G365	R359-I363 WeakPolarHBondContact O-CD1 3.29Å; L360-I363 PolarHBondContact O-N 3.43Å; G361-I363 VanDerWaalsContact C-N 3.31Å; G361-I363 PolarHBondContact O-N 3.1Å; I363-G365 VanDerWaalsContact C-N 3.3Å; I363-G365 PolarHBondContact O-N 2.97Å
364	V	46.2	Very low	46.4	Very low	140 Å²	140	131.2 Å²	131.2	85%	0.848	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	44.6	-174.9	-161.5	0	0	0	0	111.8
365	G	38.7	Very low	45.4	Very low	60 Å²	60	128.5 Å²	128.5	62%	0.619	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	7.7	-163.5	0	0	0	0	0	119.4	I363	I363-G365 VanDerWaalsContact C-N 3.3Å; I363-G365 PolarHBondContact O-N 2.97Å
366	R	35	Very low	44.4	Very low	237 Å²	237	135.6 Å²	135.6	89%	0.894	73%	0.73	S	S	*	*	S	Bend	trans	-171.3	83.9	169.6	-109.6	170.4	-160.1	-141.9	6.6	112.8
367	H	34.4	Very low	43.4	Very low	205 Å²	205	140 Å²	140	95%	0.949	75%	0.753	S	S	*	*			trans	-158	105.5	155.2	-109.7	68.3	0	0	0	107.2
368	G	33.2	Very low	42.7	Very low	77 Å²	77	139.8 Å²	139.8	79%	0.794	76%	0.763	S	S	*	*			trans	145.8	29.7	-171.7	0	0	0	0	0	117.3
369	Q	43.1	Very low	41.6	Very low	201 Å²	201	138.1 Å²	138.1	94%	0.939	77%	0.773	S	S	*	*			trans	-133.6	133.7	152.5	-79.7	-155.4	-11.2	0	0	110.6
370	T	35.4	Very low	40.8	Very low	136 Å²	136	136 Å²	136	83%	0.834	78%	0.775	S	S	*	*			trans	-91	130.9	-177	47.7	0	0	0	0	111.1
371	S	35.7	Very low	39.8	Very low	117 Å²	117	137.6 Å²	137.6	82%	0.818	79%	0.785	S	S	*	*				173.5	133.8	126.5	-80.5	0	0	0	0	110.8
372	H	43.4	Very low	39.3	Very low	179 Å²	179	140.4 Å²	140.4	83%	0.829	79%	0.787	S	S	*	*			trans	-108.2	148.6	166.1	-62.2	-84.4	0	0	0	109.4
373	N	41.3	Very low	39	Very low	167 Å²	167	140 Å²	140	89%	0.893	79%	0.788	S	S	*	*			trans	110.5	137.8	160.6	-54	-25.8	0	0	0	117
374	G	35.2	Very low	38.5	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	79%	0.785	S	S	*	*			trans	78.7	93.3	-177.8	0	0	0	0	0	113.3
375	S	41.6	Very low	38.2	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	78%	0.78	S	S	*	*			cis	80.9	115.3	24.8	-150	0	0	0	0	115.5
376	R	37.3	Very low	38.6	Very low	233 Å²	233	142.8 Å²	142.8	88%	0.879	79%	0.79	S	S	*	*			trans	73.1	155.5	164.7	-59.1	172.8	-161.4	-153.6	1.9	117.3
377	V	39.7	Very low	38.9	Very low	127 Å²	127	135.4 Å²	135.4	77%	0.77	79%	0.788	S	S	*	*			cis	-170.1	164	-39.7	110.1	0	0	0	0	107.8
378	V	37.9	Very low	39.3	Very low	134 Å²	134	134 Å²	134	81%	0.812	79%	0.787	S	S	*	*			trans	72.1	141	-174.4	-162.6	0	0	0	0	113.5
379	G	35.4	Very low	39.5	Very low	65 Å²	65	138.2 Å²	138.2	67%	0.67	79%	0.79	S	S	*	*			cis	148.9	159.2	-13	0	0	0	0	0	114.7
380	L	37.3	Very low	39.3	Very low	155 Å²	155	131.7 Å²	131.7	81%	0.812	78%	0.777	S	S	*	*			trans	77.6	140.7	164.9	-59.6	174.4	0	0	0	120.4
381	N	36.2	Very low	39.4	Very low	137 Å²	137	133.1 Å²	133.1	73%	0.733	78%	0.779	S	S	*	*			trans	69.6	140.6	158.7	-58.6	1.3	0	0	0	118
382	N	38.4	Very low	39.6	Very low	111 Å²	111	131.4 Å²	131.4	59%	0.594	77%	0.772	S	S	*	*			cis	-156	153.1	-1.7	-127.6	21.4	0	0	0	111.7
383	Q	45.5	Very low	39.3	Very low	147 Å²	147	129.9 Å²	129.9	69%	0.687	78%	0.775	S	S	*	*			trans	64.3	139.8	147.2	-64.1	175.9	-78	0	0	119.2
384	D	38.3	Very low	39.2	Very low	121 Å²	121	125.3 Å²	125.3	65%	0.647	77%	0.768	S	S	*	*			cis	-156.2	166	-5.9	-102.9	-33	0	0	0	111.1
385	N	40.4	Very low	39.4	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	77%	0.769	S	S	*	*			trans	113.2	98.5	159.9	-58.2	-57	0	0	0	120.1
386	T	46.7	Very low	39	Very low	136 Å²	136	129 Å²	129	83%	0.834	77%	0.767	S	S	*	*			trans	63.6	107	131.5	61.8	0	0	0	0	122.5
387	G	40.3	Very low	39.1	Very low	81 Å²	81	124.3 Å²	124.3	84%	0.835	76%	0.755	S	S	*	*			trans	103.8	131.2	140.4	0	0	0	0	0	116.2
388	L	43.3	Very low	38.9	Very low	177 Å²	177	127.3 Å²	127.3	93%	0.927	75%	0.753	S	S	*	*			cis	-145.9	149.1	-0.4	-177.5	65.5	0	0	0	109.5
389	L	37.2	Very low	38.8	Very low	165 Å²	165	130.7 Å²	130.7	86%	0.864	75%	0.752	S	S	*	*			trans	-70.9	164.5	-177.4	-112.6	61.2	0	0	0	113.5
390	G	39.5	Very low	38.8	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	76%	0.758	S	S	*	*			cis	-173.4	-171.5	7.6	0	0	0	0	0	115.4
391	D	35.9	Very low	38.9	Very low	166 Å²	166	131.9 Å²	131.9	89%	0.888	75%	0.753	S	S	*	*			trans	-91.1	176.5	-153.8	-69.5	-77	0	0	0	118.2
392	A	41.2	Very low	38.9	Very low	81 Å²	81	131.2 Å²	131.2	67%	0.669	76%	0.759	S	S	*	*			trans	-83	153	-174.6	0	0	0	0	0	115.4
393	T	37.8	Very low	38.8	Very low	146 Å²	146	132.1 Å²	132.1	90%	0.896	77%	0.769	S	S	*	*			trans	46.5	103.1	147.4	55.7	0	0	0	0	119
394	G	38.4	Very low	38.5	Very low	72 Å²	72	134 Å²	134	74%	0.742	78%	0.778	S	S	*	*			trans	-156.2	76.7	172.8	0	0	0	0	0	114.9
395	T	38.9	Very low	38.5	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	79%	0.788	S	S	*	*			trans	12.6	121.5	158	54	0	0	0	0	119.8
396	N	34.5	Very low	38.1	Very low	125 Å²	125	144 Å²	144	67%	0.668	80%	0.796	S	S	*	*				173.7	132.6	116.1	-102.3	-77.2	0	0	0	113.3
397	Q	39	Very low	37.6	Very low	134 Å²	134	142.8 Å²	142.8	63%	0.626	79%	0.793	S	S	*	*			trans	66.6	151.9	147.2	-64.8	174.5	52.4	0	0	116.8
398	R	34.9	Very low	37.4	Very low	190 Å²	190	146.6 Å²	146.6	72%	0.717	79%	0.793	S	S	*	*			cis	-169.4	137.9	4.5	-127	174.7	-167	160.4	6.3	110
399	Y	35.9	Very low	37.2	Very low	205 Å²	205	144.2 Å²	144.2	80%	0.804	79%	0.786	S	S	*	*			trans	59	163.8	169.2	-60.1	-88.5	0	0	0	116
400	M	35.2	Very low	37.1	Very low	158 Å²	158	142.8 Å²	142.8	78%	0.778	78%	0.779	S	S	*	*			cis	-162.8	150.9	-32	-110.2	-68.3	-179.8	0	0	109.2
401	A	39.9	Very low	36.9	Very low	87 Å²	87	149.6 Å²	149.6	72%	0.719	79%	0.786	S	S	*	*			trans	60.8	160.8	158.4	0	0	0	0	0	118.1
402	S	35.4	Very low	37.3	Very low	123 Å²	123	147.2 Å²	147.2	86%	0.86	78%	0.78	S	S	*	*			cis	-159	175.4	-22.4	-100.8	0	0	0	0	110
403	T	37	Very low	37.2	Very low	130 Å²	130	148.3 Å²	148.3	80%	0.798	78%	0.78	S	S	*	*			trans	-106.2	135.1	-167.2	-52.6	0	0	0	0	115.7
404	E	39.6	Very low	37.5	Very low	186 Å²	186	149.1 Å²	149.1	87%	0.869	78%	0.777	S	S	*	*			trans	-142.2	172.7	157.2	-66.1	-165.4	127.5	0	0	109.9
405	R	37.5	Very low	37.5	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.868	78%	0.781	S	S	*	*				-177.1	126.4	-66.5	-111.8	-167.7	176	-147.9	3.2	106.6
406	R	33.1	Very low	37.7	Very low	242 Å²	242	151.1 Å²	151.1	91%	0.913	78%	0.777	S	S	*	*			trans	11.8	132.5	159.1	-65.8	175.7	168.1	-175.5	-4.5	120.3
407	S	35.8	Very low	37.8	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	78%	0.782	S	S	*	*				-179.7	134.6	107.6	54.5	0	0	0	0	116.5
408	L	35	Very low	37.8	Very low	162 Å²	162	152.1 Å²	152.1	85%	0.848	78%	0.784	S	S	*	*			trans	33	138.6	137.6	-52.8	172.1	0	0	0	123
409	V	39.5	Very low	37.8	Very low	127 Å²	127	150.2 Å²	150.2	77%	0.77	79%	0.789	S	S	*	*				167.2	129.6	110.2	158.5	0	0	0	0	113.8
410	N	35.3	Very low	37.9	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	78%	0.779	S	S	*	*			trans	37.2	118.8	154.5	-59.5	0.2	0	0	0	125.7
411	Y	34.4	Very low	38	Very low	207 Å²	207	145.2 Å²	145.2	81%	0.812	78%	0.783	S	S	*	*				39	154.1	105.4	-72.7	-58	0	0	0	122.7
412	P	44.9	Very low	37.9	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	79%	0.785	S	S	*	*			cis	-139.8	174.4	31.5	43.3	-25.7	0	0	0	119
413	P	39.7	Very low	38.1	Very low	104 Å²	104	144 Å²	144	68%	0.675	78%	0.78	S	S	*	*			trans	-108.4	167.4	167.3	40.5	-31.1	0	0	0	113.7
414	I	42.9	Very low	38	Very low	162 Å²	162	148.4 Å²	148.4	83%	0.831	78%	0.782	S	S	*	*			trans	-138.8	139.5	175.6	-61.1	179.6	0	0	0	111.3
415	T	38.7	Very low	37.8	Very low	135 Å²	135	147.1 Å²	147.1	83%	0.828	78%	0.78	S	S	*	*			trans	-152	139.1	172.6	51.5	0	0	0	0	111.7
416	P	42.9	Very low	37.8	Very low	107 Å²	107	141.9 Å²	141.9	70%	0.695	77%	0.774	S	S	*	*			trans	-110.9	135.1	153.9	-2	24	0	0	0	111.9
417	L	37.8	Very low	37.9	Very low	148 Å²	148	135 Å²	135	78%	0.775	76%	0.763	S	S	*	*				67.5	104.4	93.4	-59.7	177.2	0	0	0	113.5
418	I	37.7	Very low	38	Very low	132 Å²	132	136.8 Å²	136.8	68%	0.677	77%	0.77	S	S	*	*				80.6	117.4	71.7	-71.2	177.2	0	0	0	113.6	T420	I418-T420 HydrophobicContact CG2-CG2 4.44Å
419	N	36.1	Very low	38.1	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	77%	0.768	S	S	*	*			trans	175.7	113.6	142	-82.9	-17	0	0	0	105.8
420	T	38.1	Very low	38.5	Very low	98 Å²	98	133.7 Å²	133.7	60%	0.601	77%	0.774	S	S	*	*				70.9	93.5	54	69.6	0	0	0	0	115.3	I418	I418-T420 HydrophobicContact CG2-CG2 4.44Å
421	D	37.1	Very low	38.8	Very low	160 Å²	160	133 Å²	133	86%	0.856	78%	0.775	S	S	*	*				147.4	160	119.3	-73.1	-23.3	0	0	0	115.5
422	G	37.9	Very low	39.5	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	78%	0.776	S	S	*	*			trans	72.7	84.7	168.6	0	0	0	0	0	116.7
423	S	39.3	Very low	39.3	Very low	110 Å²	110	131 Å²	131	77%	0.769	78%	0.778	S	S	*	*				75.9	115.2	51.5	-151.5	0	0	0	0	115.9
424	R	35.9	Very low	39.6	Very low	223 Å²	223	133.3 Å²	133.3	84%	0.842	78%	0.784	S	S	*	*			trans	91.4	116.9	162.2	-56.1	-178.7	177.5	-142.1	-3.5	120.5
425	L	35	Very low	40	Very low	158 Å²	158	134.6 Å²	134.6	83%	0.827	79%	0.786	S	S	*	*				34.8	133.8	124.4	-46.9	173.9	0	0	0	118.2
426	T	37.2	Very low	40.6	Very low	121 Å²	121	132.6 Å²	132.6	74%	0.742	77%	0.773	S	S	*	*			cis	-157.9	139.3	45.3	48.6	0	0	0	0	115.5
427	S	35.6	Very low	41.5	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	77%	0.769	S	S	*	*			trans	41.7	142.5	140.9	67.9	0	0	0	0	124.5
428	T	37.6	Very low	42.4	Very low	147 Å²	147	129.8 Å²	129.8	90%	0.902	77%	0.765	S	S	*	*			trans	84.3	132.1	162.9	74.2	0	0	0	0	117.5
429	G	37.9	Very low	43.3	Very low	79 Å²	79	126.7 Å²	126.7	81%	0.814	76%	0.759	S	S	*	*			trans	147.8	125.6	-175.8	0	0	0	0	0	110.9
430	T	46.1	Very low	44.5	Very low	145 Å²	145	122 Å²	122	89%	0.89	74%	0.741	S	S	*	*			trans	-93.8	142.2	-172.6	44.2	0	0	0	0	113.2
431	T	41.6	Very low	45.8	Very low	121 Å²	121	119.9 Å²	119.9	74%	0.742	73%	0.734	S	S	*	*			trans	-87.6	144.8	176.2	53.7	0	0	0	0	113.1
432	P	49.8	Very low	47.1	Very low	127 Å²	127	115.3 Å²	115.3	83%	0.825	72%	0.718	S	S	*	*			trans	-112.9	121.6	139	33.1	-25.3	0	0	0	110.5
433	L	40.1	Very low	48.6	Very low	154 Å²	154	118.2 Å²	118.2	81%	0.806	71%	0.713	S	S	*	*			trans	-91.7	175	172.9	-78.4	171.9	0	0	0	111.6
434	L	47	Very low	49.9	Very low	152 Å²	152	115.9 Å²	115.9	80%	0.796	70%	0.701	S	S	*	*			trans	88.7	49.9	169.3	-53.4	171.1	0	0	0	118.3	V436	L434-V436 HydrophobicContact CD2-CG2 3.98Å; L434-V436 PolarHBondContact O-N 2.93Å
435	Q	50.8	Low	51.3	Low	189 Å²	189	107.7 Å²	107.7	88%	0.883	68%	0.681	S	S	*	*			trans	-85	80.2	148.1	-173.6	168.8	-16.4	0	0	109.8
436	V	51.6	Low	52.7	Low	92 Å²	92	103 Å²	103	56%	0.558	67%	0.665	S	S	*	*			trans	-91	114.3	176.4	-179.3	0	0	0	0	109.7	L434 A438 A440	L434-V436 HydrophobicContact CD2-CG2 3.98Å; L434-V436 PolarHBondContact O-N 2.93Å; V436-A438 PolarHBondContact O-N 3.41Å; V436-A440 HydrophobicContact CG1-CB 4.18Å
437	N	61.5	Low	54.1	Low	112 Å²	112	100.3 Å²	100.3	60%	0.599	66%	0.655	S	S	*	*			trans	-55.7	134.4	179.8	-72.6	-22.6	0	0	0	111.9	A439 A440 A441	N437-A439 PolarHBondContact O-N 3.49Å; N437-A440 WeakPolarHBondContact O-CB 3.35Å; N437-A440 PolarHBondContact O-N 2.93Å; N437-A441 PolarHBondContact O-N 3.11Å
438	A	56.3	Low	55.6	Low	84 Å²	84	98.5 Å²	98.5	69%	0.694	65%	0.646	S	S	*	*	H	α-helix	trans	-56.6	-29.6	-173.8	0	0	0	0	0	114	V436 A440 A441 A442	V436-A438 PolarHBondContact O-N 3.41Å; A438-A440 VanDerWaalsContact C-N 3.35Å; A438-A440 PolarHBondContact O-N 3.48Å; A438-A441 PolarHBondContact O-N 2.73Å; A438-A442 WeakPolarHBondContact O-CB 3.37Å; A438-A442 PolarHBondContact O-N 2.93Å
439	A	57.7	Low	56.8	Low	67 Å²	67	98.4 Å²	98.4	55%	0.554	64%	0.637	S	S	*	*	H	α-helix	trans	-63.2	-35.9	174	0	0	0	0	0	113.3	N437 A442 M443	N437-A439 PolarHBondContact O-N 3.49Å; A439-A442 PolarHBondContact O-N 3.21Å; A439-M443 PolarHBondContact O-N 3.26Å
440	A	61.7	Low	57.9	Low	51 Å²	51	97.9 Å²	97.9	42%	0.421	63%	0.625	S	S	.	*	H	α-helix	trans	-70.5	-40.5	176	0	0	0	0	0	111.2	V436 N437 A438 A442 M443 A444	V436-A440 HydrophobicContact CG1-CB 4.18Å; N437-A440 WeakPolarHBondContact O-CB 3.35Å; N437-A440 PolarHBondContact O-N 2.93Å; A438-A440 VanDerWaalsContact C-N 3.35Å; A438-A440 PolarHBondContact O-N 3.48Å; A440-A442 VanDerWaalsContact C-N 3.34Å; A440-A442 PolarHBondContact O-N 3.23Å; A440-M443 PolarHBondContact O-N 2.88Å; A440-A444 WeakPolarHBondContact O-CB 3.44Å; A440-A444 PolarHBondContact O-N 2.81Å
441	A	63.5	Low	58.4	Low	55 Å²	55	94 Å²	94	46%	0.455	61%	0.608	S	S	.	*	H	α-helix	trans	-62.5	-39.7	173.3	0	0	0	0	0	112.1	N437 A438 A444 A445	N437-A441 PolarHBondContact O-N 3.11Å; A438-A441 PolarHBondContact O-N 2.73Å; A441-A444 PolarHBondContact O-N 2.78Å; A441-A445 PolarHBondContact O-N 2.77Å
442	A	65.7	Low	59.1	Low	63 Å²	63	95.1 Å²	95.1	52%	0.521	61%	0.608	S	S	.	*	H	α-helix	trans	-64.3	-43.9	175.5	0	0	0	0	0	112.6	A438 A439 A440 A445 A446	A438-A442 WeakPolarHBondContact O-CB 3.37Å; A438-A442 PolarHBondContact O-N 2.93Å; A439-A442 PolarHBondContact O-N 3.21Å; A440-A442 VanDerWaalsContact C-N 3.34Å; A440-A442 PolarHBondContact O-N 3.23Å; A442-A445 PolarHBondContact O-N 3.16Å; A442-A446 PolarHBondContact O-N 3.14Å
443	M	68.9	Low	59.4	Low	135 Å²	135	98.5 Å²	98.5	67%	0.665	61%	0.609	S	S	*	*	H	α-helix	trans	-66	-39	175.3	-80.5	-171.9	-82	0	0	112.7	A439 A440 A445 A446 A447	A439-M443 PolarHBondContact O-N 3.26Å; A440-M443 PolarHBondContact O-N 2.88Å; M443-A445 PolarHBondContact O-N 2.78Å; M443-A446 PolarHBondContact O-N 2.55Å; M443-A447 PolarHBondContact O-N 3.24Å
444	A	67.7	Low	60.1	Low	62 Å²	62	96 Å²	96	51%	0.512	61%	0.605	S	S	.	*	H	α-helix	trans	-61.7	-42.2	174.8	0	0	0	0	0	112.2	A440 A441 A447 A448	A440-A444 WeakPolarHBondContact O-CB 3.44Å; A440-A444 PolarHBondContact O-N 2.81Å; A441-A444 PolarHBondContact O-N 2.78Å; A444-A447 PolarHBondContact O-N 3.37Å; A444-A448 WeakPolarHBondContact O-CB 3.24Å; A444-A448 PolarHBondContact O-N 3.21Å
445	A	64.4	Low	60.3	Low	50 Å²	50	93.9 Å²	93.9	41%	0.413	60%	0.603	S	S	.	*	H	α-helix	trans	-64.9	-38.1	175.6	0	0	0	0	0	112.8	A441 A442 M443 M449	A441-A445 PolarHBondContact O-N 2.77Å; A442-A445 PolarHBondContact O-N 3.16Å; M443-A445 PolarHBondContact O-N 2.78Å; A445-M449 PolarHBondContact O-N 2.93Å; A445-M449 VanDerWaalsContact O-N 3.15Å
446	A	64.7	Low	60	Low	61 Å²	61	88.4 Å²	88.4	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-43.9	175.1	0	0	0	0	0	112.1	A442 M443 M449 A450	A442-A446 PolarHBondContact O-N 3.14Å; M443-A446 PolarHBondContact O-N 2.55Å; A446-M449 PolarHBondContact O-N 3.31Å; A446-A450 PolarHBondContact O-N 3.37Å; A446-A450 VanDerWaalsContact O-N 3.13Å
447	A	66.6	Low	59.5	Low	64 Å²	64	89.7 Å²	89.7	53%	0.529	61%	0.607	S	S	.	*	H	α-helix	trans	-62.3	-42.8	176.1	0	0	0	0	0	112.2	M443 A444 M449 A450 A451	M443-A447 PolarHBondContact O-N 3.24Å; A444-A447 PolarHBondContact O-N 3.37Å; A447-M449 PolarHBondContact O-N 2.77Å; A447-A450 PolarHBondContact O-N 2.97Å; A447-A451 PolarHBondContact O-N 2.88Å
448	A	65.8	Low	58.7	Low	58 Å²	58	92.6 Å²	92.6	48%	0.479	62%	0.617	S	S	.	*	H	α-helix	trans	-61.7	-40.6	177.1	0	0	0	0	0	112.8	A444 A451	A444-A448 WeakPolarHBondContact O-CB 3.24Å; A444-A448 PolarHBondContact O-N 3.21Å; A448-A451 PolarHBondContact O-N 3.12Å
449	M	64.1	Low	57.8	Low	145 Å²	145	92.7 Å²	92.7	71%	0.714	61%	0.613	S	S	*	*	H	α-helix	trans	-74	-23	177.5	-74.3	-164.3	-77.8	0	0	113.9	A445 A446 A447	A445-M449 PolarHBondContact O-N 2.93Å; A445-M449 VanDerWaalsContact O-N 3.15Å; A446-M449 PolarHBondContact O-N 3.31Å; A447-M449 PolarHBondContact O-N 2.77Å
450	A	60.2	Low	56.9	Low	68 Å²	68	97.7 Å²	97.7	56%	0.562	63%	0.628	S	S	*	*	H	α-helix	trans	-69.4	-38.9	172.2	0	0	0	0	0	112.2	A446 A447 I452 K453	A446-A450 PolarHBondContact O-N 3.37Å; A446-A450 VanDerWaalsContact O-N 3.13Å; A447-A450 PolarHBondContact O-N 2.97Å; A450-I452 VanDerWaalsContact C-N 3.29Å; A450-I452 PolarHBondContact O-N 3.31Å; A450-K453 PolarHBondContact O-N 2.88Å
451	A	57.8	Low	55.6	Low	65 Å²	65	97.9 Å²	97.9	54%	0.537	64%	0.636	S	S	.	*	H	α-helix	trans	-65.5	-26.1	-175.8	0	0	0	0	0	114.5	A447 A448 K453 S454	A447-A451 PolarHBondContact O-N 2.88Å; A448-A451 PolarHBondContact O-N 3.12Å; A451-K453 VanDerWaalsContact C-N 3.27Å; A451-K453 PolarHBondContact O-N 3.25Å; A451-S454 PolarHBondContact O-OG 3Å
452	I	54.8	Low	54.3	Low	144 Å²	144	100 Å²	100	74%	0.738	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-9.1	-176.3	-64.2	174.2	0	0	0	112.3	A450	A450-I452 VanDerWaalsContact C-N 3.29Å; A450-I452 PolarHBondContact O-N 3.31Å
453	K	56.5	Low	53	Low	197 Å²	197	106.3 Å²	106.3	86%	0.857	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	7.9	-171.4	-151	172.5	180	179.5	0	115.4	A450 A451	A450-K453 PolarHBondContact O-N 2.88Å; A451-K453 VanDerWaalsContact C-N 3.27Å; A451-K453 PolarHBondContact O-N 3.25Å
454	S	54.7	Low	51.5	Low	101 Å²	101	104.4 Å²	104.4	71%	0.706	68%	0.675	S	S	*	*	S	Bend	trans	-111.3	-4.8	-170.3	55.7	0	0	0	0	116.5	A451	A451-S454 PolarHBondContact O-OG 3Å
455	S	51.9	Low	49.9	Very low	108 Å²	108	112.9 Å²	112.9	76%	0.755	69%	0.693	S	S	*	*			trans	-114	96.5	-177.7	43.8	0	0	0	0	113.4
456	G	43.4	Very low	48.6	Very low	74 Å²	74	116.6 Å²	116.6	76%	0.763	72%	0.716	S	S	*	*			trans	-90.3	149	170.6	0	0	0	0	0	113
457	P	41.2	Very low	47.2	Very low	119 Å²	119	117.3 Å²	117.3	77%	0.773	73%	0.73	S	S	*	*			trans	-98.5	140	-168.2	36.3	-35.1	0	0	0	115.9
458	Q	44.2	Very low	45.8	Very low	174 Å²	174	119 Å²	119	81%	0.813	74%	0.744	S	S	*	*			trans	-153.1	121.7	159.9	-68.2	-57.4	-21.5	0	0	105.5
459	S	37.4	Very low	44.6	Very low	85 Å²	85	121.9 Å²	121.9	59%	0.594	76%	0.76	S	S	*	*			cis	107.8	150.1	49.8	71.8	0	0	0	0	110.7
460	I	38.9	Very low	43.5	Very low	172 Å²	172	120.3 Å²	120.3	88%	0.882	76%	0.759	S	S	*	*			trans	72.2	142.3	-175.1	-45.6	163.5	0	0	0	113.9
461	G	36.1	Very low	42.7	Very low	56 Å²	56	125.3 Å²	125.3	58%	0.577	78%	0.776	S	S	*	*			cis	157	116.3	-14.4	0	0	0	0	0	115.9
462	A	36.2	Very low	41.9	Very low	99 Å²	99	128.5 Å²	128.5	82%	0.818	78%	0.784	S	S	*	*			trans	70.9	175.8	159.2	0	0	0	0	0	120.7
463	F	36.8	Very low	41.5	Very low	196 Å²	196	126.7 Å²	126.7	86%	0.86	78%	0.781	S	S	*	*			trans	77.7	107.8	-167.7	-52.7	-68.6	0	0	0	114.8
464	A	37.4	Very low	40.8	Very low	95 Å²	95	122.3 Å²	122.3	79%	0.785	77%	0.771	S	S	*	*			cis	73.9	144.2	46.8	0	0	0	0	0	113.8
465	R	35.3	Very low	40.3	Very low	239 Å²	239	124.4 Å²	124.4	90%	0.902	77%	0.773	S	S	*	*			cis	-178.4	149.1	-17.6	172.6	-176	-179.2	-165.1	1.8	106.5
466	S	35.6	Very low	39.5	Very low	128 Å²	128	125.5 Å²	125.5	90%	0.895	77%	0.77	S	S	*	*			trans	75.7	144.8	167.1	-160.4	0	0	0	0	117.9
467	G	37.2	Very low	39.3	Very low	76 Å²	76	127.1 Å²	127.1	78%	0.784	77%	0.77	S	S	*	*			trans	152.8	96.4	173.8	0	0	0	0	0	111.6
468	A	36.1	Very low	39	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	77%	0.774	S	S	*	*			trans	-144	124.8	-175.1	0	0	0	0	0	113
469	S	41.4	Very low	38.8	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	77%	0.773	S	S	*	*			trans	178.4	163.5	163.3	51.5	0	0	0	0	110.9
470	T	40	Very low	38.9	Very low	113 Å²	113	131.9 Å²	131.9	69%	0.693	78%	0.776	S	S	*	*			cis	-175.5	102.6	-33	-74.7	0	0	0	0	107.2
471	L	44.1	Very low	39.1	Very low	173 Å²	173	130.8 Å²	130.8	91%	0.906	77%	0.77	S	S	*	*			trans	-160.4	111.6	163.7	-69.6	-177.1	0	0	0	106
472	N	41.2	Very low	39.1	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	78%	0.782	S	S	*	*			cis	78.9	135.1	25.8	-139.2	32	0	0	0	113.5
473	P	46.1	Very low	39.2	Very low	105 Å²	105	137.4 Å²	137.4	68%	0.682	78%	0.779	S	S	*	*			cis	-113.2	163	-5.2	15.4	9.9	0	0	0	113.4
474	T	42.2	Very low	39.5	Very low	106 Å²	106	133.3 Å²	133.3	65%	0.65	77%	0.772	S	S	*	*				52.8	119.9	81.9	-23.2	0	0	0	0	112.8
475	I	43.6	Very low	39.5	Very low	145 Å²	145	135.6 Å²	135.6	74%	0.744	78%	0.776	S	S	*	*				-156.7	137.8	74.8	-87.1	168.5	0	0	0	113.1
476	N	35.6	Very low	39.6	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	77%	0.774	S	S	*	*			trans	19.4	147.8	145.7	-39	-23.6	0	0	0	120.5
477	S	38.5	Very low	40	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	77%	0.767	S	S	*	*			cis	-154.8	134.2	20.6	-35.3	0	0	0	0	110.1
478	R	35.2	Very low	39.9	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	77%	0.767	S	S	*	*				82	80.3	86.8	-158.6	-178	-164.4	-115.4	4.4	117.2
479	L	39.7	Very low	40.1	Very low	154 Å²	154	139.6 Å²	139.6	81%	0.806	76%	0.764	S	S	*	*				67.1	-178.5	128.6	-57.5	172.2	0	0	0	117.2
480	P	40.8	Very low	39.9	Very low	99 Å²	99	143.2 Å²	143.2	64%	0.643	77%	0.765	S	S	*	*				-143.5	-173.3	-93.7	44.8	-24.5	0	0	0	116.1
481	I	42.2	Very low	39.8	Very low	148 Å²	148	142 Å²	142	76%	0.759	76%	0.761	S	S	*	*			trans	72.2	140.6	153.6	-71.8	165.7	0	0	0	118.9
482	Q	36.8	Very low	39.5	Very low	178 Å²	178	139.9 Å²	139.9	83%	0.832	76%	0.755	S	S	*	*			trans	76.9	133.2	164.2	-86.6	169.5	9.3	0	0	121.1
483	P	38	Very low	39.4	Very low	117 Å²	117	142 Å²	142	76%	0.76	76%	0.759	S	S	*	*			trans	-109.9	-162.6	166.1	45.4	-35.9	0	0	0	110.6
484	P	43.1	Very low	39.4	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	76%	0.761	S	S	*	*			cis	-118.9	168.7	-31.3	37.2	-25.2	0	0	0	112.2
485	T	36.6	Very low	39	Very low	143 Å²	143	144.1 Å²	144.1	88%	0.877	77%	0.767	S	S	*	*			trans	-173.1	144.2	146.6	10.1	0	0	0	0	112.2
486	F	38.3	Very low	38.9	Very low	196 Å²	196	143.4 Å²	143.4	86%	0.86	77%	0.774	S	S	*	*			trans	-77.7	157.9	157.8	-74.9	-90	0	0	0	109.6
487	P	43.1	Very low	39	Very low	115 Å²	115	140.8 Å²	140.8	75%	0.747	78%	0.779	S	S	*	*				-140.6	166.5	100.2	39	-27.4	0	0	0	115.8
488	H	34.8	Very low	39	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.787	78%	0.781	S	S	*	*			trans	-55.2	165	166.7	-37.2	-94.2	0	0	0	113.5
489	I	40.6	Very low	39.2	Very low	148 Å²	148	133.1 Å²	133.1	76%	0.759	77%	0.771	S	S	*	*				-177.1	125.6	123.6	-95.6	153.2	0	0	0	111
490	F	37.4	Very low	39.1	Very low	193 Å²	193	134.9 Å²	134.9	85%	0.846	77%	0.773	S	S	*	*			trans	38.3	152.1	145.9	-65.1	-108.2	0	0	0	121.5
491	S	37.1	Very low	39.1	Very low	87 Å²	87	135.5 Å²	135.5	61%	0.608	78%	0.78	S	S	*	*			cis	-164.9	169.1	-13.3	54.7	0	0	0	0	108.1
492	T	38.4	Very low	38.6	Very low	128 Å²	128	139.8 Å²	139.8	79%	0.785	79%	0.786	S	S	*	*				-176.5	152.4	81.6	-60.5	0	0	0	0	111.5
493	F	39.6	Very low	38.7	Very low	178 Å²	178	139.5 Å²	139.5	78%	0.781	79%	0.789	S	S	*	*			trans	-80.6	-177.4	-176.9	-81.8	-86.2	0	0	0	112.8
494	P	44.9	Very low	38.6	Very low	112 Å²	112	140.8 Å²	140.8	73%	0.727	79%	0.79	S	S	*	*			cis	-149.9	162.2	24.3	43.7	-22.2	0	0	0	122.5
495	N	34.9	Very low	38.3	Very low	143 Å²	143	141.2 Å²	141.2	77%	0.765	79%	0.79	S	S	*	*			trans	33.1	120.4	140.6	-60.6	-5.5	0	0	0	123.2
496	S	41.7	Very low	38.2	Very low	129 Å²	129	139 Å²	139	90%	0.902	78%	0.781	S	S	*	*				-166.1	160.4	105.3	54.1	0	0	0	0	110.1
497	G	37	Very low	38.1	Very low	77 Å²	77	134.9 Å²	134.9	79%	0.794	78%	0.776	S	S	*	*			cis	174.9	41.2	-3.6	0	0	0	0	0	116.9
498	G	37.9	Very low	38	Very low	78 Å²	78	134.9 Å²	134.9	80%	0.804	78%	0.779	S	S	*	*			trans	82.6	177.6	173.6	0	0	0	0	0	116.3
499	S	40.2	Very low	38.4	Very low	93 Å²	93	131.8 Å²	131.8	65%	0.65	78%	0.777	S	S	*	*			cis	-173.1	153.6	-14	55.1	0	0	0	0	113.9
500	F	37.2	Very low	38.3	Very low	192 Å²	192	132.4 Å²	132.4	84%	0.842	78%	0.781	S	S	*	*			trans	78.2	151.1	153.9	-58.3	-55.4	0	0	0	123.3
501	S	40.2	Very low	38.6	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	78%	0.776	S	S	*	*			trans	65.9	124.8	165.2	-59.2	0	0	0	0	118.2
502	R	33.2	Very low	38.9	Very low	239 Å²	239	129 Å²	129	90%	0.902	78%	0.782	S	S	*	*			cis	79.7	153.1	42.9	-72.9	-165	168.5	-163.2	-1.5	114.9
503	L	39.1	Very low	38.9	Very low	171 Å²	171	129.9 Å²	129.9	90%	0.895	78%	0.781	S	S	*	*			trans	79.4	123.3	-165.2	-50.3	176	0	0	0	112.2
504	N	34.1	Very low	38.8	Very low	144 Å²	144	128.7 Å²	128.7	77%	0.77	78%	0.782	S	S	*	*			cis	98.5	112.2	8.5	-157.9	62.5	0	0	0	117.3
505	V	36.9	Very low	38.9	Very low	118 Å²	118	128.8 Å²	128.8	72%	0.715	78%	0.783	S	S	*	*			trans	82.1	145	152.8	161.1	0	0	0	0	121.2
506	S	36	Very low	38.9	Very low	97 Å²	97	129.5 Å²	129.5	68%	0.678	79%	0.786	S	S	*	*			trans	72.9	96	157.7	57.1	0	0	0	0	123.3
507	S	36.2	Very low	38.8	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	78%	0.781	S	S	*	*				54.6	127.4	115.3	66.9	0	0	0	0	124
508	S	40.5	Very low	38.8	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	78%	0.782	S	S	*	*			trans	164.4	157.1	133	43.9	0	0	0	0	110
509	S	43.6	Very low	38.7	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	78%	0.781	S	S	*	*			cis	-163.9	156.5	-23.8	-90.6	0	0	0	0	109.1
510	N	39.1	Very low	38.5	Very low	160 Å²	160	144.3 Å²	144.3	86%	0.856	79%	0.793	S	S	*	*			trans	151.1	90.4	161.5	-80.6	-18	0	0	0	107.6
511	A	42.9	Very low	38.3	Very low	90 Å²	90	143.4 Å²	143.4	74%	0.744	79%	0.791	S	S	*	*				66.4	128.1	70.6	0	0	0	0	0	112.2
512	T	42.7	Very low	38	Very low	120 Å²	120	144.2 Å²	144.2	74%	0.736	79%	0.786	S	S	*	*			cis	-156.1	129.2	31.5	-61.6	0	0	0	0	113.5
513	L	38.4	Very low	37.9	Very low	146 Å²	146	142.8 Å²	142.8	76%	0.764	78%	0.781	S	S	*	*			trans	43.8	134.8	150.8	-49.3	176.2	0	0	0	121.5
514	L	38.6	Very low	37.6	Very low	152 Å²	152	142.1 Å²	142.1	80%	0.796	78%	0.777	S	S	*	*			cis	84.8	151.4	36.7	-66.8	177	0	0	0	115.6
515	P	46.2	Very low	37.8	Very low	114 Å²	114	140.2 Å²	140.2	74%	0.74	78%	0.775	S	S	*	*			cis	-144.3	173.8	-28.9	39.4	-20.5	0	0	0	118.3
516	L	35	Very low	37.7	Very low	159 Å²	159	138.2 Å²	138.2	83%	0.832	78%	0.778	S	S	*	*			trans	-29.3	147.1	157.4	177.9	70.6	0	0	0	120.1
517	L	38.9	Very low	37.7	Very low	152 Å²	152	139.3 Å²	139.3	80%	0.796	79%	0.785	S	S	*	*			trans	-160.4	-167.7	146.7	-101.1	175.6	0	0	0	109.8
518	Q	38.3	Very low	37.6	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	79%	0.787	S	S	*	*				-139.7	171.6	-106.3	-170.8	165.6	-91.9	0	0	113.5
519	Q	34.6	Very low	37.5	Very low	169 Å²	169	136.7 Å²	136.7	79%	0.79	78%	0.778	S	S	*	*			trans	-78.2	157	-179.2	-56.2	167	-41.4	0	0	114.9
520	Q	37.4	Very low	37.2	Very low	193 Å²	193	139 Å²	139	90%	0.902	78%	0.782	S	S	*	*				-179.2	174.9	116.4	-97.7	173.8	11.4	0	0	113.7
521	Q	32.8	Very low	36.9	Very low	172 Å²	172	136.2 Å²	136.2	80%	0.804	78%	0.781	S	S	*	*			trans	-108.6	161.7	-173	-60.7	174	-2.5	0	0	112.8
522	L	34.6	Very low	36.6	Very low	128 Å²	128	136.7 Å²	136.7	67%	0.67	79%	0.785	S	S	*	*				152	122.6	118.9	-78.8	173	0	0	0	116.4
523	R	29.4	Very low	36.2	Very low	210 Å²	210	136.2 Å²	136.2	79%	0.792	79%	0.793	S	S	*	*			trans	66.3	156	133.1	-72.3	-179.1	176.7	163.9	-0.4	124.4
524	I	34.6	Very low	36.1	Very low	156 Å²	156	133 Å²	133	80%	0.8	80%	0.795	S	S	*	*			trans	73.5	134.1	155.9	-70.5	149.1	0	0	0	115.6
525	S	37.3	Very low	36.1	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	80%	0.796	S	S	*	*			cis	-162.8	153.4	-12.1	48.8	0	0	0	0	109.1
526	G	34.2	Very low	35.9	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	80%	0.8	S	S	*	*				78.3	148.3	99.7	0	0	0	0	0	115.2
527	S	37	Very low	36	Very low	119 Å²	119	131.2 Å²	131.2	83%	0.832	80%	0.798	S	S	*	*			cis	-170.9	153.2	-3	-169.1	0	0	0	0	112.2
528	A	34.6	Very low	36.1	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	79%	0.787	S	S	*	*			trans	64.9	166.5	156.6	0	0	0	0	0	119.1
529	A	37.4	Very low	36.2	Very low	75 Å²	75	127.9 Å²	127.9	62%	0.62	79%	0.788	S	S	*	*			cis	-155	158.4	7.5	0	0	0	0	0	114.4
530	N	36.9	Very low	36.3	Very low	154 Å²	154	123.7 Å²	123.7	82%	0.824	78%	0.782	S	S	*	*			trans	60.6	128.2	154.2	-50.8	-20.4	0	0	0	119.1
531	A	34.3	Very low	36.4	Very low	100 Å²	100	122 Å²	122	83%	0.826	78%	0.778	S	S	*	*			cis	87.8	121.1	23.4	0	0	0	0	0	117.1
532	A	36.1	Very low	36.5	Very low	101 Å²	101	122 Å²	122	84%	0.835	78%	0.777	S	S	*	*			trans	167.2	142.6	131.5	0	0	0	0	0	114.6
533	A	34.6	Very low	36.8	Very low	110 Å²	110	125.2 Å²	125.2	91%	0.909	79%	0.789	S	S	*	*			trans	61	149.6	161.6	0	0	0	0	0	119.4
534	G	36	Very low	37.1	Very low	78 Å²	78	119 Å²	119	80%	0.804	78%	0.783	S	S	*	*			cis	-167.5	160.8	-3.6	0	0	0	0	0	112.1
535	A	38.5	Very low	37.1	Very low	99 Å²	99	122.6 Å²	122.6	82%	0.818	79%	0.786	S	S	*	*			trans	-100.9	-157.5	-173.1	0	0	0	0	0	113.4
536	V	41.4	Very low	37	Very low	136 Å²	136	122.5 Å²	122.5	82%	0.824	79%	0.785	S	S	*	*			trans	97.4	132.7	-178.1	179.2	0	0	0	0	112.4
537	L	37.6	Very low	37.2	Very low	152 Å²	152	126.7 Å²	126.7	80%	0.796	79%	0.789	S	S	*	*			cis	-142.4	145.2	12.6	-166	58.3	0	0	0	113.1
538	S	40.8	Very low	37.3	Very low	79 Å²	79	125.8 Å²	125.8	55%	0.552	78%	0.783	S	S	*	*				1.1	161.6	129.2	-103.9	0	0	0	0	119.7
539	Q	40	Very low	37.3	Very low	178 Å²	178	129.3 Å²	129.3	83%	0.832	79%	0.788	S	S	*	*			cis	-171.1	171.6	3.4	-127.5	159.9	-31.5	0	0	106.3
540	A	38	Very low	37.7	Very low	81 Å²	81	130.3 Å²	130.3	67%	0.669	79%	0.788	S	S	*	*			cis	-144	-141.8	4.1	0	0	0	0	0	107
541	I	39.1	Very low	37.4	Very low	158 Å²	158	129.8 Å²	129.8	81%	0.81	79%	0.786	S	S	*	*			cis	-154.2	163	-1.8	-155.6	165.4	0	0	0	109.8
542	Q	34.7	Very low	37.4	Very low	171 Å²	171	132.5 Å²	132.5	80%	0.799	78%	0.783	S	S	*	*			trans	-150.3	141.1	173.1	-65.1	176	-17.6	0	0	110.3
543	Q	39.7	Very low	37.5	Very low	196 Å²	196	135.4 Å²	135.4	92%	0.916	78%	0.783	S	S	*	*			trans	168.8	148.2	156.7	-97.4	152.7	83.8	0	0	109.9
544	A	37.5	Very low	37.5	Very low	80 Å²	80	135 Å²	135	66%	0.661	77%	0.773	S	S	*	*			cis	-157.5	143.6	-9.2	0	0	0	0	0	113.8
545	R	33.5	Very low	37.6	Very low	231 Å²	231	142.5 Å²	142.5	87%	0.872	78%	0.778	S	S	*	*			trans	40.9	113.3	130.4	-61.3	178.8	173.1	154	-2.3	122.5
546	S	34.8	Very low	37.6	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	77%	0.774	S	S	*	*				65.7	165.4	123.9	71.5	0	0	0	0	122.5
547	L	39.7	Very low	37.5	Very low	165 Å²	165	140.1 Å²	140.1	86%	0.864	77%	0.774	S	S	*	*			trans	77.2	150.3	177.6	-50.2	173.6	0	0	0	115.3
548	S	38.4	Very low	37.7	Very low	100 Å²	100	141.6 Å²	141.6	70%	0.699	78%	0.778	S	S	*	*			cis	-171.5	127.5	-28.7	53	0	0	0	0	111.4
549	N	33.6	Very low	38	Very low	169 Å²	169	143 Å²	143	90%	0.904	79%	0.786	S	S	*	*			trans	32.2	163.9	149.9	-91.2	1.9	0	0	0	124.5
550	P	46	Very low	38.2	Very low	97 Å²	97	140.8 Å²	140.8	63%	0.63	78%	0.784	S	S	*	*			trans	-107	161.7	-156.5	40.6	-36.8	0	0	0	116.6
551	N	32.2	Very low	38.3	Very low	143 Å²	143	143.9 Å²	143.9	77%	0.765	79%	0.789	S	S	*	*				173	154.7	124.1	-103.4	-47.5	0	0	0	115.5
552	M	33.4	Very low	38.8	Very low	157 Å²	157	141.4 Å²	141.4	77%	0.773	78%	0.784	S	S	*	*			trans	30.8	135.8	143.5	-61	-87.3	95.8	0	0	121.8
553	I	37.3	Very low	39	Very low	161 Å²	161	137.8 Å²	137.8	83%	0.826	78%	0.783	S	S	*	*				-177.6	141.5	111.2	-93.5	157.1	0	0	0	113.3
554	S	35.4	Very low	39.1	Very low	102 Å²	102	133 Å²	133	71%	0.713	77%	0.771	S	S	*	*			trans	-15.9	149.1	163.3	-44	0	0	0	0	119.3
555	R	38.2	Very low	39.3	Very low	236 Å²	236	136.3 Å²	136.3	89%	0.891	78%	0.778	S	S	*	*				-171.3	174.1	63.3	-90.4	-169.4	177.2	-170.9	-1.5	111.5
556	S	37.7	Very low	39.6	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	77%	0.773	S	S	*	*			cis	176.6	130.9	-40.6	58.1	0	0	0	0	110.2
557	G	40.8	Very low	40.1	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	78%	0.778	S	S	*	*			trans	-167.6	135	174.3	0	0	0	0	0	114.2
558	M	40.9	Very low	40.5	Very low	182 Å²	182	129.5 Å²	129.5	90%	0.897	77%	0.77	S	S	*	*			trans	-144.6	174.6	-174.1	-92.1	-80.7	173.9	0	0	107.9
559	P	47.6	Very low	40.7	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	78%	0.776	S	S	*	*			cis	-107.4	-146.2	12.5	10.1	16.8	0	0	0	112.8
560	V	44	Very low	40.9	Very low	131 Å²	131	131.8 Å²	131.8	79%	0.794	77%	0.771	S	S	*	*			cis	-148.5	-152.1	17.6	-146.8	0	0	0	0	113.4
561	N	39.7	Very low	40.7	Very low	147 Å²	147	132.4 Å²	132.4	79%	0.786	78%	0.777	S	S	*	*			trans	-170.8	-177.9	-158.8	-116.5	-18.7	0	0	0	108.9
562	P	50.3	Low	41.1	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	78%	0.777	S	S	*	*			cis	-140.4	-153.2	-35	39.4	-18.8	0	0	0	113
563	A	39.2	Very low	41.5	Very low	95 Å²	95	132.3 Å²	132.3	79%	0.785	78%	0.779	S	S	*	*			trans	86.9	146.9	153.7	0	0	0	0	0	118.4
564	S	41.5	Very low	41.7	Very low	95 Å²	95	132.1 Å²	132.1	66%	0.664	78%	0.775	S	S	*	*			cis	-159.7	165.9	-5.2	58.4	0	0	0	0	113.1
565	N	40.4	Very low	41.9	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	78%	0.781	S	S	*	*			trans	63.2	157.5	150.8	-61.8	-16.2	0	0	0	119.9
566	S	40.6	Very low	42.1	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	77%	0.765	S	S	*	*			cis	-162.8	169.6	-23.1	49.6	0	0	0	0	110.9
567	V	45.4	Very low	42.3	Very low	134 Å²	134	136.5 Å²	136.5	81%	0.812	77%	0.772	S	S	*	*			trans	-105.4	-166.2	-178.6	-122.7	0	0	0	0	110.8
568	P	48.9	Very low	42.3	Very low	110 Å²	110	137.9 Å²	137.9	71%	0.714	77%	0.769	S	S	*	*			cis	-132.4	-165.9	-34.8	29.5	-6.8	0	0	0	113.5
569	V	41.3	Very low	42.3	Very low	135 Å²	135	141 Å²	141	82%	0.818	77%	0.77	S	S	*	*			trans	146.2	146.2	131.1	172.4	0	0	0	0	117.3
570	K	38.4	Very low	41.9	Very low	183 Å²	183	141.3 Å²	141.3	80%	0.796	78%	0.775	S	S	*	*			trans	-73.3	159.8	-169.1	-45.9	156.8	178	175.5	0	118.9
571	S	42.6	Very low	41.8	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	77%	0.774	S	S	*	*				-170.3	131.8	126.6	40.4	0	0	0	0	109.6
572	H	40.1	Very low	42	Very low	165 Å²	165	137.4 Å²	137.4	76%	0.764	77%	0.771	S	S	*	*				52.3	130.8	78.5	-72.8	-87.5	0	0	0	114.5
573	T	42	Very low	41.5	Very low	133 Å²	133	138.8 Å²	138.8	82%	0.816	77%	0.773	S	S	*	*				-159.3	176.1	67.1	-57.4	0	0	0	0	113.2
574	E	40.9	Very low	41.6	Very low	158 Å²	158	138.7 Å²	138.7	74%	0.738	77%	0.766	S	S	*	*			trans	-99.4	177.9	-165.2	-14.7	160.2	104.2	0	0	116.9
575	R	39.4	Very low	41.7	Very low	223 Å²	223	140.5 Å²	140.5	84%	0.842	77%	0.773	S	S	*	*			trans	128.5	149.3	141.7	-72.9	-168.9	170.7	-172.1	-2.7	114.9
576	S	41.7	Very low	41.6	Very low	78 Å²	78	137.7 Å²	137.7	55%	0.545	77%	0.771	S	S	.	*			cis	-172.4	139.4	-19.8	-104.6	0	0	0	0	112.9
577	R	42.4	Very low	41.6	Very low	234 Å²	234	143.8 Å²	143.8	88%	0.883	78%	0.779	S	S	*	*			trans	58.7	162.1	142.9	-56.3	172.3	179.5	172.2	-0.8	118.1
578	S	40.5	Very low	41.3	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	77%	0.77	S	S	*	*			cis	-158.2	142.3	0.4	6.7	0	0	0	0	107.8
579	R	41	Very low	41	Very low	247 Å²	247	146.4 Å²	146.4	93%	0.932	78%	0.775	S	S	*	*				84.1	99	62.2	-96.3	-166.6	171.5	-159.5	-1.6	117.6
580	S	40.8	Very low	41	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	77%	0.772	S	S	*	*			trans	172.8	136.6	144.3	51.2	0	0	0	0	108.3
581	A	41.6	Very low	41.1	Very low	94 Å²	94	146.7 Å²	146.7	78%	0.777	78%	0.776	S	S	*	*			cis	70.8	133.9	41.7	0	0	0	0	0	114.3
582	S	43.2	Very low	40.8	Very low	102 Å²	102	150 Å²	150	71%	0.713	78%	0.779	S	S	*	*			cis	-163.4	-162.9	-24.2	53.1	0	0	0	0	107.8
583	D	39	Very low	41	Very low	136 Å²	136	153.3 Å²	153.3	73%	0.727	79%	0.785	S	S	*	*			cis	-167.5	173.5	10.4	-136.8	-54.2	0	0	0	113.7
584	S	43.2	Very low	40.9	Very low	92 Å²	92	154.5 Å²	154.5	64%	0.643	79%	0.787	S	S	*	*			trans	76.3	156.8	150.1	80.6	0	0	0	0	124.3
585	T	42.6	Very low	41.2	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	78%	0.781	S	S	*	*			trans	68.1	124.3	172.5	67.8	0	0	0	0	117.6
586	A	39.2	Very low	41.2	Very low	92 Å²	92	152.3 Å²	152.3	76%	0.76	78%	0.784	S	S	*	*			cis	109.6	106.9	7.6	0	0	0	0	0	115.8
587	Y	40.9	Very low	41.2	Very low	237 Å²	237	157.7 Å²	157.7	93%	0.929	80%	0.8	S	S	*	*			trans	-154.8	159.6	145.5	-121.9	-83.3	0	0	0	110.1
588	S	38.8	Very low	41.1	Very low	90 Å²	90	157.7 Å²	157.7	63%	0.629	80%	0.8	S	S	*	*			trans	-131.7	-169	-160.6	62.6	0	0	0	0	114.9
589	Y	41.7	Very low	41.1	Very low	210 Å²	210	163.3 Å²	163.3	82%	0.824	81%	0.805	S	S	*	*			trans	89.6	101.2	-176.4	-64.4	-84	0	0	0	115.1
590	A	42	Very low	41.3	Very low	90 Å²	90	157.7 Å²	157.7	74%	0.744	80%	0.798	S	S	*	*				95.3	147.6	69.9	0	0	0	0	0	111.6
591	R	39.7	Very low	41.2	Very low	234 Å²	234	159.9 Å²	159.9	88%	0.883	80%	0.801	S	S	*	*			cis	-149.8	147.6	13	-159.1	178.8	-165.1	165.6	5	111
592	E	36.3	Very low	41.4	Very low	177 Å²	177	159.3 Å²	159.3	83%	0.827	80%	0.804	S	S	*	*			trans	-76.5	164	176.8	-52.7	156.8	103.2	0	0	113.5
593	R	44.6	Very low	41.1	Very low	235 Å²	235	163.6 Å²	163.6	89%	0.887	81%	0.806	S	S	*	*			trans	-172.4	106.5	136.1	-107.1	167.8	-172.5	-164.1	1.5	113.6
594	N	40.3	Very low	41.4	Very low	159 Å²	159	164.3 Å²	164.3	85%	0.85	82%	0.815	S	S	*	*			trans	-162.7	115.1	151.8	-166.2	0.7	0	0	0	111.5
595	P	45.8	Very low	41.2	Very low	97 Å²	97	166.3 Å²	166.3	63%	0.63	81%	0.812	S	S	*	*			trans	-140.2	159.2	175.1	40.4	-25.1	0	0	0	117.2
596	R	39.6	Very low	41.2	Very low	238 Å²	238	168.9 Å²	168.9	90%	0.898	82%	0.815	S	S	*	*			trans	90.6	112.6	167.5	-55.9	164.9	-177.6	169.9	-0.8	114.6
597	H	42.8	Very low	41.1	Very low	191 Å²	191	172.5 Å²	172.5	88%	0.884	82%	0.816	S	S	*	*			cis	72.2	107.1	40.8	-87.2	-59.3	0	0	0	117.9
598	R	40.1	Very low	40.7	Very low	234 Å²	234	166.7 Å²	166.7	88%	0.883	81%	0.81	S	S	*	*			trans	-151.6	133.2	134.2	-96.5	173.2	167.7	158.7	-5.1	105.5
599	R	40.2	Very low	40.7	Very low	225 Å²	225	168 Å²	168	85%	0.849	82%	0.817	S	S	*	*				64.7	132.6	59.6	-77.3	-173.9	173.2	163.9	-1.5	111.9
600	T	44.8	Very low	40.4	Very low	130 Å²	130	168.8 Å²	168.8	80%	0.798	82%	0.818	S	S	*	*			cis	-139.5	168	18.2	45.9	0	0	0	0	114.4
601	D	38.1	Very low	40	Very low	162 Å²	162	173.3 Å²	173.3	87%	0.866	82%	0.821	S	S	*	*			trans	-74.5	167.3	175	-44.9	-97.1	0	0	0	114.7
602	G	45.8	Very low	39.7	Very low	82 Å²	82	170.2 Å²	170.2	85%	0.845	82%	0.817	S	S	*	*			trans	-151.6	136.5	167.3	0	0	0	0	0	110.5
603	Y	38	Very low	39.6	Very low	192 Å²	192	167 Å²	167	75%	0.753	81%	0.81	S	S	*	*			trans	-134.3	123	-162.5	-177.6	-84.9	0	0	0	111.5	K605	Y603-K605 HydrophobicContact CD1-CB 4.46Å; Y603-K605 HydrophobicContact CE1-CB 3.83Å; Y603-K605 HydrophobicContact CE1-CD 4.13Å; Y603-K605 HydrophobicContact CE1-CG 4.44Å
604	V	46.1	Very low	39.4	Very low	150 Å²	150	162.6 Å²	162.6	91%	0.909	80%	0.802	S	S	*	*			trans	-135.9	145.1	171	-179	0	0	0	0	108.5
605	K	38.1	Very low	38.9	Very low	134 Å²	134	167 Å²	167	58%	0.583	81%	0.807	S	S	*	*			trans	-153.4	110.1	-161	174.4	-150.4	173.3	-161.1	0	111.4	Y603	Y603-K605 HydrophobicContact CD1-CB 4.46Å; Y603-K605 HydrophobicContact CE1-CB 3.83Å; Y603-K605 HydrophobicContact CE1-CD 4.13Å; Y603-K605 HydrophobicContact CE1-CG 4.44Å
606	E	41.6	Very low	38.5	Very low	187 Å²	187	173 Å²	173	87%	0.874	82%	0.817	S	S	*	*			trans	-131	113.1	156.1	-68.6	-173.9	143.5	0	0	105.6
607	E	37.7	Very low	38.1	Very low	168 Å²	168	171.1 Å²	171.1	79%	0.785	82%	0.815	S	S	*	*				80.4	136.3	73.3	-68.2	-148.4	173.3	0	0	113.9
608	S	32.8	Very low	37.8	Very low	115 Å²	115	167.6 Å²	167.6	80%	0.804	81%	0.812	S	S	*	*			trans	-164.2	138.8	-162.1	174	0	0	0	0	111.2
609	P	38.1	Very low	37.6	Very low	119 Å²	119	164.8 Å²	164.8	77%	0.773	81%	0.808	S	S	*	*			trans	-113.4	119.8	164.1	33.6	-22.2	0	0	0	113
610	R	36	Very low	37.5	Very low	226 Å²	226	158.8 Å²	158.8	85%	0.853	80%	0.801	S	S	*	*			trans	27.2	110.4	133.7	-72.7	-178.5	-178.3	177.7	1.3	117.8
611	F	33.5	Very low	37.3	Very low	185 Å²	185	158.8 Å²	158.8	81%	0.811	80%	0.803	S	S	*	*				85.8	107.7	88	-113.2	-87.4	0	0	0	113.4	T613	F611-T613 HydrophobicContact CD1-CG2 4.46Å; F611-T613 HydrophobicContact CE1-CG2 4.35Å
612	E	33.4	Very low	37.3	Very low	169 Å²	169	161.4 Å²	161.4	79%	0.79	80%	0.801	S	S	*	*			trans	-150.3	136.3	147	-165.3	53.9	-90.2	0	0	109.1
613	T	35	Very low	37.1	Very low	110 Å²	110	164.4 Å²	164.4	68%	0.675	80%	0.797	S	S	*	*			trans	-96.9	111.2	-167.3	46.5	0	0	0	0	113.9	F611	F611-T613 HydrophobicContact CD1-CG2 4.46Å; F611-T613 HydrophobicContact CE1-CG2 4.35Å
614	I	39	Very low	37.2	Very low	142 Å²	142	158.1 Å²	158.1	73%	0.728	79%	0.79	S	S	*	*			trans	-115.2	110.5	168.5	-60.6	-176.8	0	0	0	111.3	R616	I614-R616 HydrophobicContact CG2-CG 4.25Å; I614-R616 PolarHBondContact O-N 2.81Å
615	R	30	Very low	37.2	Very low	252 Å²	252	155.4 Å²	155.4	95%	0.951	77%	0.774	S	S	*	*			trans	-79.9	92.7	-178.7	-175.2	-172.9	-167.6	-180	4.5	111.2
616	R	36.9	Very low	37.6	Very low	222 Å²	222	154.7 Å²	154.7	84%	0.838	78%	0.775	S	S	*	*			trans	-106.5	130.4	169.1	-73.4	-175.4	178	-171	-0.3	111.5	I614	I614-R616 HydrophobicContact CG2-CG 4.25Å; I614-R616 PolarHBondContact O-N 2.81Å
617	K	31.4	Very low	37.9	Very low	199 Å²	199	152.9 Å²	152.9	87%	0.865	77%	0.767	S	S	*	*			trans	-74.3	130.3	170.2	-63.9	176.1	179.9	176.7	0	108.8
618	S	36.1	Very low	38.2	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	76%	0.76	S	S	*	*			trans	-124.5	128.4	158.8	47	0	0	0	0	108
619	H	38	Very low	38.6	Very low	174 Å²	174	154.4 Å²	154.4	81%	0.806	75%	0.754	S	S	*	*			trans	-76.4	136.8	-173.7	-87.1	-90.6	0	0	0	111.6	P621	H619-P621 WeakPolarHBondContact O-CD 3.44Å
620	S	36.6	Very low	39.4	Very low	100 Å²	100	152.3 Å²	152.3	70%	0.699	74%	0.739	S	S	*	*			trans	-77.7	116	163.2	43.1	0	0	0	0	109.5	R622	S620-R622 VanDerWaalsContact C-N 3.27Å; S620-R622 PolarHBondContact O-N 2.73Å
621	P	41.4	Very low	39.9	Very low	129 Å²	129	148.2 Å²	148.2	84%	0.838	73%	0.729	S	S	*	*	S	Bend	trans	-79.6	75.1	-178.3	32.7	-35	0	0	0	110.2	H619	H619-P621 WeakPolarHBondContact O-CD 3.44Å
622	R	37.6	Very low	41	Very low	218 Å²	218	145.2 Å²	145.2	82%	0.823	72%	0.718	S	S	*	*			trans	-138.4	9.4	-172	-114.2	-178.5	-176.8	-179.9	1.2	117.5	S620	S620-R622 VanDerWaalsContact C-N 3.27Å; S620-R622 PolarHBondContact O-N 2.73Å
623	L	41.9	Very low	42.3	Very low	145 Å²	145	140.7 Å²	140.7	76%	0.759	71%	0.705	S	S	*	*	S	Bend	trans	-124.6	-27.6	178	-76.1	167.5	0	0	0	115.2	V625	L623-V625 VanDerWaalsContact C-N 3.29Å; L623-V625 PolarHBondContact O-N 3.4Å
624	G	40.7	Very low	43.9	Very low	60 Å²	60	142.1 Å²	142.1	62%	0.619	70%	0.702	S	S	*	*	H	α-helix	trans	-67.9	-21.4	-178.6	0	0	0	0	0	115.7	I626	G624-I626 PolarHBondContact O-N 3.13Å
625	V	44.7	Very low	45.5	Very low	93 Å²	93	140.1 Å²	140.1	56%	0.564	69%	0.692	S	S	*	*	H	α-helix	trans	-76.5	-21.3	-175.8	-176.1	0	0	0	0	112.4	L623	L623-V625 VanDerWaalsContact C-N 3.29Å; L623-V625 PolarHBondContact O-N 3.4Å
626	I	48	Very low	47.4	Very low	119 Å²	119	132.1 Å²	132.1	61%	0.61	67%	0.673	S	S	*	*	H	α-helix	trans	-77	-37.8	-173.8	-64.9	177.9	0	0	0	111.8	G624	G624-I626 PolarHBondContact O-N 3.13Å
627	E	47.6	Very low	49.2	Very low	149 Å²	149	123.8 Å²	123.8	70%	0.696	65%	0.652	S	S	*	*	H	α-helix	trans	-72.7	-38.8	-177.3	-64.6	-173.7	136.4	0	0	112.5	W629 T630	E627-W629 VanDerWaalsContact C-N 3.28Å; E627-W629 PolarHBondContact O-N 2.85Å; E627-T630 WeakPolarHBondContact O-CB 3.21Å; E627-T630 PolarHBondContact O-N 3.32Å; E627-T630 PolarHBondContact O-OG1 2.99Å
628	Q	42.5	Very low	51.7	Low	138 Å²	138	119.1 Å²	119.1	65%	0.645	64%	0.636	S	S	*	*	H	α-helix	trans	-59.7	-35.8	-178	-163	170.9	10	0	0	112.7	T630 Q631	Q628-T630 VanDerWaalsContact C-N 3.3Å; Q628-T630 PolarHBondContact O-N 2.9Å; Q628-Q631 PolarHBondContact O-N 3.3Å
629	W	42.9	Very low	53.9	Low	176 Å²	176	118.8 Å²	118.8	67%	0.667	63%	0.625	S	S	*	*	H	α-helix	trans	-70	-24.5	176.8	-74	62	0	0	0	113	E627 Q631 S633	E627-W629 VanDerWaalsContact C-N 3.28Å; E627-W629 PolarHBondContact O-N 2.85Å; W629-Q631 VanDerWaalsContact C-N 3.26Å; W629-Q631 PolarHBondContact O-N 2.86Å; W629-S633 WeakPolarHBondContact O-CB 3.36Å; W629-S633 PolarHBondContact O-N 2.7Å; W629-S633 PolarHBondContact O-OG 3.12Å
630	T	53.4	Low	56.1	Low	75 Å²	75	116.8 Å²	116.8	46%	0.46	61%	0.614	S	S	.	*	H	α-helix	trans	-70.9	-24.2	175.5	74.9	0	0	0	0	112.6	E627 Q628 K634	E627-T630 WeakPolarHBondContact O-CB 3.21Å; E627-T630 PolarHBondContact O-N 3.32Å; E627-T630 PolarHBondContact O-OG1 2.99Å; Q628-T630 VanDerWaalsContact C-N 3.3Å; Q628-T630 PolarHBondContact O-N 2.9Å; T630-K634 WeakPolarHBondContact O-CG 3.23Å; T630-K634 PolarHBondContact O-N 2.84Å
631	Q	47.1	Very low	58.4	Low	140 Å²	140	117.1 Å²	117.1	65%	0.654	61%	0.607	S	S	*	*	H	α-helix	trans	-83.2	-43.1	-178.9	-166	157.8	-20.1	0	0	111.6	Q628 W629 S633 K634 I635	Q628-Q631 PolarHBondContact O-N 3.3Å; W629-Q631 VanDerWaalsContact C-N 3.26Å; W629-Q631 PolarHBondContact O-N 2.86Å; Q631-S633 VanDerWaalsContact C-N 3.28Å; Q631-S633 PolarHBondContact O-N 3.42Å; Q631-K634 PolarHBondContact O-N 2.87Å; Q631-I635 PolarHBondContact O-N 3.45Å
632	E	56.6	Low	60.6	Low	122 Å²	122	115.8 Å²	115.8	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-60.5	-38.9	170.2	-65.7	-164.9	161.7	0	0	111.7	K634 I635 C636	E632-K634 VanDerWaalsContact C-N 3.29Å; E632-K634 PolarHBondContact O-N 3.13Å; E632-I635 PolarHBondContact O-N 3.19Å; E632-I635 VanDerWaalsContact O-N 3.12Å; E632-C636 PolarHBondContact O-N 2.87Å; E632-C636 PolarHBondContact O-SG 3.18Å; E632-C636 VanDerWaalsContact O-SG 3.42Å
633	S	61.8	Low	63	Low	74 Å²	74	112.4 Å²	112.4	52%	0.517	58%	0.58	S	S	.	*	H	α-helix	trans	-56.2	-39.6	176.4	-63.5	0	0	0	0	113.1	W629 Q631 A637	W629-S633 WeakPolarHBondContact O-CB 3.36Å; W629-S633 PolarHBondContact O-N 2.7Å; W629-S633 PolarHBondContact O-OG 3.12Å; Q631-S633 VanDerWaalsContact C-N 3.28Å; Q631-S633 PolarHBondContact O-N 3.42Å; S633-A637 WeakPolarHBondContact O-CB 3.43Å; S633-A637 PolarHBondContact O-N 2.98Å
634	K	67.6	Low	65.3	Low	141 Å²	141	109.9 Å²	109.9	61%	0.613	57%	0.566	S	S	*	*	H	α-helix	trans	-69.4	-38.5	177.5	-70.2	170.3	-177	174.7	0	112.2	T630 Q631 E632 A637 N638	T630-K634 WeakPolarHBondContact O-CG 3.23Å; T630-K634 PolarHBondContact O-N 2.84Å; Q631-K634 PolarHBondContact O-N 2.87Å; E632-K634 VanDerWaalsContact C-N 3.29Å; E632-K634 PolarHBondContact O-N 3.13Å; K634-A637 PolarHBondContact O-N 2.74Å; K634-N638 PolarHBondContact O-N 3.14Å
635	I	73.8	Confident	67.6	Low	100 Å²	100	115.9 Å²	115.9	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-65.4	-45.3	176.7	-62	168.4	0	0	0	109.9	Q631 E632 A637 N638 L639	Q631-I635 PolarHBondContact O-N 3.45Å; E632-I635 PolarHBondContact O-N 3.19Å; E632-I635 VanDerWaalsContact O-N 3.12Å; I635-A637 PolarHBondContact O-N 2.81Å; I635-N638 PolarHBondContact O-N 3.46Å; I635-L639 HydrophobicContact CG2-CD1 4.03Å; I635-L639 WeakPolarHBondContact O-CG 3.49Å; I635-L639 PolarHBondContact O-N 3.29Å
636	C	68.5	Low	69.8	Low	83 Å²	83	114.9 Å²	114.9	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-60.4	-42.6	174.7	-67.3	0	0	0	0	112.6	E632 F640	E632-C636 PolarHBondContact O-N 2.87Å; E632-C636 PolarHBondContact O-SG 3.18Å; E632-C636 VanDerWaalsContact O-SG 3.42Å; C636-F640 WeakPolarHBondContact O-CB 2.92Å; C636-F640 PolarHBondContact O-N 3.26Å
637	A	76	Confident	71.8	Confident	47 Å²	47	112 Å²	112	39%	0.388	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-46.9	177.7	0	0	0	0	0	112.3	S633 K634 I635 L639 F640 I641	S633-A637 WeakPolarHBondContact O-CB 3.43Å; S633-A637 PolarHBondContact O-N 2.98Å; K634-A637 PolarHBondContact O-N 2.74Å; I635-A637 PolarHBondContact O-N 2.81Å; A637-L639 PolarHBondContact O-N 3.23Å; A637-F640 PolarHBondContact O-N 2.66Å; A637-I641 WeakPolarHBondContact O-CG1 3.36Å; A637-I641 PolarHBondContact O-N 2.97Å
638	N	82.5	Confident	73.6	Confident	101 Å²	101	107.8 Å²	107.8	54%	0.54	54%	0.539	S	S	.	.	H	α-helix	trans	-63.3	-43.2	178.4	-74.9	-6.8	0	0	0	112	K634 I635 F640 I641 I642	K634-N638 PolarHBondContact O-N 3.14Å; I635-N638 PolarHBondContact O-N 3.46Å; N638-F640 VanDerWaalsContact C-N 3.3Å; N638-F640 PolarHBondContact O-N 2.73Å; N638-I641 PolarHBondContact O-N 2.7Å; N638-I642 VanDerWaalsContact O-CG1 3.29Å; N638-I642 WeakPolarHBondContact O-CG1 3.41Å; N638-I642 PolarHBondContact O-N 3.27Å
639	L	83.6	Confident	75.9	Confident	111 Å²	111	106.4 Å²	106.4	58%	0.581	53%	0.533	S	S	*	.	H	α-helix	trans	-62.2	-36.6	175.1	-72.1	171.2	0	0	0	112.3	I635 A637 Y643	I635-L639 HydrophobicContact CG2-CD1 4.03Å; I635-L639 WeakPolarHBondContact O-CG 3.49Å; I635-L639 PolarHBondContact O-N 3.29Å; A637-L639 PolarHBondContact O-N 3.23Å; L639-Y643 WeakPolarHBondContact O-CB 3.32Å; L639-Y643 PolarHBondContact O-N 3.45Å
640	F	82.4	Confident	78.1	Confident	132 Å²	132	101.8 Å²	101.8	58%	0.579	52%	0.521	S	S	*	.	H	α-helix	trans	-70.2	-37.8	176.9	-167.5	-109.5	0	0	0	112.5	C636 A637 N638 Y643 I644	C636-F640 WeakPolarHBondContact O-CB 2.92Å; C636-F640 PolarHBondContact O-N 3.26Å; A637-F640 PolarHBondContact O-N 2.66Å; N638-F640 VanDerWaalsContact C-N 3.3Å; N638-F640 PolarHBondContact O-N 2.73Å; F640-Y643 PolarHBondContact O-N 2.97Å; F640-I644 HydrophobicContact CD1-CD1 3.84Å; F640-I644 HydrophobicContact CE1-CD1 3.45Å; F640-I644 VanDerWaalsContact CE1-CD1 3.45Å; F640-I644 HydrophobicContact CE1-CG1 4.38Å; F640-I644 HydrophobicContact CZ-CD1 3.97Å; F640-I644 WeakPolarHBondContact O-CG1 3.47Å; F640-I644 PolarHBondContact O-N 3.41Å
641	I	85.6	Confident	79.8	Confident	107 Å²	107	101.9 Å²	101.9	55%	0.549	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-45.6	173.4	-68.4	165	0	0	0	110.7	A637 N638 Y643 I644 W645	A637-I641 WeakPolarHBondContact O-CG1 3.36Å; A637-I641 PolarHBondContact O-N 2.97Å; N638-I641 PolarHBondContact O-N 2.7Å; I641-Y643 VanDerWaalsContact C-N 3.3Å; I641-Y643 PolarHBondContact O-N 3.42Å; I641-I644 PolarHBondContact O-N 2.71Å; I641-W645 WeakPolarHBondContact O-CB 3.37Å; I641-W645 PolarHBondContact O-N 3.46Å
642	I	88	Confident	81.7	Confident	100 Å²	100	100.1 Å²	100.1	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-39.7	175.9	-67.6	163.6	0	0	0	111	N638 W645 T646	N638-I642 VanDerWaalsContact O-CG1 3.29Å; N638-I642 WeakPolarHBondContact O-CG1 3.41Å; N638-I642 PolarHBondContact O-N 3.27Å; I642-W645 PolarHBondContact O-N 2.71Å; I642-T646 HydrophobicContact CG2-CG2 4.46Å; I642-T646 WeakPolarHBondContact O-CB 3.44Å; I642-T646 WeakPolarHBondContact O-CG2 3.47Å; I642-T646 PolarHBondContact O-N 2.83Å; I642-T646 PolarHBondContact O-OG1 2.8Å
643	Y	87.7	Confident	83.1	Confident	148 Å²	148	99 Å²	99	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-65.6	-45	175.8	-178.8	-106.4	0	0	0	112.4	L639 F640 I641 W645 T646 V647	L639-Y643 WeakPolarHBondContact O-CB 3.32Å; L639-Y643 PolarHBondContact O-N 3.45Å; F640-Y643 PolarHBondContact O-N 2.97Å; I641-Y643 VanDerWaalsContact C-N 3.3Å; I641-Y643 PolarHBondContact O-N 3.42Å; Y643-W645 VanDerWaalsContact C-N 3.33Å; Y643-W645 PolarHBondContact O-N 2.92Å; Y643-T646 PolarHBondContact O-OG1 2.91Å; Y643-V647 HydrophobicContact CD1-CG2 4.42Å; Y643-V647 HydrophobicContact CD2-CG2 4.09Å; Y643-V647 HydrophobicContact CE1-CG2 4.04Å; Y643-V647 HydrophobicContact CE2-CG2 3.67Å; Y643-V647 HydrophobicContact CG-CG2 4.44Å; Y643-V647 WeakPolarHBondContact O-CB 3.39Å; Y643-V647 VanDerWaalsContact O-CG2 3.28Å; Y643-V647 WeakPolarHBondContact O-CG2 3.35Å; Y643-V647 PolarHBondContact O-N 2.83Å
644	I	90	Very high	84.3	Confident	92 Å²	92	99.3 Å²	99.3	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-43	175	-74.9	174.8	0	0	0	111	F640 I641 S648	F640-I644 HydrophobicContact CD1-CD1 3.84Å; F640-I644 HydrophobicContact CE1-CD1 3.45Å; F640-I644 VanDerWaalsContact CE1-CD1 3.45Å; F640-I644 HydrophobicContact CE1-CG1 4.38Å; F640-I644 HydrophobicContact CZ-CD1 3.97Å; F640-I644 WeakPolarHBondContact O-CG1 3.47Å; F640-I644 PolarHBondContact O-N 3.41Å; I641-I644 PolarHBondContact O-N 2.71Å; I644-S648 VanDerWaalsContact O-CB 3.23Å; I644-S648 WeakPolarHBondContact O-CB 3.47Å; I644-S648 PolarHBondContact O-N 2.89Å
645	W	88.9	Confident	85.2	Confident	186 Å²	186	96 Å²	96	71%	0.705	50%	0.497	S	S	*	.	H	α-helix	trans	-67.9	-43.7	-178.3	-158.7	66.3	0	0	0	112.1	I641 I642 Y643 S648 H649	I641-W645 WeakPolarHBondContact O-CB 3.37Å; I641-W645 PolarHBondContact O-N 3.46Å; I642-W645 PolarHBondContact O-N 2.71Å; Y643-W645 VanDerWaalsContact C-N 3.33Å; Y643-W645 PolarHBondContact O-N 2.92Å; W645-S648 PolarHBondContact O-N 2.7Å; W645-H649 WeakPolarHBondContact O-CB 3.33Å; W645-H649 PolarHBondContact O-N 2.95Å
646	T	90.5	Very high	85.7	Confident	72 Å²	72	96.6 Å²	96.6	44%	0.442	50%	0.501	S	S	.	.	H	α-helix	trans	-67.7	-41.3	176.6	49.5	0	0	0	0	112.6	I642 Y643 H649 L650	I642-T646 HydrophobicContact CG2-CG2 4.46Å; I642-T646 WeakPolarHBondContact O-CB 3.44Å; I642-T646 WeakPolarHBondContact O-CG2 3.47Å; I642-T646 PolarHBondContact O-N 2.83Å; I642-T646 PolarHBondContact O-OG1 2.8Å; Y643-T646 PolarHBondContact O-OG1 2.91Å; T646-H649 PolarHBondContact O-N 3.21Å; T646-L650 WeakPolarHBondContact O-CB 3.42Å; T646-L650 PolarHBondContact O-N 3.43Å
647	V	90	Very high	86.4	Confident	57 Å²	57	97.7 Å²	97.7	35%	0.345	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-43.3	173.9	171.1	0	0	0	0	111.2	Y643 H649 L650 V651	Y643-V647 HydrophobicContact CD1-CG2 4.42Å; Y643-V647 HydrophobicContact CD2-CG2 4.09Å; Y643-V647 HydrophobicContact CE1-CG2 4.04Å; Y643-V647 HydrophobicContact CE2-CG2 3.67Å; Y643-V647 HydrophobicContact CG-CG2 4.44Å; Y643-V647 WeakPolarHBondContact O-CB 3.39Å; Y643-V647 VanDerWaalsContact O-CG2 3.28Å; Y643-V647 WeakPolarHBondContact O-CG2 3.35Å; Y643-V647 PolarHBondContact O-N 2.83Å; V647-H649 VanDerWaalsContact C-N 3.35Å; V647-H649 PolarHBondContact O-N 3.33Å; V647-L650 PolarHBondContact O-N 3.22Å; V647-V651 HydrophobicContact CG1-CG2 4.45Å; V647-V651 WeakPolarHBondContact O-CG2 3.43Å; V647-V651 PolarHBondContact O-N 3.33Å
648	S	86.6	Confident	86.6	Confident	61 Å²	61	100.4 Å²	100.4	43%	0.427	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-36.6	178.2	-167	0	0	0	0	112.2	I644 W645 N652	I644-S648 VanDerWaalsContact O-CB 3.23Å; I644-S648 WeakPolarHBondContact O-CB 3.47Å; I644-S648 PolarHBondContact O-N 2.89Å; W645-S648 PolarHBondContact O-N 2.7Å; S648-N652 WeakPolarHBondContact O-CB 3.34Å; S648-N652 VanDerWaalsContact O-CG 3.23Å; S648-N652 PolarHBondContact O-N 3.16Å; S648-N652 PolarHBondContact O-ND2 3.05Å
649	H	89.4	Confident	86.5	Confident	110 Å²	110	104.1 Å²	104.1	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-68.4	-39.3	174.4	-163.4	-63.5	0	0	0	111.8	W645 T646 V647 N652 H653	W645-H649 WeakPolarHBondContact O-CB 3.33Å; W645-H649 PolarHBondContact O-N 2.95Å; T646-H649 PolarHBondContact O-N 3.21Å; V647-H649 VanDerWaalsContact C-N 3.35Å; V647-H649 PolarHBondContact O-N 3.33Å; H649-N652 PolarHBondContact O-N 3.41Å; H649-H653 WeakPolarHBondContact O-CB 2.93Å; H649-H653 PolarHBondContact O-N 2.77Å
650	L	89.7	Confident	85.9	Confident	79 Å²	79	106.2 Å²	106.2	41%	0.414	54%	0.544	S	S	.	.	H	α-helix	trans	-65.9	-43.2	176	-173.4	66.9	0	0	0	111.6	T646 V647 H653 I654	T646-L650 WeakPolarHBondContact O-CB 3.42Å; T646-L650 PolarHBondContact O-N 3.43Å; V647-L650 PolarHBondContact O-N 3.22Å; L650-H653 PolarHBondContact O-N 3.43Å; L650-I654 HydrophobicContact CD1-CD1 4.43Å; L650-I654 HydrophobicContact CG-CD1 4.02Å; L650-I654 VanDerWaalsContact O-CG1 3.31Å; L650-I654 WeakPolarHBondContact O-CG1 3.49Å; L650-I654 PolarHBondContact O-N 2.86Å
651	V	89.1	Confident	86.1	Confident	77 Å²	77	104.9 Å²	104.9	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-60.9	-45.1	173.8	169.5	0	0	0	0	110.9	V647 H653 I654 V655	V647-V651 HydrophobicContact CG1-CG2 4.45Å; V647-V651 WeakPolarHBondContact O-CG2 3.43Å; V647-V651 PolarHBondContact O-N 3.33Å; V651-H653 VanDerWaalsContact C-N 3.32Å; V651-H653 PolarHBondContact O-N 2.78Å; V651-I654 PolarHBondContact O-N 2.9Å; V651-V655 HydrophobicContact CG1-CG2 4.43Å; V651-V655 WeakPolarHBondContact O-CB 3.44Å; V651-V655 VanDerWaalsContact O-CG2 3.29Å; V651-V655 WeakPolarHBondContact O-CG2 3.34Å; V651-V655 PolarHBondContact O-N 3.07Å
652	N	86.3	Confident	86.1	Confident	103 Å²	103	104.8 Å²	104.8	55%	0.551	54%	0.542	S	S	*	.	H	α-helix	trans	-62.4	-38.1	175.8	-73.5	-21.9	0	0	0	112.3	S648 H649 V655 L656	S648-N652 WeakPolarHBondContact O-CB 3.34Å; S648-N652 VanDerWaalsContact O-CG 3.23Å; S648-N652 PolarHBondContact O-N 3.16Å; S648-N652 PolarHBondContact O-ND2 3.05Å; H649-N652 PolarHBondContact O-N 3.41Å; N652-V655 PolarHBondContact O-N 3.07Å; N652-L656 WeakPolarHBondContact O-CB 3.39Å; N652-L656 PolarHBondContact O-N 3.04Å
653	H	87.3	Confident	86	Confident	98 Å²	98	105.1 Å²	105.1	45%	0.454	54%	0.544	S	S	.	.	H	α-helix	trans	-70.8	-38	178.5	-157.5	-77.2	0	0	0	112.4	H649 L650 V651 L656 L657	H649-H653 WeakPolarHBondContact O-CB 2.93Å; H649-H653 PolarHBondContact O-N 2.77Å; L650-H653 PolarHBondContact O-N 3.43Å; V651-H653 VanDerWaalsContact C-N 3.32Å; V651-H653 PolarHBondContact O-N 2.78Å; H653-L656 PolarHBondContact O-N 3.39Å; H653-L657 WeakPolarHBondContact ND1-CD1 3.39Å; H653-L657 WeakPolarHBondContact O-CB 3.18Å; H653-L657 WeakPolarHBondContact O-CG 3.33Å; H653-L657 PolarHBondContact O-N 3.2Å
654	I	86.6	Confident	85.9	Confident	81 Å²	81	102.5 Å²	102.5	42%	0.415	54%	0.542	S	S	.	.	H	α-helix	trans	-65.7	-45	172.8	-68.5	166.1	0	0	0	110.3	L650 V651 L656 L657 C658	L650-I654 HydrophobicContact CD1-CD1 4.43Å; L650-I654 HydrophobicContact CG-CD1 4.02Å; L650-I654 VanDerWaalsContact O-CG1 3.31Å; L650-I654 WeakPolarHBondContact O-CG1 3.49Å; L650-I654 PolarHBondContact O-N 2.86Å; V651-I654 PolarHBondContact O-N 2.9Å; I654-L656 VanDerWaalsContact C-N 3.3Å; I654-L656 PolarHBondContact O-N 3.13Å; I654-L657 PolarHBondContact O-N 3.43Å; I654-C658 PolarHBondContact O-N 3.49Å; I654-C658 PolarHBondContact O-SG 2.72Å
655	V	86.8	Confident	85.6	Confident	72 Å²	72	103.2 Å²	103.2	44%	0.436	55%	0.546	S	S	.	.	H	α-helix	trans	-59.8	-41.9	175.3	169.1	0	0	0	0	111	V651 N652 C658 F659	V651-V655 HydrophobicContact CG1-CG2 4.43Å; V651-V655 WeakPolarHBondContact O-CB 3.44Å; V651-V655 VanDerWaalsContact O-CG2 3.29Å; V651-V655 WeakPolarHBondContact O-CG2 3.34Å; V651-V655 PolarHBondContact O-N 3.07Å; N652-V655 PolarHBondContact O-N 3.07Å; V655-C658 PolarHBondContact O-N 3.42Å; V655-F659 HydrophobicContact CG1-CD2 3.99Å; V655-F659 HydrophobicContact CG1-CE2 4.18Å; V655-F659 WeakPolarHBondContact O-CD2 3.48Å; V655-F659 PolarHBondContact O-N 3.41Å
656	L	83.1	Confident	85.4	Confident	112 Å²	112	97.7 Å²	97.7	59%	0.586	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-45.1	177.2	-160.3	73.2	0	0	0	111.7	N652 H653 I654 C658 F659 T660	N652-L656 WeakPolarHBondContact O-CB 3.39Å; N652-L656 PolarHBondContact O-N 3.04Å; H653-L656 PolarHBondContact O-N 3.39Å; I654-L656 VanDerWaalsContact C-N 3.3Å; I654-L656 PolarHBondContact O-N 3.13Å; L656-C658 VanDerWaalsContact C-N 3.25Å; L656-C658 PolarHBondContact O-N 2.97Å; L656-F659 PolarHBondContact O-N 3.39Å; L656-T660 PolarHBondContact O-N 3.28Å; L656-T660 PolarHBondContact O-OG1 3.41Å
657	L	83.7	Confident	85.1	Confident	105 Å²	105	99.5 Å²	99.5	55%	0.55	54%	0.543	S	S	.	.	H	α-helix	trans	-64.4	-24.3	175.6	-75.3	169.7	0	0	0	113.8	H653 I654 F659 T660	H653-L657 WeakPolarHBondContact ND1-CD1 3.39Å; H653-L657 WeakPolarHBondContact O-CB 3.18Å; H653-L657 WeakPolarHBondContact O-CG 3.33Å; H653-L657 PolarHBondContact O-N 3.2Å; I654-L657 PolarHBondContact O-N 3.43Å; L657-F659 VanDerWaalsContact C-N 3.34Å; L657-T660 PolarHBondContact O-OG1 2.78Å
658	C	80.7	Confident	84.7	Confident	105 Å²	105	102.8 Å²	102.8	71%	0.709	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-3	172.1	-66	0	0	0	0	113.8	I654 V655 L656	I654-C658 PolarHBondContact O-N 3.49Å; I654-C658 PolarHBondContact O-SG 2.72Å; V655-C658 PolarHBondContact O-N 3.42Å; L656-C658 VanDerWaalsContact C-N 3.25Å; L656-C658 PolarHBondContact O-N 2.97Å
659	F	80.4	Confident	84.5	Confident	178 Å²	178	106.3 Å²	106.3	78%	0.781	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-6.7	176.2	-94.4	-70.9	0	0	0	113.6	V655 L656 L657	V655-F659 HydrophobicContact CG1-CD2 3.99Å; V655-F659 HydrophobicContact CG1-CE2 4.18Å; V655-F659 WeakPolarHBondContact O-CD2 3.48Å; V655-F659 PolarHBondContact O-N 3.41Å; L656-F659 PolarHBondContact O-N 3.39Å; L657-F659 VanDerWaalsContact C-N 3.34Å
660	T	71.1	Confident	84.1	Confident	155 Å²	155	105.9 Å²	105.9	95%	0.951	57%	0.574	S	S	*	*			trans	-101.6	0	174.7	53.7	0	0	0	0	111.8	L656 L657	L656-T660 PolarHBondContact O-N 3.28Å; L656-T660 PolarHBondContact O-OG1 3.41Å; L657-T660 PolarHBondContact O-OG1 2.78Å

Retrieved 660 of 660 residues in 586.3 ms (Link to these results)

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