A0A087X3C1_POEFO Loading...

Myosin light chain kinase, smooth muscle

AlphaFold DB , UniProt , Accession A0A087X3C1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 904 aa.

						>A0A087X3C1_POEFO|A0A087X3C1
MDFKANLRGVKGKAEEKANSPQQVDFRSVLGKKGAAGSNGNKPAETPPKNAGDFRSVLANKKKTTPAATPEKNGEKVNNCVDGGIHDQKSEGGKGGEGGGGGGGGTAPEFVEKLKDVTVLDGQRLRLECRLASAAAADVTVTWTLDGKTVKPSKFIILANEGGLCSLTIDKALPEDEGQYKCRAENSAGRAECSCMVLVDDPPENSPTDKKSKKAAPTSESEARIKKPTPKTPPKQALPPQILQFPEDMKILAGEKVEILCKYSGAPPITCTWLKFRKAIQEGSSDVSIETTDSSSKLTISSGQQEHCGCYTVELRNGYGLRQAALNLTIVDKPDPPAKVPATSDIRRSSLTLSWYGPTYDGGSAVQTYHLEIWDSVDQQWKQLVSCNSTSYNIQNLLPERQYKFRIRAQNIYGIGEPSAESEAVTMGLVDDDNQDDAEAEEEDEDLDKEPEYRDVTIKTDVKVKEFYDVEERLGTGKFGQVFKLVEKSTKKVWAGKFIKAYSAKDKENVRQEIGIMNSLHHPKLVQCVDAFEGKSDIVMVLEMISGGELFERIIDEDFELTEREVIKYMLQIIDGVNFIHKQGIVHLDLKPENIMCVNKTGSQIKLIDFGLARRLANAGTLKVLFGTPEFVAPEVINYEAISYPTDMWSIGVICYILLSGLSPFMGDNDNETLANVTSATWDFEDEAFDEISENAKDFITNLLKKDMKARLSCPQCFEHPWLKQDTNTMKTTKLSKERMKKYILRRKWQKTGHAVRAIGRLSSMAMMAGVSAKKGSPTEEDNQFLECLEYEQKTESKPTFSSVIKDVEVVEGSAARFDCKIEGYPDPEVVWYKDDQPIKETRHFQIDYDEEGNCSLIISEVSGDDDAKYMVKAVNSLGEATCTADLLVEVMAGEDEEEEEEEE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	31.7	Very low	244 Å²	244	157.8 Å²	157.8	100%	1.202	81%	0.812	S	S	*	*				0	151.1	0	-72.6	179.7	173.6	0	0	107.8
2	D	31.6	Very low	31.6	Very low	147 Å²	147	150.3 Å²	150.3	79%	0.786	80%	0.803	S	S	*	*			trans	-89	-178.1	-165.9	-78.1	-79.9	0	0	0	115.6
3	F	28.9	Very low	31.4	Very low	183 Å²	183	154.5 Å²	154.5	80%	0.803	81%	0.81	S	S	*	*			trans	83.5	122.3	169.9	-66	-98.3	0	0	0	115.8
4	K	32.8	Very low	31.4	Very low	180 Å²	180	149 Å²	149	78%	0.783	80%	0.797	S	S	*	*			cis	88.8	99.2	37.9	-74.8	-175.5	171.2	175.9	0	115.1
5	A	40.9	Very low	31.2	Very low	86 Å²	86	150.5 Å²	150.5	71%	0.711	80%	0.798	S	S	*	*				66.2	161.1	114	0	0	0	0	0	122.4
6	N	31.1	Very low	31.2	Very low	141 Å²	141	150.2 Å²	150.2	75%	0.754	79%	0.79	S	S	*	*			trans	75.7	132.9	171.8	-60.9	-17.4	0	0	0	116.5
7	L	29.8	Very low	31.1	Very low	133 Å²	133	151.2 Å²	151.2	70%	0.696	79%	0.787	S	S	*	*			cis	97.3	116.2	29.2	-81.1	170.6	0	0	0	114.4
8	R	29.3	Very low	31.1	Very low	234 Å²	234	148 Å²	148	88%	0.883	79%	0.786	S	S	*	*			trans	63.9	140.9	160.1	-54.6	169.7	-178.2	-175.3	-0.6	114.2
9	G	29.2	Very low	30.9	Very low	74 Å²	74	149.2 Å²	149.2	76%	0.763	79%	0.793	S	S	*	*			cis	170	-149.2	7.8	0	0	0	0	0	105.1
10	V	31.8	Very low	30.9	Very low	111 Å²	111	146.8 Å²	146.8	67%	0.673	79%	0.788	S	S	*	*			cis	-179.7	152.5	26.6	155.8	0	0	0	0	106.9
11	K	30.1	Very low	31.9	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	78%	0.781	S	S	*	*			trans	69	145.6	170.9	-68.5	150	-167	173.1	0	117.5
12	G	29.8	Very low	31.9	Very low	68 Å²	68	141 Å²	141	70%	0.701	76%	0.762	S	S	*	*			cis	134.4	147.8	-18	0	0	0	0	0	116.9
13	K	28.9	Very low	31.6	Very low	205 Å²	205	143.5 Å²	143.5	89%	0.891	77%	0.769	S	S	*	*			trans	174.9	132	149.7	-94.7	168.5	-179.6	-172.2	0	106.5
14	A	31.6	Very low	31.6	Very low	77 Å²	77	140.7 Å²	140.7	64%	0.636	77%	0.766	S	S	*	*				74.3	133	54.2	0	0	0	0	0	112.3
15	E	28.9	Very low	31.5	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	76%	0.762	S	S	*	*			cis	-165.8	151.7	1.8	-120.9	166.7	173.1	0	0	111.2
16	E	30.3	Very low	31	Very low	146 Å²	146	142.3 Å²	142.3	68%	0.682	76%	0.764	S	S	*	*			trans	55.4	163.2	149.2	-71.8	-161.3	126.8	0	0	121.1
17	K	30.2	Very low	30.9	Very low	167 Å²	167	147.4 Å²	147.4	73%	0.726	77%	0.772	S	S	*	*			cis	-140.6	173.5	6.5	-142.6	159.3	-178.9	74.8	0	110.7
18	A	30.6	Very low	30.8	Very low	94 Å²	94	146 Å²	146	78%	0.777	77%	0.774	S	S	*	*			trans	-132.9	165.5	-179.2	0	0	0	0	0	111.7
19	N	28.4	Very low	30.9	Very low	171 Å²	171	140.6 Å²	140.6	91%	0.914	77%	0.767	S	S	*	*			trans	-137.2	146.7	171.9	-117.6	6.4	0	0	0	113.7
20	S	30.5	Very low	30.9	Very low	101 Å²	101	144.3 Å²	144.3	71%	0.706	77%	0.768	S	S	*	*			trans	-146.6	-160.5	170.2	62.4	0	0	0	0	105.8
21	P	52.3	Low	30.7	Very low	96 Å²	96	142.2 Å²	142.2	62%	0.623	77%	0.769	S	S	*	*			cis	-134.5	-171.1	-17.3	39.9	-20.9	0	0	0	114.1
22	Q	32.2	Very low	30.9	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.804	77%	0.765	S	S	*	*			trans	47.9	127.4	144.5	-74	167.3	-10.7	0	0	123
23	Q	26.8	Very low	31	Very low	201 Å²	201	147.6 Å²	147.6	94%	0.939	77%	0.773	S	S	*	*				-155.2	173.7	124.5	-122.1	178.3	24	0	0	112.7
24	V	28.9	Very low	30.9	Very low	123 Å²	123	141.7 Å²	141.7	75%	0.745	77%	0.77	S	S	*	*			trans	-155.4	145.8	-141.5	141.2	0	0	0	0	115.4
25	D	30.4	Very low	30.9	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	78%	0.783	S	S	*	*			trans	90.8	151.2	152.4	-106.1	-28.8	0	0	0	127.2
26	F	30	Very low	31	Very low	172 Å²	172	140.2 Å²	140.2	75%	0.754	79%	0.787	S	S	*	*			trans	32.2	128	158	-76.7	-69.8	0	0	0	124.3
27	R	28.2	Very low	30.9	Very low	248 Å²	248	136.2 Å²	136.2	94%	0.936	79%	0.785	S	S	*	*				-164.7	170.5	119	-113.3	172.5	-175.3	169.3	3.5	114.7
28	S	28.7	Very low	30.9	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	79%	0.787	S	S	*	*			trans	-152	-178.8	-173	55.2	0	0	0	0	112.6
29	V	31.5	Very low	30.9	Very low	121 Å²	121	136.7 Å²	136.7	73%	0.733	79%	0.791	S	S	*	*			trans	107.5	107	158.8	-175.7	0	0	0	0	120.2
30	L	29.9	Very low	31	Very low	152 Å²	152	132.2 Å²	132.2	80%	0.796	79%	0.786	S	S	*	*			trans	78.6	127.1	142.7	-78.7	170.7	0	0	0	126.5
31	G	27.3	Very low	30.9	Very low	67 Å²	67	135.4 Å²	135.4	69%	0.691	80%	0.795	S	S	*	*			trans	170.7	90.5	147.1	0	0	0	0	0	112.8
32	K	33.3	Very low	29.9	Very low	182 Å²	182	139.3 Å²	139.3	79%	0.791	80%	0.802	S	S	*	*				58.3	126.2	90.5	-74.2	-179.4	177.1	173.1	0	114.3
33	K	31.3	Very low	30.4	Very low	201 Å²	201	136.8 Å²	136.8	87%	0.874	80%	0.801	S	S	*	*			cis	-146.1	153.3	6.4	-58.9	172	179	169.2	0	109.5
34	G	28.6	Very low	30.7	Very low	81 Å²	81	131.4 Å²	131.4	84%	0.835	79%	0.79	S	S	*	*				94.3	144.6	99.5	0	0	0	0	0	113.3
35	A	30.3	Very low	30.7	Very low	109 Å²	109	134.9 Å²	134.9	90%	0.901	80%	0.799	S	S	*	*			cis	-151.4	-168.4	7.9	0	0	0	0	0	113.4
36	A	30.8	Very low	30.8	Very low	108 Å²	108	135 Å²	135	89%	0.893	81%	0.805	S	S	*	*			trans	-71.4	171.1	-169.5	0	0	0	0	0	116.9
37	G	28.3	Very low	31.7	Very low	62 Å²	62	132 Å²	132	64%	0.639	80%	0.802	S	S	*	*			cis	150.2	178.4	-9.1	0	0	0	0	0	115.6
38	S	30.2	Very low	32.1	Very low	110 Å²	110	126.2 Å²	126.2	77%	0.769	80%	0.796	S	S	*	*			trans	70.3	145.7	165	67.5	0	0	0	0	122.2
39	N	30.8	Very low	32.4	Very low	161 Å²	161	130.1 Å²	130.1	86%	0.861	80%	0.8	S	S	*	*			trans	66.8	137	169.1	-51.3	-15.6	0	0	0	117.7
40	G	29.9	Very low	32.3	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	81%	0.805	S	S	*	*			cis	112.2	100.4	-20.1	0	0	0	0	0	117.8
41	N	29.6	Very low	32.2	Very low	168 Å²	168	129.4 Å²	129.4	90%	0.898	81%	0.808	S	S	*	*			trans	-172.5	166.4	131.6	-148.9	-1.9	0	0	0	114.2
42	K	32	Very low	32.2	Very low	178 Å²	178	130.1 Å²	130.1	77%	0.774	82%	0.815	S	S	*	*			trans	-82.9	169.6	159.1	-87.7	-177.1	177.1	-177.1	0	110.4
43	P	42.7	Very low	32.2	Very low	118 Å²	118	127.8 Å²	127.8	77%	0.766	81%	0.811	S	S	*	*			cis	-121.4	179	40.5	16.1	10.6	0	0	0	113.6
44	A	32.5	Very low	32	Very low	88 Å²	88	128.2 Å²	128.2	73%	0.727	81%	0.814	S	S	*	*			cis	88	150.9	25.3	0	0	0	0	0	116.8
45	E	29.1	Very low	32	Very low	196 Å²	196	134.1 Å²	134.1	92%	0.916	81%	0.811	S	S	*	*			trans	90.3	132.2	175	-56.8	-167	158.9	0	0	121
46	T	31.4	Very low	31.9	Very low	132 Å²	132	134.3 Å²	134.3	81%	0.81	81%	0.805	S	S	*	*			trans	-121	172.3	169.2	53.5	0	0	0	0	107.9
47	P	48.8	Very low	31.8	Very low	109 Å²	109	135 Å²	135	71%	0.708	80%	0.798	S	S	*	*			cis	-124.8	-149.7	-14.2	36.7	-16.3	0	0	0	110.4
48	P	37	Very low	31.8	Very low	125 Å²	125	139 Å²	139	81%	0.812	81%	0.805	S	S	*	*				-138.6	172.6	110.5	39	-29.1	0	0	0	115.4
49	K	34.4	Very low	31.9	Very low	186 Å²	186	138 Å²	138	81%	0.809	80%	0.802	S	S	*	*			trans	-123.7	171.9	170.6	-80.4	-172.5	176.1	-177.9	0	110.8
50	N	29.4	Very low	31.8	Very low	154 Å²	154	136.6 Å²	136.6	82%	0.824	80%	0.795	S	S	*	*			trans	95.5	124.3	175.6	-53.2	-14.2	0	0	0	113
51	A	28.7	Very low	32	Very low	105 Å²	105	141.6 Å²	141.6	87%	0.868	79%	0.794	S	S	*	*			cis	91.5	128.5	36	0	0	0	0	0	113.5
52	G	27.9	Very low	32.1	Very low	82 Å²	82	142.4 Å²	142.4	85%	0.845	79%	0.79	S	S	*	*			trans	151.7	80.6	178.9	0	0	0	0	0	115.7
53	D	33	Very low	32.3	Very low	132 Å²	132	143.2 Å²	143.2	71%	0.706	79%	0.793	S	S	*	*			trans	-39.7	144.2	160.8	172.1	32.7	0	0	0	115.4
54	F	27.1	Very low	31.6	Very low	210 Å²	210	143.6 Å²	143.6	92%	0.921	79%	0.794	S	S	*	*			trans	-158.1	156.3	151.1	-117.2	-76.6	0	0	0	113.9
55	R	28.8	Very low	31.4	Very low	205 Å²	205	145.4 Å²	145.4	77%	0.774	80%	0.796	S	S	*	*			trans	-112.1	163.1	-162.3	-52.8	166.4	163.4	174.4	-8.6	115.7
56	S	28.5	Very low	32.5	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	79%	0.792	S	S	*	*			trans	78.8	161.4	138.2	87.8	0	0	0	0	118.4
57	V	28.6	Very low	32.4	Very low	122 Å²	122	140.3 Å²	140.3	74%	0.739	79%	0.79	S	S	*	*			cis	-171.5	173.7	-14.9	126.5	0	0	0	0	109.8
58	L	27.6	Very low	31.4	Very low	148 Å²	148	139.6 Å²	139.6	78%	0.775	79%	0.793	S	S	*	*			trans	80.3	125.1	174.1	-69.1	140.3	0	0	0	116.6
59	A	33.1	Very low	31	Very low	87 Å²	87	139.9 Å²	139.9	72%	0.719	79%	0.793	S	S	*	*			cis	89.2	125.6	1.8	0	0	0	0	0	120.5
60	N	28.3	Very low	31.8	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	79%	0.788	S	S	*	*			trans	-176.6	143.7	156.1	-88.8	-40.3	0	0	0	109.9
61	K	33.4	Very low	31.7	Very low	182 Å²	182	135.8 Å²	135.8	79%	0.791	78%	0.781	S	S	*	*			cis	-148.9	-127.6	-18.8	-120	175.6	-175.9	81.4	0	108.9
62	K	31.1	Very low	31.7	Very low	185 Å²	185	137.7 Å²	137.7	80%	0.804	77%	0.77	S	S	*	*			cis	-161.8	48.7	-0.1	-156.8	-158.7	172.5	-176.4	0	115.9
63	K	35.9	Very low	31.6	Very low	195 Å²	195	141.2 Å²	141.2	85%	0.848	77%	0.77	S	S	*	*			trans	81.6	167.1	161.8	-51	-174.6	166.8	-168.8	0	118.5
64	T	28	Very low	31.3	Very low	126 Å²	126	138.2 Å²	138.2	77%	0.773	77%	0.77	S	S	*	*			cis	-149.8	168	15.4	-26.5	0	0	0	0	115.2
65	T	29.4	Very low	31.3	Very low	127 Å²	127	135.6 Å²	135.6	78%	0.779	76%	0.76	S	S	*	*			trans	-110.5	-163.2	-173	51	0	0	0	0	112.6
66	P	51.5	Low	31.2	Very low	126 Å²	126	133.6 Å²	133.6	82%	0.818	76%	0.757	S	S	*	*			cis	-120.1	-155.5	-10.1	42.4	-24.9	0	0	0	112.8
67	A	30.4	Very low	31.2	Very low	95 Å²	95	133.6 Å²	133.6	79%	0.785	75%	0.752	S	S	*	*			cis	-147.9	-154.2	6.3	0	0	0	0	0	109.5
68	A	27.7	Very low	31.1	Very low	93 Å²	93	134 Å²	134	77%	0.769	75%	0.75	S	S	*	*			cis	-160.8	-176.4	1.1	0	0	0	0	0	110.7
69	T	28.8	Very low	31	Very low	132 Å²	132	133.2 Å²	133.2	81%	0.81	75%	0.747	S	S	*	*			trans	-150.2	-178.3	172.3	62.6	0	0	0	0	110.2
70	P	50.8	Low	30.7	Very low	107 Å²	107	134.1 Å²	134.1	70%	0.695	75%	0.747	S	S	*	*			cis	-139	-151	-0	40.1	-16.5	0	0	0	115
71	E	26.9	Very low	30.7	Very low	146 Å²	146	134 Å²	134	68%	0.682	75%	0.75	S	S	*	*			trans	86.2	149.6	165.3	-52	-137.4	145.9	0	0	118.9
72	K	28.3	Very low	30.4	Very low	145 Å²	145	132.5 Å²	132.5	63%	0.63	75%	0.751	S	S	*	*			cis	-169.1	149.1	-22.7	-110.6	-177.6	-172.2	142	0	109.8
73	N	27	Very low	30.1	Very low	157 Å²	157	127.6 Å²	127.6	84%	0.84	75%	0.753	S	S	*	*			trans	57.1	160.7	155	-58	2.3	0	0	0	118
74	G	27	Very low	29.6	Very low	69 Å²	69	121.7 Å²	121.7	71%	0.711	75%	0.748	S	S	*	*			cis	179.6	142.3	-11.9	0	0	0	0	0	112.5
75	E	27.1	Very low	29.6	Very low	155 Å²	155	123.3 Å²	123.3	72%	0.724	75%	0.75	S	S	*	*			trans	29.8	140.6	147.9	-82.1	-158.5	126.7	0	0	124.1
76	K	26.4	Very low	29.6	Very low	162 Å²	162	125 Å²	125	70%	0.704	75%	0.749	S	S	*	*			trans	81	151	139.2	-75.3	167	177.4	143.3	0	120
77	V	27.4	Very low	28.5	Very low	113 Å²	113	125.1 Å²	125.1	69%	0.685	74%	0.742	S	S	*	*			cis	-176.7	152.5	-32.2	109	0	0	0	0	109.2
78	N	26.1	Very low	28.3	Very low	130 Å²	130	129.9 Å²	129.9	70%	0.695	75%	0.748	S	S	*	*			trans	64.3	158.1	167.7	-72.8	10.3	0	0	0	116.7
79	N	26.7	Very low	28.3	Very low	132 Å²	132	134.9 Å²	134.9	71%	0.706	75%	0.753	S	S	*	*			cis	-152.1	-176.3	-7	-122.9	6.4	0	0	0	111.9
80	C	26	Very low	28.3	Very low	106 Å²	106	133.7 Å²	133.7	72%	0.716	75%	0.75	S	S	*	*			trans	-39.4	161.8	168.9	-37.2	0	0	0	0	115.4
81	V	28.3	Very low	27.2	Very low	131 Å²	131	138 Å²	138	79%	0.794	76%	0.761	S	S	*	*				-161.5	163.8	81.5	150.6	0	0	0	0	112.2
82	D	26.9	Very low	27.4	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	77%	0.773	S	S	*	*			trans	-49.4	161.7	-175.3	-50.1	-89.5	0	0	0	119.7
83	G	25.7	Very low	27.4	Very low	82 Å²	82	132.4 Å²	132.4	85%	0.845	78%	0.783	S	S	*	*			trans	103.5	144.1	152.4	0	0	0	0	0	116.1
84	G	24.8	Very low	27.6	Very low	71 Å²	71	135.4 Å²	135.4	73%	0.732	79%	0.789	S	S	*	*			cis	151.4	120	-9.1	0	0	0	0	0	114.2
85	I	28.6	Very low	27.8	Very low	159 Å²	159	136.3 Å²	136.3	82%	0.815	80%	0.797	S	S	*	*			trans	72.6	142.2	155.2	-61.7	173.5	0	0	0	118.5
86	H	28.3	Very low	28	Very low	163 Å²	163	132.7 Å²	132.7	76%	0.755	80%	0.802	S	S	*	*			trans	81.7	126.9	161.1	-84.2	-42.9	0	0	0	123.6
87	D	29.5	Very low	28.5	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	82%	0.815	S	S	*	*			trans	-26.4	147.5	145.7	-41.2	-105.9	0	0	0	116.6
88	Q	25.6	Very low	28.7	Very low	194 Å²	194	133.1 Å²	133.1	91%	0.907	82%	0.82	S	S	*	*				-173.3	176	93.6	-94.9	-165.7	29.6	0	0	113.3
89	K	28.8	Very low	29.1	Very low	198 Å²	198	131.2 Å²	131.2	86%	0.861	83%	0.831	S	S	*	*			trans	-85.2	144.2	-170.9	-50.6	163.5	-177.6	170	0	113.5
90	S	28.3	Very low	29.5	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	83%	0.831	S	S	*	*			trans	-171	116.1	138.4	45.3	0	0	0	0	108.8
91	E	28	Very low	30.3	Very low	199 Å²	199	127.7 Å²	127.7	93%	0.93	84%	0.844	S	S	*	*				66.4	125.7	89	-70.7	-160.2	140.4	0	0	116.5
92	G	29.7	Very low	30.7	Very low	90 Å²	90	124.9 Å²	124.9	93%	0.928	84%	0.841	S	S	*	*			trans	101.9	65.6	136.9	0	0	0	0	0	119.9
93	G	29.1	Very low	31.4	Very low	82 Å²	82	121.6 Å²	121.6	85%	0.845	84%	0.842	S	S	*	*			trans	-134.1	116.6	164.9	0	0	0	0	0	112.8
94	K	32.2	Very low	32.3	Very low	221 Å²	221	121.5 Å²	121.5	96%	0.961	84%	0.842	S	S	*	*			trans	-109.2	143.1	178.1	-86.2	-170.4	174.8	-175.3	0	112.3
95	G	29.8	Very low	34	Very low	87 Å²	87	120.4 Å²	120.4	90%	0.897	83%	0.83	S	S	*	*			trans	125.1	119.1	148.3	0	0	0	0	0	115.5
96	G	31.2	Very low	36.1	Very low	80 Å²	80	116.3 Å²	116.3	83%	0.825	81%	0.813	S	S	*	*			trans	148.3	74.4	173.9	0	0	0	0	0	113.1
97	E	37.1	Very low	38.5	Very low	208 Å²	208	110.7 Å²	110.7	97%	0.972	80%	0.795	S	S	*	*			trans	-78.2	134.8	177.4	-68.2	179.8	123.7	0	0	112.2
98	G	33	Very low	41.2	Very low	76 Å²	76	105 Å²	105	78%	0.784	76%	0.764	S	S	*	*			trans	-145.1	84.9	170.4	0	0	0	0	0	109.3	G100	G98-G100 PolarHBondContact O-N 3.07Å; G98-G100 VanDerWaalsContact O-N 3.14Å
99	G	34.6	Very low	44.1	Very low	90 Å²	90	101.7 Å²	101.7	93%	0.928	75%	0.749	S	S	*	*			trans	-74.1	100.6	-166.1	0	0	0	0	0	115
100	G	34.9	Very low	46.9	Very low	69 Å²	69	92.7 Å²	92.7	71%	0.711	71%	0.71	S	S	*	*			trans	-100	137.4	150.3	0	0	0	0	0	109.5	G98 G102	G98-G100 PolarHBondContact O-N 3.07Å; G98-G100 VanDerWaalsContact O-N 3.14Å; G100-G102 PolarHBondContact O-N 2.85Å
101	G	41.8	Very low	49.8	Very low	95 Å²	95	91.9 Å²	91.9	98%	0.979	70%	0.7	S	S	*	*			trans	-71.3	97.6	-171.8	0	0	0	0	0	113.9
102	G	36.8	Very low	52.6	Low	71 Å²	71	87.3 Å²	87.3	73%	0.732	68%	0.679	S	S	*	*			trans	-89.9	137.3	166.4	0	0	0	0	0	111.7	G100 G104	G100-G102 PolarHBondContact O-N 2.85Å; G102-G104 PolarHBondContact O-N 2.92Å
103	G	41.1	Very low	55.4	Low	82 Å²	82	89 Å²	89	85%	0.845	66%	0.661	S	S	*	*			trans	-68.9	126	171	0	0	0	0	0	110.8	G105	G103-G105 PolarHBondContact O-N 3Å; G103-G105 VanDerWaalsContact O-N 3.11Å
104	G	45.3	Very low	58.3	Low	81 Å²	81	85.8 Å²	85.8	84%	0.835	62%	0.624	S	S	*	*			trans	-72.6	100.9	176.1	0	0	0	0	0	111.1	G102	G102-G104 PolarHBondContact O-N 2.92Å
105	G	60.2	Low	60.8	Low	47 Å²	47	83.4 Å²	83.4	49%	0.485	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-62.4	144.2	172.2	0	0	0	0	0	111.8	G103 A188	G103-G105 PolarHBondContact O-N 3Å; G103-G105 VanDerWaalsContact O-N 3.11Å; G105-A188 WeakPolarHBondContact O-CB 3.26Å
106	T	73.8	Confident	63.4	Low	73 Å²	73	85 Å²	85	45%	0.448	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-85.1	136.7	174.2	-43	0	0	0	0	109.3	A134 A135 N186	T106-A134 PolarHBondContact OG1-O 3.11Å; T106-A135 WeakPolarHBondContact O-CB 3.11Å; T106-N186 PolarHBondContact O-ND2 3.35Å
107	A	78.9	Confident	65.9	Low	46 Å²	46	83.4 Å²	83.4	38%	0.38	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-60.8	143.4	172.1	0	0	0	0	0	110.6	A188	A107-A188 HydrophobicContact CB-CB 4.3Å
108	P	85.4	Confident	68	Low	8 Å²	8	77.4 Å²	77.4	5%	0.052	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-67.8	138.8	-179.2	27.4	-33.5	0	0	0	111.1	L131 V139 A184 N186 G189 A191	P108-L131 HydrophobicContact CB-CD2 4.03Å; P108-V139 HydrophobicContact CB-CG2 4.17Å; P108-A184 HydrophobicContact CB-CB 3.97Å; P108-A184 HydrophobicContact CG-CB 4.32Å; P108-A184 WeakPolarHBondContact CG-O 3.25Å; P108-N186 WeakPolarHBondContact CD-OD1 3.38Å; P108-G189 VanDerWaalsContact CD-O 3.3Å; P108-G189 WeakPolarHBondContact CD-O 3.47Å; P108-A191 WeakPolarHBondContact O-CB 3.42Å
109	E	86.3	Confident	70.3	Confident	126 Å²	126	74.5 Å²	74.5	59%	0.589	52%	0.521	S	S	*	.			trans	-136.8	133.5	172.2	-179.4	172.4	-156.1	0	0	109.7	V111 L131 A132	E109-V111 PolarHBondContact O-N 3.07Å; E109-L131 CarbonylContact O-C 3.57Å; E109-L131 WeakPolarHBondContact O-CA 3.08Å; E109-A132 PolarHBondContact O-N 2.91Å
110	F	87.9	Confident	72.1	Confident	8 Å²	8	72.9 Å²	72.9	4%	0.035	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	104.6	175.4	-70	-73	0	0	0	111.1	K113 C129 R130 L131 C182 A184 A191 C193	F110-K113 HydrophobicContact CB-CG 3.76Å; F110-K113 WeakPolarHBondContact O-CE 3.29Å; F110-C129 HydrophobicContact CD1-CB 4.01Å; F110-C129 HydrophobicContact CE1-CB 4.23Å; F110-C129 VanDerWaalsContact CE1-SG 3.53Å; F110-R130 CarbonylContact C-O 3.5Å; F110-R130 VanDerWaalsContact CA-O 3.32Å; F110-R130 WeakPolarHBondContact CA-O 3.42Å; F110-L131 HydrophobicContact CD1-CD2 3.63Å; F110-L131 HydrophobicContact CD1-CG 4.21Å; F110-L131 HydrophobicContact CD2-CD2 4.46Å; F110-L131 HydrophobicContact CE1-CD2 3.55Å; F110-L131 HydrophobicContact CE1-CG 4.01Å; F110-L131 HydrophobicContact CE2-CD2 4.4Å; F110-L131 HydrophobicContact CG-CD2 4.1Å; F110-L131 HydrophobicContact CZ-CD2 3.95Å; F110-C182 HydrophobicContact CZ-CB 4.39Å; F110-A184 HydrophobicContact CE1-CB 4.39Å; F110-A184 HydrophobicContact CE2-CB 4.09Å; F110-A184 HydrophobicContact CZ-CB 3.64Å; F110-A191 HydrophobicContact CD2-CB 4Å; F110-A191 HydrophobicContact CE2-CB 4.09Å; F110-C193 HydrophobicContact CD2-CB 4.04Å; F110-C193 HydrophobicContact CE2-CB 4.46Å; F110-C193 HydrophobicContact CG-CB 4.35Å
111	V	88.5	Confident	74.1	Confident	90 Å²	90	72.3 Å²	72.3	55%	0.545	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-30.5	174.8	-64	0	0	0	0	112.1	E109 R130 A132	E109-V111 PolarHBondContact O-N 3.07Å; V111-R130 HydrophobicContact CG2-CB 4.17Å; V111-R130 HydrophobicContact CG2-CG 4.16Å; V111-R130 WeakPolarHBondContact CG2-O 3.46Å; V111-R130 PolarHBondContact N-O 3.4Å; V111-A132 HydrophobicContact CG1-CB 3.91Å
112	E	87.2	Confident	75	Confident	103 Å²	103	69.6 Å²	69.6	48%	0.481	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.1	165	-55.9	-176.2	121.8	0	0	107.4	C129 R130	E112-C129 CarbonylContact O-C 3.54Å; E112-C129 WeakPolarHBondContact O-CA 3.3Å; E112-C129 VanDerWaalsContact O-CB 3.27Å; E112-C129 WeakPolarHBondContact O-CB 3.31Å; E112-R130 HydrophobicContact CB-CB 3.79Å; E112-R130 HydrophobicContact CG-CB 4.01Å; E112-R130 PolarHBondContact N-O 2.97Å; E112-R130 PolarHBondContact O-N 2.62Å; E112-R130 WeakPolarHBondContact OE2-CB 3.48Å; E112-R130 WeakPolarHBondContact OE2-CD 3.32Å; E112-R130 IonicContact OE2-CZ 2.66Å; E112-R130 IonicContact OE2-NE 2.78Å; E112-R130 PolarHBondContact OE2-NE 2.95Å; E112-R130 IonicContact OE2-NH2 2.73Å
113	K	89.4	Confident	76.6	Confident	126 Å²	126	71.2 Å²	71.2	55%	0.548	43%	0.431	S	S	.	.			trans	-100.6	156.9	-178.6	-67.7	178.1	-177	178.5	0	110.5	F110 C193	F110-K113 HydrophobicContact CB-CG 3.76Å; F110-K113 WeakPolarHBondContact O-CE 3.29Å; K113-C193 HydrophobicContact CB-CB 4.11Å; K113-C193 HydrophobicContact CD-CB 4.37Å; K113-C193 HydrophobicContact CG-CB 3.99Å
114	L	89.1	Confident	78.4	Confident	15 Å²	15	75 Å²	75	8%	0.079	42%	0.42	C	S	.	.			trans	-52.9	152.8	171.4	-61.2	174.6	0	0	0	111.3	L127 C129 W143 C182 C195	L114-L127 HydrophobicContact CD2-CB 4.17Å; L114-C129 HydrophobicContact CD2-CB 3.83Å; L114-C129 HydrophobicContact CG-CB 4.01Å; L114-W143 HydrophobicContact CD1-CH2 4.34Å; L114-W143 HydrophobicContact CD1-CZ3 3.85Å; L114-W143 HydrophobicContact CD2-CH2 3.68Å; L114-W143 HydrophobicContact CD2-CZ3 3.91Å; L114-C182 HydrophobicContact CD1-CB 3.96Å; L114-C195 HydrophobicContact CB-CB 3.77Å
115	K	85.4	Confident	80.2	Confident	170 Å²	170	71.2 Å²	71.2	74%	0.739	38%	0.381	S	S	*	.			trans	-131.9	151.2	179	-61.3	170.7	-171.4	163.4	0	107.9	C195	K115-C195 VanDerWaalsContact C-CB 3.41Å; K115-C195 WeakPolarHBondContact O-CB 3.36Å
116	D	84.2	Confident	81.6	Confident	122 Å²	122	74.6 Å²	74.6	65%	0.652	38%	0.379	S	S	*	.			trans	-67	141.5	179.3	-50.6	-35.1	0	0	0	110.7	C195 M196	D116-C195 VanDerWaalsContact OD1-CA 3.3Å; D116-C195 WeakPolarHBondContact OD1-CA 3.2Å; D116-M196 CarbonylContact C-O 3.5Å; D116-M196 WeakPolarHBondContact CA-O 3.3Å; D116-M196 HydrophobicContact CB-CB 4.38Å; D116-M196 PolarHBondContact OD1-N 3.1Å
117	V	84.1	Confident	82.3	Confident	45 Å²	45	71.3 Å²	71.3	27%	0.273	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130.9	-175	-179.4	0	0	0	0	110.1	L125 L127 M196 V197 L198	V117-L125 HydrophobicContact CB-CD1 4.19Å; V117-L125 HydrophobicContact CG1-CD1 3.76Å; V117-L127 HydrophobicContact CB-CD2 4.39Å; V117-L127 HydrophobicContact CG2-CD2 3.85Å; V117-M196 PolarHBondContact N-O 2.87Å; V117-V197 VanDerWaalsContact O-CA 3.31Å; V117-V197 WeakPolarHBondContact O-CA 3.45Å; V117-L198 PolarHBondContact O-N 3.08Å
118	T	81	Confident	82.9	Confident	83 Å²	83	73.1 Å²	73.1	51%	0.509	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.7	162.9	-52.8	0	0	0	0	108.4	L198 D200	T118-L198 WeakPolarHBondContact CA-O 3.24Å; T118-L198 HydrophobicContact CG2-CB 4.31Å; T118-D200 HydrophobicContact CG2-CB 4.26Å; T118-D200 VanDerWaalsContact CG2-OD2 3.26Å; T118-D200 WeakPolarHBondContact CG2-OD2 3.36Å
119	V	79.8	Confident	82.9	Confident	14 Å²	14	72.8 Å²	72.8	9%	0.085	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.6	178.4	63.5	0	0	0	0	108.4	Q123 L125 A172 L198 V199 D200	V119-Q123 HydrophobicContact CG2-CB 3.76Å; V119-L125 HydrophobicContact CG1-CB 4.43Å; V119-L125 HydrophobicContact CG1-CD1 4.28Å; V119-A172 HydrophobicContact CG1-CB 3.69Å; V119-A172 HydrophobicContact CG2-CB 4.37Å; V119-L198 PolarHBondContact N-O 2.84Å; V119-V199 HydrophobicContact CG1-CG2 3.9Å; V119-V199 CarbonylContact O-C 3.47Å; V119-V199 WeakPolarHBondContact O-CA 3.46Å; V119-D200 PolarHBondContact O-N 2.96Å
120	L	72.8	Confident	83	Confident	57 Å²	57	71.1 Å²	71.1	30%	0.298	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	147.6	172.6	-63.6	177.1	0	0	0	110.3	G122 Q123 D200	L120-G122 PolarHBondContact O-N 3.11Å; L120-Q123 HydrophobicContact CB-CG 4.12Å; L120-Q123 WeakPolarHBondContact O-CB 3.46Å; L120-Q123 PolarHBondContact O-N 3.28Å; L120-D200 VanDerWaalsContact CA-O 3.31Å; L120-D200 WeakPolarHBondContact CA-O 3.43Å; L120-D200 HydrophobicContact CD2-CB 3.76Å
121	D	77.6	Confident	82.8	Confident	57 Å²	57	71 Å²	71	31%	0.305	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	133.9	174.8	-177.6	27.4	0	0	0	111.5	Q123 L173 V199 D200	D121-Q123 VanDerWaalsContact C-N 3.32Å; D121-Q123 PolarHBondContact O-N 2.91Å; D121-L173 WeakPolarHBondContact OD1-CD2 3.11Å; D121-V199 HydrophobicContact CB-CG1 4.14Å; D121-D200 PolarHBondContact N-O 3.32Å
122	G	60.6	Low	82.4	Confident	37 Å²	37	68 Å²	68	38%	0.381	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-2.5	-176.5	0	0	0	0	0	116.1	L120 A172	L120-G122 PolarHBondContact O-N 3.11Å; G122-A172 PolarHBondContact N-O 2.88Å
123	Q	70.6	Confident	81	Confident	106 Å²	106	68.5 Å²	68.5	50%	0.495	34%	0.344	S	S	.	.	S	Bend	trans	-92.5	153.6	177.3	-62.8	-168.8	-4	0	0	113.4	V119 L120 D121 L125 A172	V119-Q123 HydrophobicContact CG2-CB 3.76Å; L120-Q123 HydrophobicContact CB-CG 4.12Å; L120-Q123 WeakPolarHBondContact O-CB 3.46Å; L120-Q123 PolarHBondContact O-N 3.28Å; D121-Q123 VanDerWaalsContact C-N 3.32Å; D121-Q123 PolarHBondContact O-N 2.91Å; Q123-L125 PolarHBondContact O-N 2.79Å; Q123-A172 WeakPolarHBondContact O-CB 3.43Å; Q123-A172 PolarHBondContact O-N 2.95Å
124	R	78.6	Confident	79.4	Confident	160 Å²	160	66 Å²	66	60%	0.604	35%	0.347	S	S	*	.			trans	-70.3	110.6	179.8	-176.7	-179.9	-81.4	-176	-3.9	112	T168 I169 D170	R124-T168 HydrophobicContact CG-CG2 3.73Å; R124-I169 CarbonylContact C-O 3.53Å; R124-I169 VanDerWaalsContact CA-O 3.3Å; R124-I169 WeakPolarHBondContact CA-O 3.49Å; R124-I169 WeakPolarHBondContact CG-O 3.22Å; R124-D170 VanDerWaalsContact CA-O 3.25Å; R124-D170 WeakPolarHBondContact CA-O 3.48Å; R124-D170 WeakPolarHBondContact CB-O 3.3Å; R124-D170 IonicContact CZ-OD1 2.79Å; R124-D170 PolarHBondContact N-O 3.45Å; R124-D170 IonicContact NE-OD1 2.72Å; R124-D170 PolarHBondContact NE-OD1 2.84Å; R124-D170 IonicContact NH2-OD1 3.27Å; R124-D170 PolarHBondContact NH2-OD1 2.93Å
125	L	82.6	Confident	77.8	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	139.9	170	172.6	69	0	0	0	110.5	V117 V119 Q123 L127 T168 I169 A172 Y180 V197	V117-L125 HydrophobicContact CB-CD1 4.19Å; V117-L125 HydrophobicContact CG1-CD1 3.76Å; V119-L125 HydrophobicContact CG1-CB 4.43Å; V119-L125 HydrophobicContact CG1-CD1 4.28Å; Q123-L125 PolarHBondContact O-N 2.79Å; L125-L127 HydrophobicContact CD1-CD2 4.06Å; L125-L127 HydrophobicContact CD1-CG 4.48Å; L125-L127 HydrophobicContact CG-CG 4.47Å; L125-T168 CarbonylContact O-C 3.48Å; L125-T168 WeakPolarHBondContact O-CA 3.26Å; L125-T168 WeakPolarHBondContact O-CG2 3.43Å; L125-I169 HydrophobicContact CB-CB 4.3Å; L125-I169 HydrophobicContact CD2-CD1 4.15Å; L125-I169 HydrophobicContact CD2-CG1 4.28Å; L125-I169 PolarHBondContact N-O 2.82Å; L125-I169 PolarHBondContact O-N 3.45Å; L125-A172 HydrophobicContact CB-CB 3.86Å; L125-Y180 HydrophobicContact CD2-CE2 4.41Å; L125-V197 HydrophobicContact CD1-CG1 4.07Å; L125-V197 HydrophobicContact CD1-CG2 4.11Å; L125-V197 HydrophobicContact CD2-CG1 3.78Å; L125-V197 HydrophobicContact CD2-CG2 4.11Å
126	R	90.5	Very high	76.3	Confident	119 Å²	119	59.1 Å²	59.1	45%	0.449	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	118.8	175	-166.6	159.2	-175	-87.1	-14.9	111.9	E128 L167 T168	R126-E128 HydrophobicContact CG-CG 4.48Å; R126-E128 IonicContact CZ-OE1 3.8Å; R126-E128 IonicContact NH1-OE1 2.78Å; R126-E128 PolarHBondContact NH1-OE1 2.87Å; R126-E128 IonicContact NH1-OE2 3.47Å; R126-E128 PolarHBondContact NH1-OE2 2.62Å; R126-E128 IonicContact NH2-OE1 3.3Å; R126-E128 PolarHBondContact NH2-OE1 3.37Å; R126-L167 WeakPolarHBondContact CA-O 3.07Å; R126-T168 HydrophobicContact CB-CG2 4.29Å; R126-T168 HydrophobicContact CG-CG2 4.22Å; R126-T168 PolarHBondContact NE-OG1 3.23Å
127	L	87.2	Confident	75	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.6	178.9	-57.9	-177	0	0	0	109.5	L114 V117 L125 W143 S166 L167 Y180 V197	L114-L127 HydrophobicContact CD2-CB 4.17Å; V117-L127 HydrophobicContact CB-CD2 4.39Å; V117-L127 HydrophobicContact CG2-CD2 3.85Å; L125-L127 HydrophobicContact CD1-CD2 4.06Å; L125-L127 HydrophobicContact CD1-CG 4.48Å; L125-L127 HydrophobicContact CG-CG 4.47Å; L127-W143 HydrophobicContact CB-CH2 3.92Å; L127-W143 HydrophobicContact CB-CZ3 3.92Å; L127-W143 HydrophobicContact CD1-CZ3 4.1Å; L127-S166 CarbonylContact O-C 3.53Å; L127-S166 WeakPolarHBondContact O-CA 3.44Å; L127-S166 WeakPolarHBondContact O-CB 3.47Å; L127-L167 HydrophobicContact CB-CB 4.43Å; L127-L167 HydrophobicContact CD1-CD2 4.27Å; L127-L167 HydrophobicContact CG-CD2 4.5Å; L127-L167 PolarHBondContact N-O 3.13Å; L127-L167 PolarHBondContact O-N 2.72Å; L127-Y180 HydrophobicContact CD1-CD1 3.8Å; L127-Y180 HydrophobicContact CD1-CD2 3.85Å; L127-Y180 HydrophobicContact CD1-CE1 4.44Å; L127-Y180 HydrophobicContact CD1-CE2 4.45Å; L127-Y180 HydrophobicContact CD1-CG 3.47Å; L127-Y180 VanDerWaalsContact CD1-CG 3.47Å; L127-V197 HydrophobicContact CD1-CG2 4.09Å; L127-V197 HydrophobicContact CD2-CG2 3.92Å
128	E	92.1	Very high	74	Confident	84 Å²	84	62 Å²	62	39%	0.393	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.2	-178.8	-66.4	-168.5	121	0	0	112.1	R126 L164	R126-E128 HydrophobicContact CG-CG 4.48Å; R126-E128 IonicContact CZ-OE1 3.8Å; R126-E128 IonicContact NH1-OE1 2.78Å; R126-E128 PolarHBondContact NH1-OE1 2.87Å; R126-E128 IonicContact NH1-OE2 3.47Å; R126-E128 PolarHBondContact NH1-OE2 2.62Å; R126-E128 IonicContact NH2-OE1 3.3Å; R126-E128 PolarHBondContact NH2-OE1 3.37Å; E128-L164 HydrophobicContact CB-CD1 4.21Å; E128-L164 HydrophobicContact CG-CD1 4.46Å
129	C	85.4	Confident	73.7	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.1	168.9	56.5	0	0	0	0	110.3	F110 E112 L114 C165 C182	F110-C129 HydrophobicContact CD1-CB 4.01Å; F110-C129 HydrophobicContact CE1-CB 4.23Å; F110-C129 VanDerWaalsContact CE1-SG 3.53Å; E112-C129 CarbonylContact O-C 3.54Å; E112-C129 WeakPolarHBondContact O-CA 3.3Å; E112-C129 VanDerWaalsContact O-CB 3.27Å; E112-C129 WeakPolarHBondContact O-CB 3.31Å; L114-C129 HydrophobicContact CD2-CB 3.83Å; L114-C129 HydrophobicContact CG-CB 4.01Å; C129-C165 PolarHBondContact N-O 2.82Å; C129-C165 PolarHBondContact O-N 3Å; C129-C165 VanDerWaalsContact O-O 3.07Å; C129-C182 VanDerWaalsContact SG-SG 3.62Å
130	R	88.5	Confident	73.9	Confident	91 Å²	91	62.6 Å²	62.6	34%	0.343	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.8	-173.3	-167	-179.6	-57.5	-76.9	-8.8	112.2	F110 V111 E112 G163	F110-R130 CarbonylContact C-O 3.5Å; F110-R130 VanDerWaalsContact CA-O 3.32Å; F110-R130 WeakPolarHBondContact CA-O 3.42Å; V111-R130 HydrophobicContact CG2-CB 4.17Å; V111-R130 HydrophobicContact CG2-CG 4.16Å; V111-R130 WeakPolarHBondContact CG2-O 3.46Å; V111-R130 PolarHBondContact N-O 3.4Å; E112-R130 HydrophobicContact CB-CB 3.79Å; E112-R130 HydrophobicContact CG-CB 4.01Å; E112-R130 PolarHBondContact N-O 2.97Å; E112-R130 PolarHBondContact O-N 2.62Å; E112-R130 WeakPolarHBondContact OE2-CB 3.48Å; E112-R130 WeakPolarHBondContact OE2-CD 3.32Å; E112-R130 IonicContact OE2-CZ 2.66Å; E112-R130 IonicContact OE2-NE 2.78Å; E112-R130 PolarHBondContact OE2-NE 2.95Å; E112-R130 IonicContact OE2-NH2 2.73Å; R130-G163 CarbonylContact C-O 3.5Å; R130-G163 WeakPolarHBondContact CA-O 3.36Å; R130-G163 WeakPolarHBondContact CG-O 3.27Å
131	L	84.4	Confident	74.6	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	152.5	174.5	-67.7	171	0	0	0	112.2	P108 E109 F110 S133 V139 V141 G163 A184	P108-L131 HydrophobicContact CB-CD2 4.03Å; E109-L131 CarbonylContact O-C 3.57Å; E109-L131 WeakPolarHBondContact O-CA 3.08Å; F110-L131 HydrophobicContact CD1-CD2 3.63Å; F110-L131 HydrophobicContact CD1-CG 4.21Å; F110-L131 HydrophobicContact CD2-CD2 4.46Å; F110-L131 HydrophobicContact CE1-CD2 3.55Å; F110-L131 HydrophobicContact CE1-CG 4.01Å; F110-L131 HydrophobicContact CE2-CD2 4.4Å; F110-L131 HydrophobicContact CG-CD2 4.1Å; F110-L131 HydrophobicContact CZ-CD2 3.95Å; L131-S133 PolarHBondContact O-N 3.34Å; L131-V139 HydrophobicContact CD1-CB 4.44Å; L131-V139 HydrophobicContact CD1-CG1 3.75Å; L131-V141 HydrophobicContact CD1-CG2 4.47Å; L131-G163 PolarHBondContact N-O 2.8Å; L131-A184 HydrophobicContact CD1-CB 4.01Å; L131-A184 HydrophobicContact CD2-CB 3.72Å; L131-A184 HydrophobicContact CG-CB 4.45Å
132	A	79.6	Confident	75.1	Confident	26 Å²	26	61.4 Å²	61.4	22%	0.215	35%	0.351	C	S	.	.			trans	-60.2	128.7	170.7	0	0	0	0	0	111.2	E109 V111 A134 A135	E109-A132 PolarHBondContact O-N 2.91Å; V111-A132 HydrophobicContact CG1-CB 3.91Å; A132-A134 PolarHBondContact O-N 2.93Å; A132-A135 PolarHBondContact O-N 3.38Å
133	S	58.3	Low	76.7	Confident	113 Å²	113	59.8 Å²	59.8	79%	0.79	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.2	-172.6	-173	0	0	0	0	115.5	L131 A135	L131-S133 PolarHBondContact O-N 3.34Å; S133-A135 VanDerWaalsContact C-N 3.32Å
134	A	56	Low	77.6	Confident	74 Å²	74	56.1 Å²	56.1	61%	0.612	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-3.5	178.4	0	0	0	0	0	114.4	T106 A132	T106-A134 PolarHBondContact OG1-O 3.11Å; A132-A134 PolarHBondContact O-N 2.93Å
135	A	54.1	Low	78.3	Confident	8 Å²	8	49.9 Å²	49.9	7%	0.066	30%	0.297	C	S	.	.	S	Bend	trans	-118.2	-9	-178.9	0	0	0	0	0	114.1	T106 A132 S133 A137 V139	T106-A135 WeakPolarHBondContact O-CB 3.11Å; A132-A135 PolarHBondContact O-N 3.38Å; S133-A135 VanDerWaalsContact C-N 3.32Å; A135-A137 VanDerWaalsContact C-N 3.31Å; A135-A137 PolarHBondContact O-N 2.89Å; A135-A137 VanDerWaalsContact O-N 3.12Å; A135-V139 HydrophobicContact CB-CG2 4.41Å; A135-V139 WeakPolarHBondContact O-CG2 3.4Å
136	A	54.4	Low	78.5	Confident	33 Å²	33	55.1 Å²	55.1	27%	0.273	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-4.8	-159.3	0	0	0	0	0	117.2
137	A	57.3	Low	77.7	Confident	91 Å²	91	52.5 Å²	52.5	75%	0.752	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-39.4	-175.2	0	0	0	0	0	113.9	A135	A135-A137 VanDerWaalsContact C-N 3.31Å; A135-A137 PolarHBondContact O-N 2.89Å; A135-A137 VanDerWaalsContact O-N 3.12Å
138	D	62.9	Low	77.3	Confident	136 Å²	136	60.2 Å²	60.2	73%	0.727	37%	0.368	S	S	*	.	S	Bend	trans	-126.3	36.1	-168.8	-57.7	-66.2	0	0	0	112.2	N186	D138-N186 VanDerWaalsContact O-CB 3.24Å; D138-N186 WeakPolarHBondContact O-CB 3.17Å
139	V	74.9	Confident	76.9	Confident	14 Å²	14	61.1 Å²	61.1	9%	0.085	38%	0.38	C	S	.	.			trans	-105.8	119.3	-177.1	167.7	0	0	0	0	111.7	P108 L131 A135 V141 N160 A184 N186	P108-V139 HydrophobicContact CB-CG2 4.17Å; L131-V139 HydrophobicContact CD1-CB 4.44Å; L131-V139 HydrophobicContact CD1-CG1 3.75Å; A135-V139 HydrophobicContact CB-CG2 4.41Å; A135-V139 WeakPolarHBondContact O-CG2 3.4Å; V139-V141 HydrophobicContact CG1-CG2 4.01Å; V139-N160 PolarHBondContact O-ND2 2.79Å; V139-A184 HydrophobicContact CG1-CB 3.76Å; V139-N186 HydrophobicContact CG2-CB 3.87Å; V139-N186 WeakPolarHBondContact CG2-ND2 3.47Å
140	T	83.4	Confident	76.8	Confident	96 Å²	96	62 Å²	62	59%	0.589	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	129.8	167.2	-59.2	0	0	0	0	109.2	T142 A184 E185	T140-T142 HydrophobicContact CG2-CG2 4.4Å; T140-A184 WeakPolarHBondContact O-CA 3.48Å; T140-E185 PolarHBondContact N-O 2.85Å; T140-E185 PolarHBondContact O-N 3.26Å
141	V	88.1	Confident	76.3	Confident	31 Å²	31	65 Å²	65	19%	0.188	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134	176.3	178	0	0	0	0	109.6	L131 V139 N160 C165 C182 R183 A184	L131-V141 HydrophobicContact CD1-CG2 4.47Å; V139-V141 HydrophobicContact CG1-CG2 4.01Å; V141-N160 HydrophobicContact CB-CB 4.44Å; V141-N160 HydrophobicContact CG2-CB 4.25Å; V141-N160 WeakPolarHBondContact CG2-ND2 3.49Å; V141-C165 HydrophobicContact CG1-CB 4.16Å; V141-C182 VanDerWaalsContact CG1-SG 3.6Å; V141-R183 CarbonylContact C-O 3.53Å; V141-R183 WeakPolarHBondContact CA-O 3.31Å; V141-A184 HydrophobicContact CG2-CB 4.46Å
142	T	88.8	Confident	75.5	Confident	57 Å²	57	69.2 Å²	69.2	35%	0.35	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.9	179.2	49.3	0	0	0	0	110.1	T140 R183	T140-T142 HydrophobicContact CG2-CG2 4.4Å; T142-R183 PolarHBondContact N-O 2.88Å; T142-R183 PolarHBondContact O-N 2.93Å; T142-R183 PolarHBondContact OG1-O 2.94Å
143	W	94.2	Very high	74.9	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.015	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.9	179.2	-69.7	82.8	0	0	0	110.5	L114 L127 V150 L158 C165 L167 K181 C182	L114-W143 HydrophobicContact CD1-CH2 4.34Å; L114-W143 HydrophobicContact CD1-CZ3 3.85Å; L114-W143 HydrophobicContact CD2-CH2 3.68Å; L114-W143 HydrophobicContact CD2-CZ3 3.91Å; L127-W143 HydrophobicContact CB-CH2 3.92Å; L127-W143 HydrophobicContact CB-CZ3 3.92Å; L127-W143 HydrophobicContact CD1-CZ3 4.1Å; W143-V150 HydrophobicContact CB-CB 4.19Å; W143-V150 PolarHBondContact O-N 2.87Å; W143-L158 HydrophobicContact CG-CD2 4.27Å; W143-C165 HydrophobicContact CZ2-CB 4.46Å; W143-L167 HydrophobicContact CB-CD1 3.92Å; W143-L167 HydrophobicContact CD2-CB 3.8Å; W143-L167 HydrophobicContact CD2-CD1 3.73Å; W143-L167 HydrophobicContact CD2-CG 4.44Å; W143-L167 HydrophobicContact CE3-CB 3.84Å; W143-L167 HydrophobicContact CE3-CD1 3.6Å; W143-L167 HydrophobicContact CE3-CG 4.38Å; W143-L167 HydrophobicContact CG-CB 4.45Å; W143-L167 HydrophobicContact CG-CD1 3.9Å; W143-L167 HydrophobicContact CH2-CB 3.79Å; W143-L167 HydrophobicContact CZ2-CB 3.8Å; W143-L167 HydrophobicContact CZ3-CB 3.83Å; W143-L167 HydrophobicContact CZ3-CD1 4.26Å; W143-K181 CarbonylContact C-O 3.41Å; W143-K181 VanDerWaalsContact CA-O 3.27Å; W143-K181 WeakPolarHBondContact CA-O 2.82Å; W143-C182 HydrophobicContact CD2-CB 3.93Å; W143-C182 HydrophobicContact CE3-CB 3.86Å; W143-C182 HydrophobicContact CH2-CB 3.98Å; W143-C182 HydrophobicContact CZ2-CB 3.97Å; W143-C182 HydrophobicContact CZ3-CB 3.9Å
144	T	88.8	Confident	74.4	Confident	28 Å²	28	70.9 Å²	70.9	17%	0.172	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.3	171.7	67.8	0	0	0	0	111.6	K148 Y180 K181	T144-K148 CarbonylContact C-O 3.59Å; T144-K148 WeakPolarHBondContact CA-O 3.45Å; T144-K148 VanDerWaalsContact CB-O 3.23Å; T144-K148 WeakPolarHBondContact CB-O 3.31Å; T144-Y180 CarbonylContact O-C 3.58Å; T144-Y180 WeakPolarHBondContact O-CA 3.05Å; T144-K181 PolarHBondContact N-O 2.82Å; T144-K181 PolarHBondContact O-N 3.43Å
145	L	92.5	Very high	74.7	Confident	30 Å²	30	72.6 Å²	72.6	16%	0.157	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.5	165.4	171.2	57.7	0	0	0	107.5	G147 K148 V150 Y180	L145-G147 PolarHBondContact O-N 2.92Å; L145-K148 PolarHBondContact N-O 2.99Å; L145-K148 WeakPolarHBondContact O-CB 3.45Å; L145-K148 PolarHBondContact O-N 2.83Å; L145-V150 HydrophobicContact CB-CG2 3.92Å; L145-Y180 HydrophobicContact CB-CD1 4.32Å; L145-Y180 HydrophobicContact CB-CE1 4.07Å; L145-Y180 HydrophobicContact CD1-CD2 3.97Å; L145-Y180 HydrophobicContact CD1-CE1 4.44Å; L145-Y180 HydrophobicContact CD1-CE2 3.74Å; L145-Y180 HydrophobicContact CD1-CG 4.44Å
146	D	86.3	Confident	75.4	Confident	112 Å²	112	73.7 Å²	73.7	60%	0.599	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	35.7	-177.8	-72.5	-3.3	0	0	0	114.1	K148 Q179	D146-K148 VanDerWaalsContact C-N 3.32Å; D146-K148 PolarHBondContact O-N 3.1Å; D146-Q179 PolarHBondContact N-O 2.91Å; D146-Q179 WeakPolarHBondContact OD1-CB 3.39Å; D146-Q179 PolarHBondContact OD1-N 2.78Å
147	G	73.9	Confident	76.5	Confident	63 Å²	63	76.9 Å²	76.9	65%	0.649	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-6.5	-179.3	0	0	0	0	0	115.9	L145	L145-G147 PolarHBondContact O-N 2.92Å
148	K	80.6	Confident	77.6	Confident	166 Å²	166	74.9 Å²	74.9	72%	0.722	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.4	170.5	-60.6	174.7	-175.2	168.1	0	110.2	T144 L145 D146 V150	T144-K148 CarbonylContact C-O 3.59Å; T144-K148 WeakPolarHBondContact CA-O 3.45Å; T144-K148 VanDerWaalsContact CB-O 3.23Å; T144-K148 WeakPolarHBondContact CB-O 3.31Å; L145-K148 PolarHBondContact N-O 2.99Å; L145-K148 WeakPolarHBondContact O-CB 3.45Å; L145-K148 PolarHBondContact O-N 2.83Å; D146-K148 VanDerWaalsContact C-N 3.32Å; D146-K148 PolarHBondContact O-N 3.1Å; K148-V150 PolarHBondContact O-N 2.68Å
149	T	83.1	Confident	78.3	Confident	103 Å²	103	70.1 Å²	70.1	63%	0.632	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	123.7	178.1	-51.5	0	0	0	0	111.8
150	V	82.5	Confident	78.3	Confident	19 Å²	19	72.4 Å²	72.4	12%	0.115	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.5	171	-178.2	0	0	0	0	108.5	W143 L145 K148 I156 L167 Y180	W143-V150 HydrophobicContact CB-CB 4.19Å; W143-V150 PolarHBondContact O-N 2.87Å; L145-V150 HydrophobicContact CB-CG2 3.92Å; K148-V150 PolarHBondContact O-N 2.68Å; V150-I156 HydrophobicContact CG1-CD1 4.07Å; V150-I156 HydrophobicContact CG1-CG2 3.76Å; V150-L167 HydrophobicContact CB-CD1 4.47Å; V150-L167 HydrophobicContact CG1-CD1 4.1Å; V150-Y180 HydrophobicContact CG2-CE1 4.37Å
151	K	79.3	Confident	77.9	Confident	155 Å²	155	75.3 Å²	75.3	67%	0.674	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-100.5	155	173.9	-65.9	-177.1	179.2	-178.9	0	110.2
152	P	67.1	Low	76.8	Confident	94 Å²	94	77.7 Å²	77.7	61%	0.61	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-60.9	147.9	167.3	-18.4	31.3	0	0	0	111.8	I156 L158	P152-I156 CarbonylContact C-O 3.55Å; P152-I156 VanDerWaalsContact CA-O 3.3Å; P152-I156 WeakPolarHBondContact CA-O 3.32Å; P152-L158 HydrophobicContact CG-CB 4.35Å; P152-L158 HydrophobicContact CG-CD1 4.01Å; P152-L158 HydrophobicContact CG-CG 4.2Å
153	S	66.8	Low	76.1	Confident	61 Å²	61	75 Å²	75	43%	0.427	42%	0.423	S	S	.	.			trans	-153.6	-179.9	176	78.7	0	0	0	0	111.3	F155 I156	S153-F155 PolarHBondContact O-N 3.04Å; S153-F155 VanDerWaalsContact O-N 3.14Å; S153-F155 PolarHBondContact OG-N 2.99Å; S153-F155 VanDerWaalsContact OG-N 3.14Å; S153-I156 PolarHBondContact N-O 3.16Å; S153-I156 PolarHBondContact O-N 2.79Å; S153-I156 PolarHBondContact OG-N 2.83Å
154	K	47.9	Very low	75.5	Confident	114 Å²	114	76.8 Å²	76.8	50%	0.496	43%	0.433	S	S	.	.	S	Bend	trans	-60.3	-17.4	172.1	65.7	-176.6	176.8	-175.7	0	113.9	D668 E672	K154-D668 IonicContact NZ-OD2 3.06Å; K154-D668 PolarHBondContact NZ-OD2 3.43Å; K154-E672 IonicContact NZ-OE1 3.72Å; K154-E672 PolarHBondContact NZ-OE1 3.31Å; K154-E672 IonicContact NZ-OE2 3.7Å; K154-E672 PolarHBondContact NZ-OE2 3.02Å
155	F	62.3	Low	75.4	Confident	110 Å²	110	75.5 Å²	75.5	48%	0.482	42%	0.424	S	S	.	.	S	Bend	trans	-111.9	-22.3	177.2	-53.9	-56.7	0	0	0	113.8	S153 I169 D170	S153-F155 PolarHBondContact O-N 3.04Å; S153-F155 VanDerWaalsContact O-N 3.14Å; S153-F155 PolarHBondContact OG-N 2.99Å; S153-F155 VanDerWaalsContact OG-N 3.14Å; F155-I169 CarbonylContact O-C 3.57Å; F155-I169 WeakPolarHBondContact O-CA 3.5Å; F155-D170 PolarHBondContact O-N 2.88Å
156	I	67.9	Low	75.2	Confident	31 Å²	31	74.4 Å²	74.4	16%	0.159	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	108.2	-176.5	-54.7	-179.3	0	0	0	110.4	V150 P152 S153 L158 L167 T168 I169	V150-I156 HydrophobicContact CG1-CD1 4.07Å; V150-I156 HydrophobicContact CG1-CG2 3.76Å; P152-I156 CarbonylContact C-O 3.55Å; P152-I156 VanDerWaalsContact CA-O 3.3Å; P152-I156 WeakPolarHBondContact CA-O 3.32Å; S153-I156 PolarHBondContact N-O 3.16Å; S153-I156 PolarHBondContact O-N 2.79Å; S153-I156 PolarHBondContact OG-N 2.83Å; I156-L158 HydrophobicContact CG2-CD2 4.02Å; I156-L167 HydrophobicContact CG2-CG 4.34Å; I156-T168 CarbonylContact C-O 3.51Å; I156-T168 WeakPolarHBondContact CA-O 3.36Å; I156-I169 HydrophobicContact CD1-CD1 4.22Å; I156-I169 HydrophobicContact CG1-CD1 4.27Å; I156-I169 HydrophobicContact CG1-CG1 4.14Å; I156-I169 HydrophobicContact CG1-CG2 4.23Å; I156-I169 HydrophobicContact CG2-CG1 4.45Å
157	I	77.6	Confident	75.6	Confident	99 Å²	99	69 Å²	69	51%	0.508	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	118.9	177.7	-56.5	175	0	0	0	109.1	L167 T168	I157-L167 WeakPolarHBondContact O-CA 3.36Å; I157-T168 PolarHBondContact N-O 2.74Å; I157-T168 PolarHBondContact O-N 2.89Å
158	L	79.9	Confident	76.2	Confident	50 Å²	50	66.6 Å²	66.6	26%	0.262	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.4	170.6	-53.7	-174.3	0	0	0	109.4	W143 P152 I156 L167	W143-L158 HydrophobicContact CG-CD2 4.27Å; P152-L158 HydrophobicContact CG-CB 4.35Å; P152-L158 HydrophobicContact CG-CD1 4.01Å; P152-L158 HydrophobicContact CG-CG 4.2Å; I156-L158 HydrophobicContact CG2-CD2 4.02Å; L158-L167 HydrophobicContact CD2-CB 3.75Å; L158-L167 HydrophobicContact CD2-CD1 3.72Å; L158-L167 HydrophobicContact CD2-CG 3.54Å
159	A	77.7	Confident	76.4	Confident	35 Å²	35	58.9 Å²	58.9	29%	0.289	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.5	177.5	0	0	0	0	0	111.7	C165 S166	A159-C165 WeakPolarHBondContact O-CA 3.43Å; A159-S166 PolarHBondContact N-O 3.27Å; A159-S166 PolarHBondContact O-N 2.84Å
160	N	75.8	Confident	75.5	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	81.4	176.7	-178.6	42.3	0	0	0	109.7	V139 V141 L164 C165	V139-N160 PolarHBondContact O-ND2 2.79Å; V141-N160 HydrophobicContact CB-CB 4.44Å; V141-N160 HydrophobicContact CG2-CB 4.25Å; V141-N160 WeakPolarHBondContact CG2-ND2 3.49Å; N160-L164 WeakPolarHBondContact CA-O 3.25Å; N160-C165 PolarHBondContact OD1-SG 2.86Å
161	E	74.2	Confident	75.2	Confident	158 Å²	158	61.8 Å²	61.8	74%	0.738	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.9	-175	-68.1	-172.7	-178.2	0	0	111	G163 L164	E161-G163 PolarHBondContact O-N 3.49Å; E161-L164 PolarHBondContact N-O 2.84Å; E161-L164 VanDerWaalsContact N-O 3.1Å; E161-L164 WeakPolarHBondContact O-CB 3.48Å; E161-L164 PolarHBondContact O-N 3.01Å
162	G	66.6	Low	75.1	Confident	80 Å²	80	54.4 Å²	54.4	83%	0.825	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	23.3	178.6	0	0	0	0	0	114.7	L164	G162-L164 VanDerWaalsContact C-N 3.34Å
163	G	73.5	Confident	75.8	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.021	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	7.3	-173.6	0	0	0	0	0	115.2	R130 L131 E161	R130-G163 CarbonylContact C-O 3.5Å; R130-G163 WeakPolarHBondContact CA-O 3.36Å; R130-G163 WeakPolarHBondContact CG-O 3.27Å; L131-G163 PolarHBondContact N-O 2.8Å; E161-G163 PolarHBondContact O-N 3.49Å
164	L	81.8	Confident	76.3	Confident	41 Å²	41	54.3 Å²	54.3	22%	0.215	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.5	164.6	177.2	57.8	0	0	0	109.1	E128 N160 E161 G162	E128-L164 HydrophobicContact CB-CD1 4.21Å; E128-L164 HydrophobicContact CG-CD1 4.46Å; N160-L164 WeakPolarHBondContact CA-O 3.25Å; E161-L164 PolarHBondContact N-O 2.84Å; E161-L164 VanDerWaalsContact N-O 3.1Å; E161-L164 WeakPolarHBondContact O-CB 3.48Å; E161-L164 PolarHBondContact O-N 3.01Å; G162-L164 VanDerWaalsContact C-N 3.34Å
165	C	86.3	Confident	77.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.8	174.1	-45.4	0	0	0	0	108.4	C129 V141 W143 A159 N160	C129-C165 PolarHBondContact N-O 2.82Å; C129-C165 PolarHBondContact O-N 3Å; C129-C165 VanDerWaalsContact O-O 3.07Å; V141-C165 HydrophobicContact CG1-CB 4.16Å; W143-C165 HydrophobicContact CZ2-CB 4.46Å; A159-C165 WeakPolarHBondContact O-CA 3.43Å; N160-C165 PolarHBondContact OD1-SG 2.86Å
166	S	88.8	Confident	79	Confident	7 Å²	7	52.1 Å²	52.1	5%	0.049	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.7	178.3	70.4	0	0	0	0	113.4	L127 A159	L127-S166 CarbonylContact O-C 3.53Å; L127-S166 WeakPolarHBondContact O-CA 3.44Å; L127-S166 WeakPolarHBondContact O-CB 3.47Å; A159-S166 PolarHBondContact N-O 3.27Å; A159-S166 PolarHBondContact O-N 2.84Å
167	L	93.3	Very high	80	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.9	169.8	176.2	161.8	0	0	0	107.2	R126 L127 W143 V150 I156 I157 L158 I169 Y180	R126-L167 WeakPolarHBondContact CA-O 3.07Å; L127-L167 HydrophobicContact CB-CB 4.43Å; L127-L167 HydrophobicContact CD1-CD2 4.27Å; L127-L167 HydrophobicContact CG-CD2 4.5Å; L127-L167 PolarHBondContact N-O 3.13Å; L127-L167 PolarHBondContact O-N 2.72Å; W143-L167 HydrophobicContact CB-CD1 3.92Å; W143-L167 HydrophobicContact CD2-CB 3.8Å; W143-L167 HydrophobicContact CD2-CD1 3.73Å; W143-L167 HydrophobicContact CD2-CG 4.44Å; W143-L167 HydrophobicContact CE3-CB 3.84Å; W143-L167 HydrophobicContact CE3-CD1 3.6Å; W143-L167 HydrophobicContact CE3-CG 4.38Å; W143-L167 HydrophobicContact CG-CB 4.45Å; W143-L167 HydrophobicContact CG-CD1 3.9Å; W143-L167 HydrophobicContact CH2-CB 3.79Å; W143-L167 HydrophobicContact CZ2-CB 3.8Å; W143-L167 HydrophobicContact CZ3-CB 3.83Å; W143-L167 HydrophobicContact CZ3-CD1 4.26Å; V150-L167 HydrophobicContact CB-CD1 4.47Å; V150-L167 HydrophobicContact CG1-CD1 4.1Å; I156-L167 HydrophobicContact CG2-CG 4.34Å; I157-L167 WeakPolarHBondContact O-CA 3.36Å; L158-L167 HydrophobicContact CD2-CB 3.75Å; L158-L167 HydrophobicContact CD2-CD1 3.72Å; L158-L167 HydrophobicContact CD2-CG 3.54Å; L167-I169 HydrophobicContact CD2-CD1 4.04Å; L167-I169 HydrophobicContact CD2-CG1 3.61Å; L167-Y180 HydrophobicContact CD1-CD1 3.86Å; L167-Y180 HydrophobicContact CD1-CE1 3.91Å; L167-Y180 HydrophobicContact CD2-CE1 4.16Å
168	T	87.3	Confident	80.1	Confident	12 Å²	12	50.6 Å²	50.6	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.2	177.2	-48.4	0	0	0	0	108.7	R124 L125 R126 I156 I157	R124-T168 HydrophobicContact CG-CG2 3.73Å; L125-T168 CarbonylContact O-C 3.48Å; L125-T168 WeakPolarHBondContact O-CA 3.26Å; L125-T168 WeakPolarHBondContact O-CG2 3.43Å; R126-T168 HydrophobicContact CB-CG2 4.29Å; R126-T168 HydrophobicContact CG-CG2 4.22Å; R126-T168 PolarHBondContact NE-OG1 3.23Å; I156-T168 CarbonylContact C-O 3.51Å; I156-T168 WeakPolarHBondContact CA-O 3.36Å; I157-T168 PolarHBondContact N-O 2.74Å; I157-T168 PolarHBondContact O-N 2.89Å
169	I	83.9	Confident	80.8	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.9	172.4	-48.5	-165.9	0	0	0	107.4	R124 L125 F155 I156 L167 K171 D176 Y180	R124-I169 CarbonylContact C-O 3.53Å; R124-I169 VanDerWaalsContact CA-O 3.3Å; R124-I169 WeakPolarHBondContact CA-O 3.49Å; R124-I169 WeakPolarHBondContact CG-O 3.22Å; L125-I169 HydrophobicContact CB-CB 4.3Å; L125-I169 HydrophobicContact CD2-CD1 4.15Å; L125-I169 HydrophobicContact CD2-CG1 4.28Å; L125-I169 PolarHBondContact N-O 2.82Å; L125-I169 PolarHBondContact O-N 3.45Å; F155-I169 CarbonylContact O-C 3.57Å; F155-I169 WeakPolarHBondContact O-CA 3.5Å; I156-I169 HydrophobicContact CD1-CD1 4.22Å; I156-I169 HydrophobicContact CG1-CD1 4.27Å; I156-I169 HydrophobicContact CG1-CG1 4.14Å; I156-I169 HydrophobicContact CG1-CG2 4.23Å; I156-I169 HydrophobicContact CG2-CG1 4.45Å; L167-I169 HydrophobicContact CD2-CD1 4.04Å; L167-I169 HydrophobicContact CD2-CG1 3.61Å; I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 2.83Å; I169-D176 HydrophobicContact CD1-CB 4.2Å; I169-D176 WeakPolarHBondContact CD1-OD1 3.07Å; I169-Y180 HydrophobicContact CD1-CE1 4.39Å; I169-Y180 WeakPolarHBondContact CD1-OH 3.22Å
170	D	64.6	Low	81.6	Confident	55 Å²	55	51.1 Å²	51.1	29%	0.294	28%	0.277	S	S	.	.	S	Bend	trans	-66.4	-35.8	-167.3	-165.3	50.6	0	0	0	113.5	R124 F155	R124-D170 VanDerWaalsContact CA-O 3.25Å; R124-D170 WeakPolarHBondContact CA-O 3.48Å; R124-D170 WeakPolarHBondContact CB-O 3.3Å; R124-D170 IonicContact CZ-OD1 2.79Å; R124-D170 PolarHBondContact N-O 3.45Å; R124-D170 IonicContact NE-OD1 2.72Å; R124-D170 PolarHBondContact NE-OD1 2.84Å; R124-D170 IonicContact NH2-OD1 3.27Å; R124-D170 PolarHBondContact NH2-OD1 2.93Å; F155-D170 PolarHBondContact O-N 2.88Å
171	K	76.4	Confident	82.5	Confident	128 Å²	128	51 Å²	51	56%	0.557	27%	0.273	S	S	*	.	S	Bend	trans	-139.9	107.5	172	-61.2	-176.7	-177.1	179.4	0	106.8	I169	I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 2.83Å
172	A	78.2	Confident	83.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.238	C	C	.	.			trans	-73.6	128.7	175.9	0	0	0	0	0	109.6	V119 G122 Q123 L125 D176 V199	V119-A172 HydrophobicContact CG1-CB 3.69Å; V119-A172 HydrophobicContact CG2-CB 4.37Å; G122-A172 PolarHBondContact N-O 2.88Å; Q123-A172 WeakPolarHBondContact O-CB 3.43Å; Q123-A172 PolarHBondContact O-N 2.95Å; L125-A172 HydrophobicContact CB-CB 3.86Å; A172-D176 WeakPolarHBondContact CA-OD2 3.48Å; A172-D176 HydrophobicContact CB-CB 4.48Å; A172-V199 HydrophobicContact CB-CG2 4.4Å
173	L	80.1	Confident	84.6	Confident	72 Å²	72	43.4 Å²	43.4	38%	0.377	21%	0.213	S	C	.	.			trans	-108	166.8	176.5	-59.8	179.1	0	0	0	109.9	D121 E175 D176 V199	D121-L173 WeakPolarHBondContact OD1-CD2 3.11Å; L173-E175 HydrophobicContact CB-CG 3.95Å; L173-E175 HydrophobicContact CD1-CG 4.49Å; L173-E175 PolarHBondContact O-N 3.42Å; L173-D176 PolarHBondContact N-OD2 3.43Å; L173-D176 WeakPolarHBondContact O-CB 3.28Å; L173-D176 PolarHBondContact O-N 2.88Å; L173-V199 WeakPolarHBondContact O-CG2 3.39Å
174	P	78.4	Confident	85.3	Confident	82 Å²	82	43.3 Å²	43.3	53%	0.532	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-12.4	174.3	-27.3	36.7	0	0	0	115.2
175	E	80.6	Confident	85.5	Confident	158 Å²	158	44.6 Å²	44.6	74%	0.738	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.1	171.5	57.7	178.7	-144	0	0	114.7	L173	L173-E175 HydrophobicContact CB-CG 3.95Å; L173-E175 HydrophobicContact CD1-CG 4.49Å; L173-E175 PolarHBondContact O-N 3.42Å
176	D	86.6	Confident	85.4	Confident	20 Å²	20	45.8 Å²	45.8	11%	0.107	22%	0.223	C	C	.	.	S	Bend	trans	-90.2	1.9	167.7	-64.8	-62.2	0	0	0	112.7	I169 A172 L173 Y180	I169-D176 HydrophobicContact CD1-CB 4.2Å; I169-D176 WeakPolarHBondContact CD1-OD1 3.07Å; A172-D176 WeakPolarHBondContact CA-OD2 3.48Å; A172-D176 HydrophobicContact CB-CB 4.48Å; L173-D176 PolarHBondContact N-OD2 3.43Å; L173-D176 WeakPolarHBondContact O-CB 3.28Å; L173-D176 PolarHBondContact O-N 2.88Å; D176-Y180 VanDerWaalsContact O-CE2 3.3Å; D176-Y180 WeakPolarHBondContact O-CE2 3.27Å; D176-Y180 PolarHBondContact O-OH 2.96Å
177	E	88.1	Confident	84.9	Confident	91 Å²	91	51.5 Å²	51.5	43%	0.425	26%	0.263	S	S	.	.			trans	-70.7	139.3	170.7	175.5	155.2	130	0	0	111.1	L198 V199	E177-L198 HydrophobicContact CG-CD2 4.18Å; E177-L198 VanDerWaalsContact OE2-CA 3.26Å; E177-L198 WeakPolarHBondContact OE2-CA 3.47Å; E177-V199 HydrophobicContact CB-CG2 4.3Å; E177-V199 PolarHBondContact OE2-N 2.94Å
178	G	80.7	Confident	84.2	Confident	7 Å²	7	53.8 Å²	53.8	7%	0.072	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.7	-167.5	172.8	0	0	0	0	0	115	Y180 M196 V197	G178-Y180 PolarHBondContact O-N 3.16Å; G178-M196 VanDerWaalsContact C-SD 3.54Å; G178-V197 PolarHBondContact N-O 2.72Å; G178-V197 VanDerWaalsContact N-O 3.11Å; G178-V197 PolarHBondContact O-N 2.68Å
179	Q	93.3	Very high	83.9	Confident	93 Å²	93	54.5 Å²	54.5	44%	0.435	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.4	-178.2	-178.7	166.1	103.7	0	0	111.4	D146 C195 M196	D146-Q179 PolarHBondContact N-O 2.91Å; D146-Q179 WeakPolarHBondContact OD1-CB 3.39Å; D146-Q179 PolarHBondContact OD1-N 2.78Å; Q179-C195 WeakPolarHBondContact CA-O 3.47Å; Q179-M196 HydrophobicContact CB-CE 4.31Å; Q179-M196 HydrophobicContact CB-SD 4.35Å
180	Y	94.9	Very high	84.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	143.4	168.2	-73.1	-95.7	0	0	0	111.3	L125 L127 T144 L145 V150 L167 I169 D176 G178 S194 C195 V197	L125-Y180 HydrophobicContact CD2-CE2 4.41Å; L127-Y180 HydrophobicContact CD1-CD1 3.8Å; L127-Y180 HydrophobicContact CD1-CD2 3.85Å; L127-Y180 HydrophobicContact CD1-CE1 4.44Å; L127-Y180 HydrophobicContact CD1-CE2 4.45Å; L127-Y180 HydrophobicContact CD1-CG 3.47Å; L127-Y180 VanDerWaalsContact CD1-CG 3.47Å; T144-Y180 CarbonylContact O-C 3.58Å; T144-Y180 WeakPolarHBondContact O-CA 3.05Å; L145-Y180 HydrophobicContact CB-CD1 4.32Å; L145-Y180 HydrophobicContact CB-CE1 4.07Å; L145-Y180 HydrophobicContact CD1-CD2 3.97Å; L145-Y180 HydrophobicContact CD1-CE1 4.44Å; L145-Y180 HydrophobicContact CD1-CE2 3.74Å; L145-Y180 HydrophobicContact CD1-CG 4.44Å; V150-Y180 HydrophobicContact CG2-CE1 4.37Å; L167-Y180 HydrophobicContact CD1-CD1 3.86Å; L167-Y180 HydrophobicContact CD1-CE1 3.91Å; L167-Y180 HydrophobicContact CD2-CE1 4.16Å; I169-Y180 HydrophobicContact CD1-CE1 4.39Å; I169-Y180 WeakPolarHBondContact CD1-OH 3.22Å; D176-Y180 VanDerWaalsContact O-CE2 3.3Å; D176-Y180 WeakPolarHBondContact O-CE2 3.27Å; D176-Y180 PolarHBondContact O-OH 2.96Å; G178-Y180 PolarHBondContact O-N 3.16Å; Y180-S194 CarbonylContact O-C 3.59Å; Y180-S194 WeakPolarHBondContact O-CA 3.39Å; Y180-S194 VanDerWaalsContact O-CB 3.25Å; Y180-S194 WeakPolarHBondContact O-CB 3.45Å; Y180-S194 PolarHBondContact O-OG 2.93Å; Y180-C195 PolarHBondContact N-O 2.86Å; Y180-C195 PolarHBondContact O-N 2.81Å; Y180-V197 HydrophobicContact CD2-CB 3.83Å; Y180-V197 HydrophobicContact CD2-CG2 3.4Å; Y180-V197 VanDerWaalsContact CD2-CG2 3.4Å; Y180-V197 HydrophobicContact CE2-CB 3.74Å; Y180-V197 HydrophobicContact CE2-CG1 4.25Å; Y180-V197 HydrophobicContact CE2-CG2 3.62Å; Y180-V197 HydrophobicContact CG-CG2 4.43Å
181	K	94.8	Very high	85.2	Confident	60 Å²	60	60.1 Å²	60.1	26%	0.261	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.1	172.2	175.6	-179.4	-71.7	-164.2	0	110	W143 T144 E192 C193 S194	W143-K181 CarbonylContact C-O 3.41Å; W143-K181 VanDerWaalsContact CA-O 3.27Å; W143-K181 WeakPolarHBondContact CA-O 2.82Å; T144-K181 PolarHBondContact N-O 2.82Å; T144-K181 PolarHBondContact O-N 3.43Å; K181-E192 HydrophobicContact CD-CB 4.33Å; K181-E192 HydrophobicContact CD-CG 4.4Å; K181-E192 WeakPolarHBondContact CD-OE2 3.36Å; K181-E192 WeakPolarHBondContact CE-OE2 3.38Å; K181-E192 HydrophobicContact CG-CB 4.5Å; K181-E192 IonicContact NZ-OE2 2.7Å; K181-E192 PolarHBondContact NZ-OE2 1.98Å; K181-C193 CarbonylContact C-O 3.59Å; K181-C193 WeakPolarHBondContact CA-O 3.04Å; K181-S194 VanDerWaalsContact CB-OG 3.28Å; K181-S194 WeakPolarHBondContact CB-OG 3.33Å; K181-S194 WeakPolarHBondContact CE-OG 3.34Å; K181-S194 WeakPolarHBondContact CG-OG 3.33Å
182	C	93.6	Very high	86	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.1	165.6	178.6	0	0	0	0	109.3	F110 L114 C129 V141 W143 E192 C193	F110-C182 HydrophobicContact CZ-CB 4.39Å; L114-C182 HydrophobicContact CD1-CB 3.96Å; C129-C182 VanDerWaalsContact SG-SG 3.62Å; V141-C182 VanDerWaalsContact CG1-SG 3.6Å; W143-C182 HydrophobicContact CD2-CB 3.93Å; W143-C182 HydrophobicContact CE3-CB 3.86Å; W143-C182 HydrophobicContact CH2-CB 3.98Å; W143-C182 HydrophobicContact CZ2-CB 3.97Å; W143-C182 HydrophobicContact CZ3-CB 3.9Å; C182-E192 WeakPolarHBondContact O-CA 3.31Å; C182-C193 PolarHBondContact N-O 2.79Å; C182-C193 PolarHBondContact O-N 3.37Å
183	R	91.7	Very high	86.5	Confident	78 Å²	78	58.2 Å²	58.2	29%	0.294	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.8	174.8	170.4	176.5	172.3	172.1	-5.8	109.5	V141 T142 E185 A191 E192	V141-R183 CarbonylContact C-O 3.53Å; V141-R183 WeakPolarHBondContact CA-O 3.31Å; T142-R183 PolarHBondContact N-O 2.88Å; T142-R183 PolarHBondContact O-N 2.93Å; T142-R183 PolarHBondContact OG1-O 2.94Å; R183-E185 IonicContact CZ-OE2 3.12Å; R183-E185 IonicContact NE-OE2 3.89Å; R183-E185 PolarHBondContact NE-OE2 2.99Å; R183-E185 VanDerWaalsContact NH2-CD 3.35Å; R183-E185 IonicContact NH2-OE1 3.2Å; R183-E185 PolarHBondContact NH2-OE1 3.46Å; R183-E185 IonicContact NH2-OE2 2.66Å; R183-E185 PolarHBondContact NH2-OE2 2.76Å; R183-A191 WeakPolarHBondContact CA-O 3.41Å; R183-E192 HydrophobicContact CB-CG 3.98Å; R183-E192 HydrophobicContact CG-CG 4.03Å
184	A	88.6	Confident	87.1	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.7	175.9	0	0	0	0	0	109.7	P108 F110 L131 V139 T140 V141 R190 A191	P108-A184 HydrophobicContact CB-CB 3.97Å; P108-A184 HydrophobicContact CG-CB 4.32Å; P108-A184 WeakPolarHBondContact CG-O 3.25Å; F110-A184 HydrophobicContact CE1-CB 4.39Å; F110-A184 HydrophobicContact CE2-CB 4.09Å; F110-A184 HydrophobicContact CZ-CB 3.64Å; L131-A184 HydrophobicContact CD1-CB 4.01Å; L131-A184 HydrophobicContact CD2-CB 3.72Å; L131-A184 HydrophobicContact CG-CB 4.45Å; V139-A184 HydrophobicContact CG1-CB 3.76Å; T140-A184 WeakPolarHBondContact O-CA 3.48Å; V141-A184 HydrophobicContact CG2-CB 4.46Å; A184-R190 CarbonylContact O-C 3.54Å; A184-R190 VanDerWaalsContact O-CA 3.26Å; A184-R190 WeakPolarHBondContact O-CA 3.05Å; A184-A191 PolarHBondContact N-O 2.91Å; A184-A191 PolarHBondContact O-N 2.82Å
185	E	85.4	Confident	87.7	Confident	68 Å²	68	53.2 Å²	53.2	32%	0.318	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	139.1	-172.9	-169.8	154.4	-149.5	0	0	112.2	T140 R183 G189 R190	T140-E185 PolarHBondContact N-O 2.85Å; T140-E185 PolarHBondContact O-N 3.26Å; R183-E185 IonicContact CZ-OE2 3.12Å; R183-E185 IonicContact NE-OE2 3.89Å; R183-E185 PolarHBondContact NE-OE2 2.99Å; R183-E185 VanDerWaalsContact NH2-CD 3.35Å; R183-E185 IonicContact NH2-OE1 3.2Å; R183-E185 PolarHBondContact NH2-OE1 3.46Å; R183-E185 IonicContact NH2-OE2 2.66Å; R183-E185 PolarHBondContact NH2-OE2 2.76Å; E185-G189 WeakPolarHBondContact CA-O 3.35Å; E185-R190 HydrophobicContact CB-CB 4.08Å; E185-R190 HydrophobicContact CG-CB 3.83Å
186	N	83.4	Confident	87.8	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.134	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	-176.4	171.7	70.4	16.7	0	0	0	110.6	T106 P108 D138 V139 A188 G189	T106-N186 PolarHBondContact O-ND2 3.35Å; P108-N186 WeakPolarHBondContact CD-OD1 3.38Å; D138-N186 VanDerWaalsContact O-CB 3.24Å; D138-N186 WeakPolarHBondContact O-CB 3.17Å; V139-N186 HydrophobicContact CG2-CB 3.87Å; V139-N186 WeakPolarHBondContact CG2-ND2 3.47Å; N186-A188 PolarHBondContact O-N 3.06Å; N186-A188 VanDerWaalsContact O-N 3.1Å; N186-A188 WeakPolarHBondContact OD1-CA 3.41Å; N186-A188 WeakPolarHBondContact OD1-CB 3.15Å; N186-A188 PolarHBondContact OD1-N 2.78Å; N186-G189 PolarHBondContact N-O 2.85Å; N186-G189 PolarHBondContact O-N 2.95Å; N186-G189 PolarHBondContact OD1-N 2.9Å
187	S	79.1	Confident	88	Confident	127 Å²	127	48.4 Å²	48.4	89%	0.888	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.3	-179	54.9	0	0	0	0	115.3
188	A	78.6	Confident	87.4	Confident	49 Å²	49	47.5 Å²	47.5	41%	0.405	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-16	179.3	0	0	0	0	0	113.8	G105 A107 N186	G105-A188 WeakPolarHBondContact O-CB 3.26Å; A107-A188 HydrophobicContact CB-CB 4.3Å; N186-A188 PolarHBondContact O-N 3.06Å; N186-A188 VanDerWaalsContact O-N 3.1Å; N186-A188 WeakPolarHBondContact OD1-CA 3.41Å; N186-A188 WeakPolarHBondContact OD1-CB 3.15Å; N186-A188 PolarHBondContact OD1-N 2.78Å
189	G	81.9	Confident	87.7	Confident	26 Å²	26	47.8 Å²	47.8	27%	0.268	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-170.3	175.8	0	0	0	0	0	114.7	P108 E185 N186	P108-G189 VanDerWaalsContact CD-O 3.3Å; P108-G189 WeakPolarHBondContact CD-O 3.47Å; E185-G189 WeakPolarHBondContact CA-O 3.35Å; N186-G189 PolarHBondContact N-O 2.85Å; N186-G189 PolarHBondContact O-N 2.95Å; N186-G189 PolarHBondContact OD1-N 2.9Å
190	R	86.4	Confident	86.8	Confident	157 Å²	157	47.9 Å²	47.9	59%	0.592	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	149.2	179.6	73.8	-174.4	-170.1	-178.3	7.1	111.9	A184 E185	A184-R190 CarbonylContact O-C 3.54Å; A184-R190 VanDerWaalsContact O-CA 3.26Å; A184-R190 WeakPolarHBondContact O-CA 3.05Å; E185-R190 HydrophobicContact CB-CB 4.08Å; E185-R190 HydrophobicContact CG-CB 3.83Å
191	A	88.3	Confident	85.4	Confident	20 Å²	20	54 Å²	54	17%	0.165	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	154.9	169.8	0	0	0	0	0	110.9	P108 F110 R183 A184	P108-A191 WeakPolarHBondContact O-CB 3.42Å; F110-A191 HydrophobicContact CD2-CB 4Å; F110-A191 HydrophobicContact CE2-CB 4.09Å; R183-A191 WeakPolarHBondContact CA-O 3.41Å; A184-A191 PolarHBondContact N-O 2.91Å; A184-A191 PolarHBondContact O-N 2.82Å
192	E	93.3	Very high	83.7	Confident	77 Å²	77	54.5 Å²	54.5	36%	0.36	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.2	178.1	-60	-176.3	-178.9	0	0	109.6	K181 C182 R183	K181-E192 HydrophobicContact CD-CB 4.33Å; K181-E192 HydrophobicContact CD-CG 4.4Å; K181-E192 WeakPolarHBondContact CD-OE2 3.36Å; K181-E192 WeakPolarHBondContact CE-OE2 3.38Å; K181-E192 HydrophobicContact CG-CB 4.5Å; K181-E192 IonicContact NZ-OE2 2.7Å; K181-E192 PolarHBondContact NZ-OE2 1.98Å; C182-E192 WeakPolarHBondContact O-CA 3.31Å; R183-E192 HydrophobicContact CB-CG 3.98Å; R183-E192 HydrophobicContact CG-CG 4.03Å
193	C	88.7	Confident	81.6	Confident	11 Å²	11	60 Å²	60	7%	0.074	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.7	162.6	64	0	0	0	0	110.2	F110 K113 K181 C182	F110-C193 HydrophobicContact CD2-CB 4.04Å; F110-C193 HydrophobicContact CE2-CB 4.46Å; F110-C193 HydrophobicContact CG-CB 4.35Å; K113-C193 HydrophobicContact CB-CB 4.11Å; K113-C193 HydrophobicContact CD-CB 4.37Å; K113-C193 HydrophobicContact CG-CB 3.99Å; K181-C193 CarbonylContact C-O 3.59Å; K181-C193 WeakPolarHBondContact CA-O 3.04Å; C182-C193 PolarHBondContact N-O 2.79Å; C182-C193 PolarHBondContact O-N 3.37Å
194	S	92.1	Very high	79.1	Confident	45 Å²	45	65.7 Å²	65.7	32%	0.315	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	157.8	-171.6	-68	0	0	0	0	111.8	Y180 K181	Y180-S194 CarbonylContact O-C 3.59Å; Y180-S194 WeakPolarHBondContact O-CA 3.39Å; Y180-S194 VanDerWaalsContact O-CB 3.25Å; Y180-S194 WeakPolarHBondContact O-CB 3.45Å; Y180-S194 PolarHBondContact O-OG 2.93Å; K181-S194 VanDerWaalsContact CB-OG 3.28Å; K181-S194 WeakPolarHBondContact CB-OG 3.33Å; K181-S194 WeakPolarHBondContact CE-OG 3.34Å; K181-S194 WeakPolarHBondContact CG-OG 3.33Å
195	C	91	Very high	76.8	Confident	4 Å²	4	73.7 Å²	73.7	3%	0.027	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.6	172.4	57.9	0	0	0	0	110.4	L114 K115 D116 Q179 Y180	L114-C195 HydrophobicContact CB-CB 3.77Å; K115-C195 VanDerWaalsContact C-CB 3.41Å; K115-C195 WeakPolarHBondContact O-CB 3.36Å; D116-C195 VanDerWaalsContact OD1-CA 3.3Å; D116-C195 WeakPolarHBondContact OD1-CA 3.2Å; Q179-C195 WeakPolarHBondContact CA-O 3.47Å; Y180-C195 PolarHBondContact N-O 2.86Å; Y180-C195 PolarHBondContact O-N 2.81Å
196	M	84.3	Confident	74	Confident	76 Å²	76	75.5 Å²	75.5	37%	0.374	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.8	165.1	-161.3	62.7	66	0	0	110.2	D116 V117 G178 Q179 L198	D116-M196 CarbonylContact C-O 3.5Å; D116-M196 WeakPolarHBondContact CA-O 3.3Å; D116-M196 HydrophobicContact CB-CB 4.38Å; D116-M196 PolarHBondContact OD1-N 3.1Å; V117-M196 PolarHBondContact N-O 2.87Å; G178-M196 VanDerWaalsContact C-SD 3.54Å; Q179-M196 HydrophobicContact CB-CE 4.31Å; Q179-M196 HydrophobicContact CB-SD 4.35Å; M196-L198 HydrophobicContact CG-CD2 4.29Å; M196-L198 HydrophobicContact CG-CG 4.44Å
197	V	89.3	Confident	71.9	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.1	163.6	171.1	0	0	0	0	108	V117 L125 L127 G178 Y180 V199	V117-V197 VanDerWaalsContact O-CA 3.31Å; V117-V197 WeakPolarHBondContact O-CA 3.45Å; L125-V197 HydrophobicContact CD1-CG1 4.07Å; L125-V197 HydrophobicContact CD1-CG2 4.11Å; L125-V197 HydrophobicContact CD2-CG1 3.78Å; L125-V197 HydrophobicContact CD2-CG2 4.11Å; L127-V197 HydrophobicContact CD1-CG2 4.09Å; L127-V197 HydrophobicContact CD2-CG2 3.92Å; G178-V197 PolarHBondContact N-O 2.72Å; G178-V197 VanDerWaalsContact N-O 3.11Å; G178-V197 PolarHBondContact O-N 2.68Å; Y180-V197 HydrophobicContact CD2-CB 3.83Å; Y180-V197 HydrophobicContact CD2-CG2 3.4Å; Y180-V197 VanDerWaalsContact CD2-CG2 3.4Å; Y180-V197 HydrophobicContact CE2-CB 3.74Å; Y180-V197 HydrophobicContact CE2-CG1 4.25Å; Y180-V197 HydrophobicContact CE2-CG2 3.62Å; Y180-V197 HydrophobicContact CG-CG2 4.43Å; V197-V199 HydrophobicContact CG1-CG2 4.35Å
198	L	76.3	Confident	69.6	Low	72 Å²	72	79.7 Å²	79.7	38%	0.377	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.6	171.6	-62.5	175.1	0	0	0	109.7	V117 T118 V119 E177 M196	V117-L198 PolarHBondContact O-N 3.08Å; T118-L198 WeakPolarHBondContact CA-O 3.24Å; T118-L198 HydrophobicContact CG2-CB 4.31Å; V119-L198 PolarHBondContact N-O 2.84Å; E177-L198 HydrophobicContact CG-CD2 4.18Å; E177-L198 VanDerWaalsContact OE2-CA 3.26Å; E177-L198 WeakPolarHBondContact OE2-CA 3.47Å; M196-L198 HydrophobicContact CG-CD2 4.29Å; M196-L198 HydrophobicContact CG-CG 4.44Å
199	V	86.8	Confident	67.1	Low	14 Å²	14	82.9 Å²	82.9	9%	0.085	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	101.6	-179.1	-172.6	0	0	0	0	110	V119 D121 A172 L173 E177 V197	V119-V199 HydrophobicContact CG1-CG2 3.9Å; V119-V199 CarbonylContact O-C 3.47Å; V119-V199 WeakPolarHBondContact O-CA 3.46Å; D121-V199 HydrophobicContact CB-CG1 4.14Å; A172-V199 HydrophobicContact CB-CG2 4.4Å; L173-V199 WeakPolarHBondContact O-CG2 3.39Å; E177-V199 HydrophobicContact CB-CG2 4.3Å; E177-V199 PolarHBondContact OE2-N 2.94Å; V197-V199 HydrophobicContact CG1-CG2 4.35Å
200	D	75.2	Confident	64.6	Low	94 Å²	94	89.1 Å²	89.1	50%	0.503	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	143.1	-177.9	-90.6	-25.1	0	0	0	111.7	T118 V119 L120 D121	T118-D200 HydrophobicContact CG2-CB 4.26Å; T118-D200 VanDerWaalsContact CG2-OD2 3.26Å; T118-D200 WeakPolarHBondContact CG2-OD2 3.36Å; V119-D200 PolarHBondContact O-N 2.96Å; L120-D200 VanDerWaalsContact CA-O 3.31Å; L120-D200 WeakPolarHBondContact CA-O 3.43Å; L120-D200 HydrophobicContact CD2-CB 3.76Å; D121-D200 PolarHBondContact N-O 3.32Å
201	D	65.5	Low	61.7	Low	132 Å²	132	90.9 Å²	90.9	71%	0.706	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-63	136.9	173.6	-71.7	-52.2	0	0	0	112
202	P	58.3	Low	58.7	Low	69 Å²	69	95 Å²	95	45%	0.448	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-65.9	133	169.6	27.3	-34	0	0	0	110.4	E204	P202-E204 PolarHBondContact O-N 2.82Å
203	P	50	Low	55.7	Low	116 Å²	116	101.4 Å²	101.4	75%	0.753	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-69	118.1	-167.9	24.9	-34.5	0	0	0	113.4
204	E	38.6	Very low	52.7	Low	197 Å²	197	110.7 Å²	110.7	92%	0.921	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-58	135.1	171.5	-73.8	-161.8	129.2	0	0	112	P202	P202-E204 PolarHBondContact O-N 2.82Å
205	N	40.3	Very low	49.6	Very low	168 Å²	168	113.5 Å²	113.5	90%	0.898	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-103.2	128.5	-174.3	-151.4	-6.8	0	0	0	110.8
206	S	26.8	Very low	46.4	Very low	106 Å²	106	117.8 Å²	117.8	74%	0.741	65%	0.65	S	S	*	*			trans	-128.7	157.6	-176.4	64.2	0	0	0	0	112.3
207	P	38.3	Very low	44.6	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	67%	0.671	S	S	*	*			trans	-94.3	158.2	-144.1	35.1	-37.8	0	0	0	116.8
208	T	31.2	Very low	41.6	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	71%	0.713	S	S	*	*			trans	21.4	131	152.9	61.5	0	0	0	0	118.8
209	D	27.4	Very low	39.6	Very low	115 Å²	115	128.9 Å²	128.9	62%	0.615	73%	0.733	S	S	*	*				-172.6	158.3	62.4	-163.5	28.9	0	0	0	115.3
210	K	28.4	Very low	36.7	Very low	158 Å²	158	138 Å²	138	69%	0.687	77%	0.774	S	S	*	*			trans	10.1	121.5	164.1	-63.9	160.4	-160.8	75.4	0	121.1
211	K	25.1	Very low	34.7	Very low	194 Å²	194	138.7 Å²	138.7	84%	0.843	79%	0.787	S	S	*	*				175.3	124.4	104.6	-98	166.6	-174.5	166.8	0	117.5
212	S	26.9	Very low	33	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	80%	0.797	S	S	*	*			trans	50.1	115.1	133.4	-51.5	0	0	0	0	122.4
213	K	28.2	Very low	31.5	Very low	212 Å²	212	142.3 Å²	142.3	92%	0.922	81%	0.807	S	S	*	*				-171.5	162.8	102.7	-103	167.9	-175.5	175.9	0	114
214	K	27.6	Very low	30.5	Very low	207 Å²	207	147.1 Å²	147.1	90%	0.9	81%	0.81	S	S	*	*			trans	-77.5	145.7	177	-66.1	178.1	174.2	-177.6	0	112.3
215	A	25.6	Very low	30.2	Very low	103 Å²	103	145.1 Å²	145.1	85%	0.851	80%	0.804	S	S	*	*			trans	-144.8	156.3	132.7	0	0	0	0	0	108.8
216	A	25	Very low	30.1	Very low	94 Å²	94	144.9 Å²	144.9	78%	0.777	80%	0.795	S	S	*	*			trans	-140.4	168.7	-179.5	0	0	0	0	0	108.5
217	P	46.4	Very low	30.1	Very low	126 Å²	126	149.1 Å²	149.1	82%	0.818	80%	0.8	S	S	*	*			trans	-89.4	161.9	-135.7	34.9	-39.4	0	0	0	115.4
218	T	25.4	Very low	29.7	Very low	142 Å²	142	149.3 Å²	149.3	87%	0.871	80%	0.801	S	S	*	*			trans	-124.9	115.7	158.8	46.5	0	0	0	0	109.5
219	S	34.4	Very low	29.6	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	80%	0.802	S	S	*	*			trans	-74.4	139.7	163.7	51.9	0	0	0	0	110.2
220	E	26.9	Very low	29.9	Very low	205 Å²	205	149.4 Å²	149.4	96%	0.958	81%	0.808	S	S	*	*			trans	-147.1	138.6	155.6	-127.9	159.6	-136.8	0	0	109.8
221	S	32.5	Very low	30.1	Very low	110 Å²	110	151.7 Å²	151.7	77%	0.769	82%	0.818	S	S	*	*			trans	-133.8	125.5	-171.4	58.4	0	0	0	0	109.4
222	E	28.8	Very low	30.4	Very low	197 Å²	197	148.5 Å²	148.5	92%	0.921	82%	0.815	S	S	*	*			trans	-157.3	159.9	167.5	-128.3	174.1	-142.5	0	0	117
223	A	27.3	Very low	30.8	Very low	80 Å²	80	148.3 Å²	148.3	66%	0.661	81%	0.811	S	S	*	*			trans	56.3	85	152.1	0	0	0	0	0	120.2	I225	A223-I225 PolarHBondContact O-N 2.86Å
224	R	29.4	Very low	31.2	Very low	216 Å²	216	143.8 Å²	143.8	82%	0.815	80%	0.804	S	S	*	*			trans	-65.1	115.4	158.2	179	-163.4	-158.4	173.1	11.6	112
225	I	32	Very low	31.9	Very low	155 Å²	155	143.3 Å²	143.3	80%	0.795	80%	0.802	S	S	*	*			trans	-108.1	124.6	165	-61.7	-179.8	0	0	0	109.9	A223	A223-I225 PolarHBondContact O-N 2.86Å
226	K	38	Very low	33	Very low	164 Å²	164	145.7 Å²	145.7	71%	0.713	80%	0.795	S	S	*	*			trans	-92.3	130.4	173	-70.7	-175.3	177	-176.3	0	110.8
227	K	27.4	Very low	34.5	Very low	195 Å²	195	143.8 Å²	143.8	85%	0.848	78%	0.78	S	S	*	*			trans	-138.4	162.3	156.4	-100.7	-177.4	-178.8	178.9	0	109.5
228	P	30.3	Very low	35.2	Very low	116 Å²	116	142 Å²	142	75%	0.753	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-78.9	151.7	-144.8	29.2	-36.6	0	0	0	115.1
229	T	29.3	Very low	37	Very low	129 Å²	129	137 Å²	137	79%	0.791	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.1	167.4	45.7	0	0	0	0	111.4
230	P	32.3	Very low	38.9	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-56.1	147.7	153.8	-17.8	31.6	0	0	0	109.3	T232	P230-T232 PolarHBondContact O-N 2.86Å
231	K	32.7	Very low	41.2	Very low	206 Å²	206	127.4 Å²	127.4	90%	0.896	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-67.8	119.2	171.1	-68	-177.6	179	-178.1	0	108.3
232	T	31.5	Very low	43.2	Very low	128 Å²	128	122.8 Å²	122.8	79%	0.785	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-59.6	129.3	172.5	-33.8	0	0	0	0	109	P230	P230-T232 PolarHBondContact O-N 2.86Å
233	P	35.4	Very low	45.3	Very low	100 Å²	100	118.5 Å²	118.5	65%	0.649	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-57.8	158.6	162.7	-20	32.8	0	0	0	110.1	K235	P233-K235 PolarHBondContact O-N 3.49Å
234	P	35.9	Very low	47.9	Very low	117 Å²	117	117.9 Å²	117.9	76%	0.76	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-55.3	136.5	169	25.8	-33.9	0	0	0	109.3	Q236	P234-Q236 PolarHBondContact O-N 2.68Å
235	K	42.8	Very low	50.2	Low	198 Å²	198	113.3 Å²	113.3	86%	0.861	59%	0.594	S	S	*	*			trans	-56.5	115.7	173.2	-75.2	-173.7	175.8	-174.9	0	107.8	P233 A237	P233-K235 PolarHBondContact O-N 3.49Å; K235-A237 PolarHBondContact O-N 2.93Å
236	Q	48.6	Very low	52.1	Low	152 Å²	152	106.4 Å²	106.4	71%	0.71	56%	0.56	S	S	*	*			trans	-62.7	131.7	169.6	-75.8	177	-32.5	0	0	108.4	P234 L238	P234-Q236 PolarHBondContact O-N 2.68Å; Q236-L238 HydrophobicContact CB-CD1 4.4Å; Q236-L238 HydrophobicContact CB-CD2 4.23Å; Q236-L238 HydrophobicContact CB-CG 4.01Å; Q236-L238 PolarHBondContact O-N 2.55Å
237	A	57	Low	53.8	Low	55 Å²	55	105.3 Å²	105.3	46%	0.455	56%	0.557	S	S	.	*			trans	-64.7	112.4	164.6	0	0	0	0	0	107.5	K235 Y319	K235-A237 PolarHBondContact O-N 2.93Å; A237-Y319 HydrophobicContact CB-CD1 3.81Å; A237-Y319 HydrophobicContact CB-CD2 3.9Å; A237-Y319 HydrophobicContact CB-CE1 3.56Å; A237-Y319 HydrophobicContact CB-CE2 3.65Å; A237-Y319 HydrophobicContact CB-CG 3.98Å; A237-Y319 VanDerWaalsContact CB-CZ 3.47Å
238	L	60.6	Low	55.5	Low	89 Å²	89	101 Å²	101	47%	0.466	54%	0.544	S	S	.	.			trans	-123.9	138.7	-177.2	-67.6	172.7	0	0	0	109.5	Q236 A266 N317	Q236-L238 HydrophobicContact CB-CD1 4.4Å; Q236-L238 HydrophobicContact CB-CD2 4.23Å; Q236-L238 HydrophobicContact CB-CG 4.01Å; Q236-L238 PolarHBondContact O-N 2.55Å; L238-A266 PolarHBondContact O-N 3.13Å; L238-N317 PolarHBondContact O-ND2 2.93Å
239	P	63.7	Low	57.7	Low	35 Å²	35	97.4 Å²	97.4	23%	0.227	52%	0.517	C	S	.	.			trans	-59	168.1	167	27.8	-35	0	0	0	110.1
240	P	74.9	Confident	59.9	Low	1 Å²	1	98.2 Å²	98.2	1%	0.006	51%	0.51	C	S	.	.			trans	-59.3	147	170.4	-21.5	37.2	0	0	0	109.9	S264 I269 L315 N317 G320 R322	P240-S264 CarbonylContact C-O 3.58Å; P240-S264 VanDerWaalsContact CA-O 3.32Å; P240-S264 WeakPolarHBondContact CA-O 3.13Å; P240-I269 HydrophobicContact CB-CG2 4.37Å; P240-I269 HydrophobicContact CG-CG2 4.17Å; P240-L315 HydrophobicContact CB-CB 3.64Å; P240-L315 HydrophobicContact CB-CD1 4.4Å; P240-L315 HydrophobicContact CG-CB 4.1Å; P240-L315 WeakPolarHBondContact CG-O 3.42Å; P240-N317 WeakPolarHBondContact CD-OD1 3.46Å; P240-N317 HydrophobicContact CG-CB 4.23Å; P240-G320 VanDerWaalsContact CD-O 3.22Å; P240-G320 WeakPolarHBondContact CD-O 3.47Å; P240-R322 WeakPolarHBondContact O-CG 3.12Å
241	Q	74.1	Confident	62.3	Low	117 Å²	117	94.1 Å²	94.1	55%	0.547	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128	173.3	-179.7	178.9	-0.3	0	0	108.2	L243 Y263 S264	Q241-L243 HydrophobicContact CG-CD2 4.2Å; Q241-Y263 CarbonylContact O-C 3.55Å; Q241-Y263 WeakPolarHBondContact O-CA 3.35Å; Q241-Y263 WeakPolarHBondContact O-CB 3.37Å; Q241-S264 PolarHBondContact N-O 2.81Å; Q241-S264 PolarHBondContact O-N 2.8Å
242	I	74.4	Confident	64.5	Low	12 Å²	12	87.6 Å²	87.6	6%	0.062	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.8	173.5	-62.1	177.1	0	0	0	107.9	Q244 F245 L315 A324	I242-Q244 WeakPolarHBondContact CG2-O 3.39Å; I242-F245 HydrophobicContact CB-CD1 4.42Å; I242-F245 HydrophobicContact CB-CD2 4.31Å; I242-F245 HydrophobicContact CB-CE1 4.1Å; I242-F245 HydrophobicContact CB-CE2 3.98Å; I242-F245 HydrophobicContact CB-CZ 3.86Å; I242-F245 HydrophobicContact CD1-CE1 4.26Å; I242-F245 HydrophobicContact CG2-CB 4.19Å; I242-F245 HydrophobicContact CG2-CD1 3.83Å; I242-F245 HydrophobicContact CG2-CD2 3.6Å; I242-F245 HydrophobicContact CG2-CE1 4.02Å; I242-F245 HydrophobicContact CG2-CE2 3.79Å; I242-F245 HydrophobicContact CG2-CG 3.6Å; I242-F245 HydrophobicContact CG2-CZ 3.99Å; I242-L315 HydrophobicContact CD1-CD1 4.22Å; I242-L315 HydrophobicContact CG1-CD1 3.59Å; I242-A324 HydrophobicContact CD1-CB 3.5Å
243	L	74.7	Confident	67	Low	107 Å²	107	83.4 Å²	83.4	56%	0.56	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	-32.6	-178.3	-62.4	-176.9	0	0	0	112.1	Q241 K262	Q241-L243 HydrophobicContact CG-CD2 4.2Å; L243-K262 HydrophobicContact CB-CB 4.47Å; L243-K262 PolarHBondContact N-O 3.44Å
244	Q	81.4	Confident	69.1	Low	67 Å²	67	80.4 Å²	80.4	31%	0.313	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	113.6	163	-177.9	177.4	-2.2	0	0	106.6	I242 C261 K262	I242-Q244 WeakPolarHBondContact CG2-O 3.39Å; Q244-C261 WeakPolarHBondContact O-CA 3.17Å; Q244-K262 HydrophobicContact CB-CB 3.75Å; Q244-K262 HydrophobicContact CB-CD 4.4Å; Q244-K262 HydrophobicContact CB-CG 3.91Å; Q244-K262 PolarHBondContact N-O 3.05Å; Q244-K262 PolarHBondContact O-N 3.33Å
245	F	77.4	Confident	71.6	Confident	120 Å²	120	79.6 Å²	79.6	53%	0.526	41%	0.407	S	S	.	.			trans	-69.8	144.7	171	-71.7	-103.4	0	0	0	108.7	I242 A324	I242-F245 HydrophobicContact CB-CD1 4.42Å; I242-F245 HydrophobicContact CB-CD2 4.31Å; I242-F245 HydrophobicContact CB-CE1 4.1Å; I242-F245 HydrophobicContact CB-CE2 3.98Å; I242-F245 HydrophobicContact CB-CZ 3.86Å; I242-F245 HydrophobicContact CD1-CE1 4.26Å; I242-F245 HydrophobicContact CG2-CB 4.19Å; I242-F245 HydrophobicContact CG2-CD1 3.83Å; I242-F245 HydrophobicContact CG2-CD2 3.6Å; I242-F245 HydrophobicContact CG2-CE1 4.02Å; I242-F245 HydrophobicContact CG2-CE2 3.79Å; I242-F245 HydrophobicContact CG2-CG 3.6Å; I242-F245 HydrophobicContact CG2-CZ 3.99Å; F245-A324 HydrophobicContact CD1-CB 3.65Å; F245-A324 HydrophobicContact CE1-CB 4.15Å
246	P	72.6	Confident	73.8	Confident	11 Å²	11	75.2 Å²	75.2	7%	0.071	39%	0.388	C	S	.	.			trans	-63.5	146.1	160.5	30.4	-33.4	0	0	0	109.4	I259 W273 V313 A324 L326	P246-I259 HydrophobicContact CB-CG2 4.18Å; P246-W273 HydrophobicContact CB-CH2 4.36Å; P246-W273 HydrophobicContact CG-CH2 4.45Å; P246-V313 HydrophobicContact CG-CG1 4.07Å; P246-A324 HydrophobicContact CG-CB 4.05Å; P246-L326 HydrophobicContact CB-CB 4.22Å; P246-L326 HydrophobicContact CB-CD2 3.52Å; P246-L326 HydrophobicContact CB-CG 4.45Å; P246-L326 HydrophobicContact CG-CD2 4.1Å
247	E	72.8	Confident	75.8	Confident	140 Å²	140	68 Å²	68	65%	0.654	35%	0.354	S	S	*	.			trans	-112.6	157.4	-177.4	-67.3	170.9	-152.8	0	0	110.3	M249	E247-M249 WeakPolarHBondContact O-CG 3.37Å
248	D	62.8	Low	77.5	Confident	106 Å²	106	69.3 Å²	69.3	57%	0.567	35%	0.351	S	S	*	.			trans	-65.2	131.3	174.7	-84.1	18.4	0	0	0	110.8	L326 N327	D248-L326 WeakPolarHBondContact OD1-CA 3.44Å; D248-N327 PolarHBondContact OD1-N 2.54Å; D248-N327 PolarHBondContact OD1-ND2 3.41Å; D248-N327 WeakPolarHBondContact OD2-CB 3.06Å; D248-N327 PolarHBondContact OD2-ND2 2.87Å
249	M	76	Confident	79	Confident	40 Å²	40	65.1 Å²	65.1	20%	0.197	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.7	-169.7	-71.5	175	71.5	0	0	112.1	E247 I251 V257 I259 N327 L328 T329	E247-M249 WeakPolarHBondContact O-CG 3.37Å; M249-I251 HydrophobicContact CB-CG1 4.38Å; M249-I251 HydrophobicContact CE-CD1 3.86Å; M249-I251 HydrophobicContact CE-CG1 4.06Å; M249-V257 HydrophobicContact CE-CG1 3.79Å; M249-V257 HydrophobicContact SD-CG1 4.36Å; M249-I259 HydrophobicContact SD-CG1 3.55Å; M249-I259 VanDerWaalsContact SD-CG1 3.55Å; M249-N327 PolarHBondContact N-O 3.08Å; M249-L328 HydrophobicContact CB-CD1 3.91Å; M249-T329 PolarHBondContact O-N 3.39Å
250	K	76.6	Confident	80.3	Confident	146 Å²	146	65.9 Å²	65.9	64%	0.635	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.3	165.4	-59.6	-163.8	176	-172.2	0	109.1	T329	K250-T329 WeakPolarHBondContact CA-O 3.34Å
251	I	82.3	Confident	81	Confident	29 Å²	29	65.9 Å²	65.9	15%	0.149	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.7	-172.7	-60.6	-64.6	0	0	0	108.9	M249 E255 V257 L328 T329 I330 V331	M249-I251 HydrophobicContact CB-CG1 4.38Å; M249-I251 HydrophobicContact CE-CD1 3.86Å; M249-I251 HydrophobicContact CE-CG1 4.06Å; I251-E255 HydrophobicContact CG2-CB 3.63Å; I251-V257 HydrophobicContact CB-CG2 4.5Å; I251-V257 HydrophobicContact CG1-CG2 4.39Å; I251-V257 HydrophobicContact CG2-CG2 4.19Å; I251-L328 HydrophobicContact CG1-CD1 4.27Å; I251-T329 PolarHBondContact N-O 3.41Å; I251-I330 HydrophobicContact CB-CD1 4.03Å; I251-I330 HydrophobicContact CG2-CD1 4.4Å; I251-I330 WeakPolarHBondContact O-CA 3.44Å; I251-V331 WeakPolarHBondContact O-CG2 3.35Å; I251-V331 PolarHBondContact O-N 2.99Å
252	L	79.8	Confident	81.7	Confident	70 Å²	70	64.5 Å²	64.5	37%	0.366	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	146.7	179.1	-72	161.2	0	0	0	111.3	G254 E255 V331 Y413	L252-G254 PolarHBondContact O-N 2.96Å; L252-E255 HydrophobicContact CB-CG 4.01Å; L252-E255 WeakPolarHBondContact CB-OE2 3.36Å; L252-E255 PolarHBondContact N-OE2 3.06Å; L252-E255 VanDerWaalsContact N-OE2 3.15Å; L252-E255 WeakPolarHBondContact O-CB 3.37Å; L252-E255 PolarHBondContact O-N 3.02Å; L252-V331 CarbonylContact C-O 3.57Å; L252-V331 VanDerWaalsContact CA-O 3.27Å; L252-V331 WeakPolarHBondContact CA-O 3.47Å; L252-V331 HydrophobicContact CD2-CG2 4.2Å; L252-Y413 HydrophobicContact CD2-CD1 4.05Å; L252-Y413 HydrophobicContact CD2-CG 4.25Å
253	A	82.3	Confident	82.3	Confident	40 Å²	40	64.1 Å²	64.1	33%	0.331	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	129.3	176.6	0	0	0	0	0	111.2	I330 V331 D332	A253-I330 HydrophobicContact CB-CG2 3.93Å; A253-V331 PolarHBondContact N-O 2.89Å; A253-D332 HydrophobicContact CB-CB 3.9Å
254	G	80.6	Confident	82.8	Confident	36 Å²	36	61.1 Å²	61.1	37%	0.371	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	-26	-173.8	0	0	0	0	0	115.1	L252 S302 G303	L252-G254 PolarHBondContact O-N 2.96Å; G254-S302 VanDerWaalsContact C-OG 3.3Å; G254-S302 VanDerWaalsContact CA-OG 3.3Å; G254-S302 WeakPolarHBondContact CA-OG 3.45Å; G254-S302 PolarHBondContact O-OG 2.84Å; G254-G303 PolarHBondContact N-O 3.07Å
255	E	87.7	Confident	82.6	Confident	100 Å²	100	59.4 Å²	59.4	47%	0.467	31%	0.309	S	S	.	.	S	Bend	trans	-73	153.5	-175.8	-66.3	-170.8	136.9	0	0	113.4	I251 L252 G303	I251-E255 HydrophobicContact CG2-CB 3.63Å; L252-E255 HydrophobicContact CB-CG 4.01Å; L252-E255 WeakPolarHBondContact CB-OE2 3.36Å; L252-E255 PolarHBondContact N-OE2 3.06Å; L252-E255 VanDerWaalsContact N-OE2 3.15Å; L252-E255 WeakPolarHBondContact O-CB 3.37Å; L252-E255 PolarHBondContact O-N 3.02Å; E255-G303 PolarHBondContact O-N 3.29Å
256	K	88.7	Confident	82.5	Confident	106 Å²	106	54.8 Å²	54.8	46%	0.461	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-71	133.7	179	-173.4	-166.5	177.7	-163.1	0	110.9	E258 T299 I300	K256-E258 HydrophobicContact CD-CG 4.23Å; K256-E258 VanDerWaalsContact CE-CD 3.4Å; K256-E258 WeakPolarHBondContact CE-OE2 3.4Å; K256-E258 IonicContact NZ-OE1 2.64Å; K256-E258 PolarHBondContact NZ-OE1 3.34Å; K256-E258 IonicContact NZ-OE2 2.76Å; K256-E258 PolarHBondContact NZ-OE2 2.83Å; K256-T299 HydrophobicContact CG-CG2 4.47Å; K256-I300 WeakPolarHBondContact CG-O 3.25Å
257	V	91.4	Very high	82.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.4	172.4	-168.1	0	0	0	0	109.4	M249 I251 I259 T299 I300 L328 I330	M249-V257 HydrophobicContact CE-CG1 3.79Å; M249-V257 HydrophobicContact SD-CG1 4.36Å; I251-V257 HydrophobicContact CB-CG2 4.5Å; I251-V257 HydrophobicContact CG1-CG2 4.39Å; I251-V257 HydrophobicContact CG2-CG2 4.19Å; V257-I259 HydrophobicContact CG1-CD1 4.08Å; V257-I259 HydrophobicContact CG1-CG1 4.13Å; V257-T299 WeakPolarHBondContact O-CA 3.02Å; V257-I300 HydrophobicContact CB-CB 3.93Å; V257-I300 HydrophobicContact CB-CD1 4.05Å; V257-I300 HydrophobicContact CB-CG1 4.1Å; V257-I300 HydrophobicContact CG1-CD1 4.35Å; V257-I300 HydrophobicContact CG2-CB 4.19Å; V257-I300 HydrophobicContact CG2-CD1 4.19Å; V257-I300 PolarHBondContact N-O 2.74Å; V257-I300 PolarHBondContact O-N 2.89Å; V257-L328 HydrophobicContact CG1-CD1 3.73Å; V257-L328 HydrophobicContact CG1-CD2 3.99Å; V257-L328 HydrophobicContact CG2-CD1 4.29Å; V257-L328 HydrophobicContact CG2-CD2 4.26Å; V257-I330 HydrophobicContact CG2-CD1 4.17Å
258	E	92.3	Very high	82.4	Confident	84 Å²	84	57.9 Å²	57.9	39%	0.393	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	106.9	169.1	-74.8	-171.7	112.6	0	0	110.2	K256 K297 T299	K256-E258 HydrophobicContact CD-CG 4.23Å; K256-E258 VanDerWaalsContact CE-CD 3.4Å; K256-E258 WeakPolarHBondContact CE-OE2 3.4Å; K256-E258 IonicContact NZ-OE1 2.64Å; K256-E258 PolarHBondContact NZ-OE1 3.34Å; K256-E258 IonicContact NZ-OE2 2.76Å; K256-E258 PolarHBondContact NZ-OE2 2.83Å; E258-K297 IonicContact OE1-NZ 3.06Å; E258-K297 PolarHBondContact OE1-NZ 3.22Å; E258-T299 HydrophobicContact CG-CG2 3.94Å
259	I	91.7	Very high	83.1	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.3	176.6	-76.3	157.5	0	0	0	107.8	P246 M249 V257 W273 K297 L298 L326 L328	P246-I259 HydrophobicContact CB-CG2 4.18Å; M249-I259 HydrophobicContact SD-CG1 3.55Å; M249-I259 VanDerWaalsContact SD-CG1 3.55Å; V257-I259 HydrophobicContact CG1-CD1 4.08Å; V257-I259 HydrophobicContact CG1-CG1 4.13Å; I259-W273 HydrophobicContact CG2-CE3 4.39Å; I259-W273 HydrophobicContact CG2-CH2 3.26Å; I259-W273 HydrophobicContact CG2-CZ2 4.1Å; I259-W273 HydrophobicContact CG2-CZ3 3.43Å; I259-W273 VanDerWaalsContact CG2-CZ3 3.43Å; I259-K297 CarbonylContact O-C 3.58Å; I259-K297 VanDerWaalsContact O-CA 3.24Å; I259-K297 WeakPolarHBondContact O-CA 3.5Å; I259-K297 WeakPolarHBondContact O-CG 3.46Å; I259-L298 HydrophobicContact CB-CB 4.29Å; I259-L298 HydrophobicContact CD1-CD2 4.18Å; I259-L298 HydrophobicContact CG2-CB 4.43Å; I259-L298 PolarHBondContact N-O 3.39Å; I259-L298 PolarHBondContact O-N 2.68Å; I259-L326 HydrophobicContact CB-CD2 4.34Å; I259-L326 HydrophobicContact CD1-CD1 3.9Å; I259-L326 HydrophobicContact CD1-CD2 3.97Å; I259-L326 HydrophobicContact CG1-CD1 4.15Å; I259-L326 HydrophobicContact CG1-CD2 3.98Å; I259-L326 HydrophobicContact CG2-CD2 3.42Å; I259-L326 VanDerWaalsContact CG2-CD2 3.42Å; I259-L328 HydrophobicContact CD1-CD2 4.45Å
260	L	90.8	Very high	83.4	Confident	51 Å²	51	56.6 Å²	56.6	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	124.2	-175.8	178.1	64.8	0	0	0	111.7	K262 K297	L260-K262 HydrophobicContact CD2-CG 4.5Å; L260-K262 HydrophobicContact CG-CG 4.4Å; L260-K297 HydrophobicContact CD1-CB 3.93Å; L260-K297 HydrophobicContact CD1-CG 4.31Å
261	C	89.6	Confident	84.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.5	164.8	-178.2	0	0	0	0	109.8	Q244 W273 S295 S296 V313	Q244-C261 WeakPolarHBondContact O-CA 3.17Å; C261-W273 HydrophobicContact CB-CH2 4.04Å; C261-W273 HydrophobicContact CB-CZ2 3.9Å; C261-S295 CarbonylContact O-C 3.56Å; C261-S295 VanDerWaalsContact O-CA 3.23Å; C261-S295 WeakPolarHBondContact O-CA 3.21Å; C261-S295 WeakPolarHBondContact O-CB 3.34Å; C261-S296 PolarHBondContact N-O 3.38Å; C261-S296 PolarHBondContact O-N 3Å; C261-S296 VanDerWaalsContact O-O 3.11Å; C261-V313 HydrophobicContact CB-CB 4.49Å; C261-V313 HydrophobicContact CB-CG1 4.01Å; C261-V313 HydrophobicContact CB-CG2 4.21Å
262	K	89.3	Confident	84.1	Confident	89 Å²	89	51.6 Å²	51.6	39%	0.387	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.2	167.4	-58	-166.1	178.4	93.8	0	110.1	L243 Q244 L260 S294	L243-K262 HydrophobicContact CB-CB 4.47Å; L243-K262 PolarHBondContact N-O 3.44Å; Q244-K262 HydrophobicContact CB-CB 3.75Å; Q244-K262 HydrophobicContact CB-CD 4.4Å; Q244-K262 HydrophobicContact CB-CG 3.91Å; Q244-K262 PolarHBondContact N-O 3.05Å; Q244-K262 PolarHBondContact O-N 3.33Å; L260-K262 HydrophobicContact CD2-CG 4.5Å; L260-K262 HydrophobicContact CG-CG 4.4Å; K262-S294 WeakPolarHBondContact CA-O 3.38Å
263	Y	87.7	Confident	84.5	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	166.9	-174.8	49.7	-106.8	0	0	0	113.6	Q241 I269 C271 T292 S294 S295 L315	Q241-Y263 CarbonylContact O-C 3.55Å; Q241-Y263 WeakPolarHBondContact O-CA 3.35Å; Q241-Y263 WeakPolarHBondContact O-CB 3.37Å; Y263-I269 HydrophobicContact CD2-CD1 4.25Å; Y263-C271 HydrophobicContact CE1-CB 4.44Å; Y263-T292 PolarHBondContact OH-O 3.03Å; Y263-S294 PolarHBondContact N-O 3.03Å; Y263-S294 CarbonylContact O-C 3.57Å; Y263-S294 WeakPolarHBondContact O-CA 3.36Å; Y263-S294 VanDerWaalsContact O-O 3.06Å; Y263-S295 VanDerWaalsContact CE1-C 3.46Å; Y263-S295 PolarHBondContact OH-O 3.35Å; Y263-L315 VanDerWaalsContact CB-CD1 3.44Å; Y263-L315 HydrophobicContact CD1-CD1 3.59Å; Y263-L315 HydrophobicContact CD1-CD2 3.46Å; Y263-L315 VanDerWaalsContact CD1-CD2 3.46Å; Y263-L315 HydrophobicContact CD1-CG 4.19Å; Y263-L315 HydrophobicContact CE1-CD1 4.5Å; Y263-L315 HydrophobicContact CE1-CD2 3.52Å; Y263-L315 HydrophobicContact CG-CD1 3.68Å; Y263-L315 HydrophobicContact CG-CD2 4.05Å
264	S	84.4	Confident	83.9	Confident	44 Å²	44	47.3 Å²	47.3	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	172.5	169.3	62.2	0	0	0	0	110.2	P240 Q241	P240-S264 CarbonylContact C-O 3.58Å; P240-S264 VanDerWaalsContact CA-O 3.32Å; P240-S264 WeakPolarHBondContact CA-O 3.13Å; Q241-S264 PolarHBondContact N-O 2.81Å; Q241-S264 PolarHBondContact O-N 2.8Å
265	G	77.1	Confident	83.6	Confident	32 Å²	32	47.5 Å²	47.5	33%	0.33	27%	0.268	S	S	.	.	S	Bend	trans	155.4	-174	178.3	0	0	0	0	0	110.9	P267	G265-P267 WeakPolarHBondContact O-CD 2.99Å
266	A	76.4	Confident	82	Confident	22 Å²	22	47.5 Å²	47.5	18%	0.182	27%	0.267	C	S	.	.	S	Bend	trans	-77.2	124.5	167.8	0	0	0	0	0	110.2	L238 I269 N317 Y319	L238-A266 PolarHBondContact O-N 3.13Å; A266-I269 WeakPolarHBondContact O-CG1 3.33Å; A266-N317 PolarHBondContact N-ND2 2.86Å; A266-N317 PolarHBondContact O-ND2 2.83Å; A266-Y319 HydrophobicContact CB-CD2 3.89Å; A266-Y319 HydrophobicContact CB-CE2 3.78Å
267	P	72.5	Confident	80.1	Confident	102 Å²	102	52.7 Å²	52.7	66%	0.662	28%	0.283	S	S	*	.	S	Bend	trans	-76.7	156.5	173.2	31.9	-34.9	0	0	0	111.6	G265	G265-P267 WeakPolarHBondContact O-CD 2.99Å
268	P	70.9	Confident	78.6	Confident	114 Å²	114	60.3 Å²	60.3	74%	0.74	32%	0.317	S	S	*	.	P	Polyproline II helix	cis	-71.6	141.1	-0.9	30.3	-35.1	0	0	0	112.5	N317	P268-N317 WeakPolarHBondContact O-CB 3.34Å
269	I	77	Confident	77.8	Confident	31 Å²	31	59.3 Å²	59.3	16%	0.159	32%	0.323	C	S	.	.			trans	-112.3	119.6	169.6	-58.1	175	0	0	0	106.7	P240 Y263 A266 L315 R316 N317	P240-I269 HydrophobicContact CB-CG2 4.37Å; P240-I269 HydrophobicContact CG-CG2 4.17Å; Y263-I269 HydrophobicContact CD2-CD1 4.25Å; A266-I269 WeakPolarHBondContact O-CG1 3.33Å; I269-L315 HydrophobicContact CG2-CB 4.14Å; I269-L315 HydrophobicContact CG2-CD2 4.36Å; I269-R316 CarbonylContact C-O 3.54Å; I269-R316 WeakPolarHBondContact CA-O 3.39Å; I269-N317 HydrophobicContact CG1-CB 4.31Å
270	T	83	Confident	77.3	Confident	88 Å²	88	61.2 Å²	61.2	54%	0.54	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.5	168.2	-56.2	0	0	0	0	108.3	L315 R316	T270-L315 WeakPolarHBondContact O-CA 3.09Å; T270-R316 PolarHBondContact N-O 3.45Å; T270-R316 PolarHBondContact O-N 2.73Å
271	C	89.6	Confident	76.3	Confident	22 Å²	22	67 Å²	67	15%	0.149	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.9	174.4	-176.4	0	0	0	0	109.7	Y263 T291 S296 E314 L315	Y263-C271 HydrophobicContact CE1-CB 4.44Å; C271-T291 HydrophobicContact CB-CG2 3.85Å; C271-S296 WeakPolarHBondContact SG-CB 3.38Å; C271-E314 CarbonylContact C-O 3.59Å; C271-E314 VanDerWaalsContact CA-O 3.31Å; C271-E314 WeakPolarHBondContact CA-O 3.49Å; C271-L315 HydrophobicContact CB-CD2 3.82Å; C271-L315 VanDerWaalsContact SG-CD2 3.59Å
272	T	84.2	Confident	74.8	Confident	49 Å²	49	74.2 Å²	74.2	30%	0.301	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.9	177	-53.6	0	0	0	0	109.2	L274 A279 E314	T272-L274 HydrophobicContact CG2-CD1 3.94Å; T272-L274 HydrophobicContact CG2-CG 4.19Å; T272-A279 HydrophobicContact CG2-CB 4.12Å; T272-E314 PolarHBondContact N-O 2.82Å; T272-E314 PolarHBondContact O-N 3.06Å
273	W	86.6	Confident	73.1	Confident	5 Å²	5	73.6 Å²	73.6	2%	0.019	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.5	166.1	-72.2	92.4	0	0	0	110.2	P246 I259 C261 I280 I289 S296 L298 T312 V313 L326	P246-W273 HydrophobicContact CB-CH2 4.36Å; P246-W273 HydrophobicContact CG-CH2 4.45Å; I259-W273 HydrophobicContact CG2-CE3 4.39Å; I259-W273 HydrophobicContact CG2-CH2 3.26Å; I259-W273 HydrophobicContact CG2-CZ2 4.1Å; I259-W273 HydrophobicContact CG2-CZ3 3.43Å; I259-W273 VanDerWaalsContact CG2-CZ3 3.43Å; C261-W273 HydrophobicContact CB-CH2 4.04Å; C261-W273 HydrophobicContact CB-CZ2 3.9Å; W273-I280 HydrophobicContact CB-CD1 4.13Å; W273-I280 PolarHBondContact O-N 3.31Å; W273-I289 HydrophobicContact CB-CD1 3.99Å; W273-I289 HydrophobicContact CG-CD1 4.3Å; W273-S296 PolarHBondContact NE1-OG 3.13Å; W273-L298 HydrophobicContact CB-CD1 3.94Å; W273-L298 HydrophobicContact CD2-CB 4.05Å; W273-L298 HydrophobicContact CD2-CD1 4.12Å; W273-L298 HydrophobicContact CE3-CB 4.43Å; W273-L298 HydrophobicContact CE3-CD1 4.26Å; W273-L298 HydrophobicContact CG-CB 4.34Å; W273-L298 HydrophobicContact CG-CD1 3.99Å; W273-T312 CarbonylContact C-O 3.52Å; W273-T312 WeakPolarHBondContact CA-O 3.41Å; W273-V313 HydrophobicContact CD2-CB 4.06Å; W273-V313 HydrophobicContact CD2-CG2 4.27Å; W273-V313 HydrophobicContact CE3-CB 3.84Å; W273-V313 HydrophobicContact CH2-CB 3.65Å; W273-V313 HydrophobicContact CH2-CG1 4.09Å; W273-V313 HydrophobicContact CH2-CG2 4.19Å; W273-V313 HydrophobicContact CZ2-CB 3.88Å; W273-V313 HydrophobicContact CZ2-CG2 3.9Å; W273-V313 HydrophobicContact CZ3-CB 3.65Å; W273-V313 HydrophobicContact CZ3-CG1 4.28Å; W273-L326 HydrophobicContact CZ3-CD2 4.14Å
274	L	70.8	Confident	71.6	Confident	15 Å²	15	76.1 Å²	76.1	8%	0.079	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.9	176.5	-54.4	91.6	0	0	0	109.8	T272 R277 K278 Y311 T312 E314	T272-L274 HydrophobicContact CG2-CD1 3.94Å; T272-L274 HydrophobicContact CG2-CG 4.19Å; L274-R277 WeakPolarHBondContact CD2-O 3.43Å; L274-K278 CarbonylContact C-O 3.59Å; L274-K278 WeakPolarHBondContact CA-O 3.13Å; L274-K278 WeakPolarHBondContact CB-O 3.39Å; L274-Y311 CarbonylContact O-C 3.53Å; L274-Y311 VanDerWaalsContact O-CA 3.26Å; L274-Y311 WeakPolarHBondContact O-CA 3.27Å; L274-T312 PolarHBondContact N-O 2.81Å; L274-T312 PolarHBondContact O-N 3.04Å; L274-E314 HydrophobicContact CD1-CB 4.24Å; L274-E314 VanDerWaalsContact CD1-CD 3.42Å; L274-E314 HydrophobicContact CD1-CG 3.4Å; L274-E314 VanDerWaalsContact CD1-CG 3.4Å
275	K	74.8	Confident	70.3	Confident	40 Å²	40	79.9 Å²	79.9	17%	0.174	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128	165.7	-164.6	-171.5	-177.5	-174.7	0	108.1	R277 K278 I280 E306 H307 C308 Y311	K275-R277 VanDerWaalsContact C-N 3.27Å; K275-R277 PolarHBondContact O-N 2.88Å; K275-K278 PolarHBondContact N-O 2.81Å; K275-K278 PolarHBondContact O-N 2.93Å; K275-I280 HydrophobicContact CB-CD1 4.08Å; K275-I280 HydrophobicContact CB-CG1 4.12Å; K275-E306 PolarHBondContact NZ-O 2.98Å; K275-H307 WeakPolarHBondContact CE-O 3.21Å; K275-H307 VanDerWaalsContact NZ-C 3.25Å; K275-H307 PolarHBondContact NZ-O 2.93Å; K275-H307 VanDerWaalsContact NZ-O 3.09Å; K275-C308 WeakPolarHBondContact CE-O 3.47Å; K275-C308 PolarHBondContact NZ-O 2.86Å; K275-Y311 HydrophobicContact CB-CD1 4.16Å; K275-Y311 HydrophobicContact CB-CE1 4.1Å; K275-Y311 HydrophobicContact CD-CE1 3.94Å; K275-Y311 HydrophobicContact CD-CE2 4.11Å; K275-Y311 WeakPolarHBondContact CE-OH 3.44Å; K275-Y311 HydrophobicContact CG-CD1 4.15Å; K275-Y311 HydrophobicContact CG-CD2 4.32Å; K275-Y311 HydrophobicContact CG-CE1 3.9Å; K275-Y311 HydrophobicContact CG-CE2 4.07Å; K275-Y311 HydrophobicContact CG-CG 4.35Å
276	F	52.1	Low	70.3	Confident	100 Å²	100	80.8 Å²	80.8	44%	0.439	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	46.6	-173.4	-54.2	-73	0	0	0	113.1	K278 C310	F276-K278 PolarHBondContact O-N 3.42Å; F276-K278 VanDerWaalsContact O-N 3.12Å; F276-C310 PolarHBondContact N-O 3.41Å
277	R	50.7	Low	70.7	Confident	214 Å²	214	80.9 Å²	80.9	81%	0.808	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	15.7	-174	-56.4	-170.6	-177.8	-159.2	3.7	116.4	L274 K275	L274-R277 WeakPolarHBondContact CD2-O 3.43Å; K275-R277 VanDerWaalsContact C-N 3.27Å; K275-R277 PolarHBondContact O-N 2.88Å
278	K	59.7	Low	71.3	Confident	161 Å²	161	78.9 Å²	78.9	70%	0.7	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	128	171.4	-66.8	177.6	-178.4	174.1	0	110.3	L274 K275 F276 I280	L274-K278 CarbonylContact C-O 3.59Å; L274-K278 WeakPolarHBondContact CA-O 3.13Å; L274-K278 WeakPolarHBondContact CB-O 3.39Å; K275-K278 PolarHBondContact N-O 2.81Å; K275-K278 PolarHBondContact O-N 2.93Å; F276-K278 PolarHBondContact O-N 3.42Å; F276-K278 VanDerWaalsContact O-N 3.12Å; K278-I280 PolarHBondContact O-N 2.87Å
279	A	75.2	Confident	72.3	Confident	63 Å²	63	74.9 Å²	74.9	52%	0.521	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	131.8	177.9	0	0	0	0	0	111.4	T272 Q281	T272-A279 HydrophobicContact CG2-CB 4.12Å; A279-Q281 PolarHBondContact O-N 2.64Å
280	I	80.9	Confident	72.9	Confident	40 Å²	40	78.8 Å²	78.8	21%	0.205	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-78.9	120.4	-180	-60.5	175.1	0	0	0	107.9	W273 K275 K278 V287 I289 L298 Y311	W273-I280 HydrophobicContact CB-CD1 4.13Å; W273-I280 PolarHBondContact O-N 3.31Å; K275-I280 HydrophobicContact CB-CD1 4.08Å; K275-I280 HydrophobicContact CB-CG1 4.12Å; K278-I280 PolarHBondContact O-N 2.87Å; I280-V287 HydrophobicContact CG2-CG1 4.26Å; I280-I289 HydrophobicContact CB-CD1 4.48Å; I280-I289 HydrophobicContact CG2-CD1 4.4Å; I280-L298 HydrophobicContact CD1-CD1 3.49Å; I280-L298 VanDerWaalsContact CD1-CD1 3.49Å; I280-Y311 HydrophobicContact CD1-CD1 3.74Å; I280-Y311 HydrophobicContact CD1-CE1 3.76Å
281	Q	69.8	Low	73.2	Confident	174 Å²	174	78 Å²	78	81%	0.813	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-81.2	123.5	178.6	-65.2	-176.5	-9.2	0	0	109.9	A279 G283	A279-Q281 PolarHBondContact O-N 2.64Å; Q281-G283 PolarHBondContact O-N 2.89Å
282	E	58.8	Low	73.2	Confident	151 Å²	151	80.4 Å²	80.4	71%	0.706	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	116.4	170.4	-65.2	-177	155.3	0	0	109.4	I289	E282-I289 HydrophobicContact CG-CD1 4.44Å
283	G	51.9	Low	73.1	Confident	76 Å²	76	84.5 Å²	84.5	78%	0.784	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	145.8	-4.2	179.8	0	0	0	0	0	116.9	Q281	Q281-G283 PolarHBondContact O-N 2.89Å
284	S	57.2	Low	73.1	Confident	56 Å²	56	87 Å²	87	39%	0.392	48%	0.476	S	S	.	.			trans	-70.3	156.7	164.8	71.7	0	0	0	0	110.7	D286	S284-D286 WeakPolarHBondContact CB-OD1 2.99Å; S284-D286 PolarHBondContact O-N 2.99Å; S284-D286 VanDerWaalsContact O-N 3.17Å; S284-D286 PolarHBondContact OG-OD1 2.86Å
285	S	56.8	Low	74.1	Confident	123 Å²	123	87.5 Å²	87.5	86%	0.86	48%	0.481	S	S	*	.	S	Bend	trans	-76	0.4	-170.6	40.8	0	0	0	0	115.3
286	D	77.9	Confident	75	Confident	50 Å²	50	85.6 Å²	85.6	27%	0.267	47%	0.473	S	S	.	.	S	Bend	trans	-137.7	-20.6	-159.1	36	35.3	0	0	0	113.4	S284 I300 S301	S284-D286 WeakPolarHBondContact CB-OD1 2.99Å; S284-D286 PolarHBondContact O-N 2.99Å; S284-D286 VanDerWaalsContact O-N 3.17Å; S284-D286 PolarHBondContact OG-OD1 2.86Å; D286-I300 CarbonylContact O-C 3.6Å; D286-I300 WeakPolarHBondContact O-CA 3.31Å; D286-S301 PolarHBondContact O-N 3.17Å; D286-S301 PolarHBondContact O-OG 3.13Å
287	V	83.8	Confident	77	Confident	24 Å²	24	82.8 Å²	82.8	15%	0.145	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.3	-179	-174.9	0	0	0	0	111.1	I280 L298 T299 I300	I280-V287 HydrophobicContact CG2-CG1 4.26Å; V287-L298 HydrophobicContact CG1-CD1 4.48Å; V287-L298 HydrophobicContact CG1-CD2 4.26Å; V287-L298 HydrophobicContact CG1-CG 4.18Å; V287-T299 WeakPolarHBondContact CA-O 3.36Å; V287-I300 HydrophobicContact CG2-CG1 4.34Å; V287-I300 HydrophobicContact CG2-CG2 4.42Å
288	S	86.2	Confident	79	Confident	61 Å²	61	72.6 Å²	72.6	43%	0.427	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.9	177.4	59.6	0	0	0	0	111	T299	S288-T299 PolarHBondContact N-O 2.9Å; S288-T299 PolarHBondContact O-N 3.36Å
289	I	91.2	Very high	80.6	Confident	30 Å²	30	65.4 Å²	65.4	15%	0.154	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.5	177.5	-62.7	166.9	0	0	0	108.7	W273 I280 E282 T291 K297 L298	W273-I289 HydrophobicContact CB-CD1 3.99Å; W273-I289 HydrophobicContact CG-CD1 4.3Å; I280-I289 HydrophobicContact CB-CD1 4.48Å; I280-I289 HydrophobicContact CG2-CD1 4.4Å; E282-I289 HydrophobicContact CG-CD1 4.44Å; I289-T291 WeakPolarHBondContact CG2-OG1 3.42Å; I289-K297 WeakPolarHBondContact CA-O 3.44Å; I289-L298 HydrophobicContact CG1-CB 4.47Å; I289-L298 HydrophobicContact CG1-CD1 4.4Å; I289-L298 HydrophobicContact CG1-CG 4.3Å
290	E	89.4	Confident	81.4	Confident	113 Å²	113	62.4 Å²	62.4	53%	0.528	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	108.4	174.3	-70.2	177.1	175.8	0	0	108.8	S296 K297	E290-S296 CarbonylContact O-C 3.27Å; E290-S296 VanDerWaalsContact O-CA 3.29Å; E290-S296 WeakPolarHBondContact O-CA 3.27Å; E290-K297 PolarHBondContact N-O 2.83Å; E290-K297 PolarHBondContact O-N 3.13Å; E290-K297 IonicContact OE1-NZ 3.7Å; E290-K297 WeakPolarHBondContact OE2-CE 3.26Å; E290-K297 IonicContact OE2-NZ 2.86Å; E290-K297 PolarHBondContact OE2-NZ 3.39Å
291	T	88.9	Confident	81.7	Confident	71 Å²	71	64.2 Å²	64.2	44%	0.436	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.6	-175.3	-64.7	0	0	0	0	112	C271 I289 S296	C271-T291 HydrophobicContact CB-CG2 3.85Å; I289-T291 WeakPolarHBondContact CG2-OG1 3.42Å; T291-S296 PolarHBondContact OG1-OG 3.16Å
292	T	89.4	Confident	82.5	Confident	72 Å²	72	57.7 Å²	57.7	44%	0.442	36%	0.356	S	S	.	.			trans	-133.6	-176.2	-177.3	65.2	0	0	0	0	111.1	Y263 S294 S295	Y263-T292 PolarHBondContact OH-O 3.03Å; T292-S294 PolarHBondContact O-N 2.94Å; T292-S294 PolarHBondContact OG1-N 2.84Å; T292-S295 PolarHBondContact N-O 3.37Å; T292-S295 PolarHBondContact OG1-N 2.8Å; T292-S295 PolarHBondContact OG1-O 2.82Å; T292-S295 PolarHBondContact OG1-OG 3.13Å; T292-S295 VanDerWaalsContact OG1-OG 3.05Å
293	D	83.1	Confident	83.5	Confident	135 Å²	135	50.5 Å²	50.5	72%	0.722	32%	0.323	S	S	*	.	S	Bend	trans	-68.2	-15.8	175.2	68.5	-13.3	0	0	0	114.3
294	S	86.1	Confident	84.8	Confident	57 Å²	57	50.7 Å²	50.7	40%	0.399	30%	0.304	S	S	.	.	S	Bend	trans	-142	-1.6	-167.3	49.6	0	0	0	0	114.7	K262 Y263 T292	K262-S294 WeakPolarHBondContact CA-O 3.38Å; Y263-S294 PolarHBondContact N-O 3.03Å; Y263-S294 CarbonylContact O-C 3.57Å; Y263-S294 WeakPolarHBondContact O-CA 3.36Å; Y263-S294 VanDerWaalsContact O-O 3.06Å; T292-S294 PolarHBondContact O-N 2.94Å; T292-S294 PolarHBondContact OG1-N 2.84Å
295	S	92.5	Very high	85.2	Confident	27 Å²	27	50.8 Å²	50.8	19%	0.189	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	154.1	173.5	61.7	0	0	0	0	112.8	C261 Y263 T292	C261-S295 CarbonylContact O-C 3.56Å; C261-S295 VanDerWaalsContact O-CA 3.23Å; C261-S295 WeakPolarHBondContact O-CA 3.21Å; C261-S295 WeakPolarHBondContact O-CB 3.34Å; Y263-S295 VanDerWaalsContact CE1-C 3.46Å; Y263-S295 PolarHBondContact OH-O 3.35Å; T292-S295 PolarHBondContact N-O 3.37Å; T292-S295 PolarHBondContact OG1-N 2.8Å; T292-S295 PolarHBondContact OG1-O 2.82Å; T292-S295 PolarHBondContact OG1-OG 3.13Å; T292-S295 VanDerWaalsContact OG1-OG 3.05Å
296	S	93.3	Very high	85.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.6	166.9	-176.1	0	0	0	0	109.8	C261 C271 W273 E290 T291	C261-S296 PolarHBondContact N-O 3.38Å; C261-S296 PolarHBondContact O-N 3Å; C261-S296 VanDerWaalsContact O-O 3.11Å; C271-S296 WeakPolarHBondContact SG-CB 3.38Å; W273-S296 PolarHBondContact NE1-OG 3.13Å; E290-S296 CarbonylContact O-C 3.27Å; E290-S296 VanDerWaalsContact O-CA 3.29Å; E290-S296 WeakPolarHBondContact O-CA 3.27Å; T291-S296 PolarHBondContact OG1-OG 3.16Å
297	K	94.3	Very high	85.6	Confident	41 Å²	41	49.7 Å²	49.7	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.4	-177.4	-174.4	-166.9	63.3	170.3	0	109.9	E258 I259 L260 I289 E290 T299	E258-K297 IonicContact OE1-NZ 3.06Å; E258-K297 PolarHBondContact OE1-NZ 3.22Å; I259-K297 CarbonylContact O-C 3.58Å; I259-K297 VanDerWaalsContact O-CA 3.24Å; I259-K297 WeakPolarHBondContact O-CA 3.5Å; I259-K297 WeakPolarHBondContact O-CG 3.46Å; L260-K297 HydrophobicContact CD1-CB 3.93Å; L260-K297 HydrophobicContact CD1-CG 4.31Å; I289-K297 WeakPolarHBondContact CA-O 3.44Å; E290-K297 PolarHBondContact N-O 2.83Å; E290-K297 PolarHBondContact O-N 3.13Å; E290-K297 IonicContact OE1-NZ 3.7Å; E290-K297 WeakPolarHBondContact OE2-CE 3.26Å; E290-K297 IonicContact OE2-NZ 2.86Å; E290-K297 PolarHBondContact OE2-NZ 3.39Å; K297-T299 VanDerWaalsContact CE-OG1 3.26Å; K297-T299 WeakPolarHBondContact CE-OG1 3.39Å
298	L	93.1	Very high	84.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.9	169	-175.7	154.2	0	0	0	108.7	I259 W273 I280 V287 I289 I300 Y311	I259-L298 HydrophobicContact CB-CB 4.29Å; I259-L298 HydrophobicContact CD1-CD2 4.18Å; I259-L298 HydrophobicContact CG2-CB 4.43Å; I259-L298 PolarHBondContact N-O 3.39Å; I259-L298 PolarHBondContact O-N 2.68Å; W273-L298 HydrophobicContact CB-CD1 3.94Å; W273-L298 HydrophobicContact CD2-CB 4.05Å; W273-L298 HydrophobicContact CD2-CD1 4.12Å; W273-L298 HydrophobicContact CE3-CB 4.43Å; W273-L298 HydrophobicContact CE3-CD1 4.26Å; W273-L298 HydrophobicContact CG-CB 4.34Å; W273-L298 HydrophobicContact CG-CD1 3.99Å; I280-L298 HydrophobicContact CD1-CD1 3.49Å; I280-L298 VanDerWaalsContact CD1-CD1 3.49Å; V287-L298 HydrophobicContact CG1-CD1 4.48Å; V287-L298 HydrophobicContact CG1-CD2 4.26Å; V287-L298 HydrophobicContact CG1-CG 4.18Å; I289-L298 HydrophobicContact CG1-CB 4.47Å; I289-L298 HydrophobicContact CG1-CD1 4.4Å; I289-L298 HydrophobicContact CG1-CG 4.3Å; L298-I300 HydrophobicContact CD2-CD1 4.14Å; L298-I300 HydrophobicContact CD2-CG1 3.72Å; L298-Y311 HydrophobicContact CD1-CD1 4.08Å; L298-Y311 HydrophobicContact CD1-CE1 4.23Å; L298-Y311 HydrophobicContact CD2-CE1 4.47Å
299	T	92.4	Very high	83.3	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.8	179.9	-57.2	0	0	0	0	110	K256 V257 E258 V287 S288 K297	K256-T299 HydrophobicContact CG-CG2 4.47Å; V257-T299 WeakPolarHBondContact O-CA 3.02Å; E258-T299 HydrophobicContact CG-CG2 3.94Å; V287-T299 WeakPolarHBondContact CA-O 3.36Å; S288-T299 PolarHBondContact N-O 2.9Å; S288-T299 PolarHBondContact O-N 3.36Å; K297-T299 VanDerWaalsContact CE-OG1 3.26Å; K297-T299 WeakPolarHBondContact CE-OG1 3.39Å
300	I	92.1	Very high	82.1	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.7	172.8	-46.1	174.8	0	0	0	107.3	K256 V257 D286 V287 L298 S302 H307 L328	K256-I300 WeakPolarHBondContact CG-O 3.25Å; V257-I300 HydrophobicContact CB-CB 3.93Å; V257-I300 HydrophobicContact CB-CD1 4.05Å; V257-I300 HydrophobicContact CB-CG1 4.1Å; V257-I300 HydrophobicContact CG1-CD1 4.35Å; V257-I300 HydrophobicContact CG2-CB 4.19Å; V257-I300 HydrophobicContact CG2-CD1 4.19Å; V257-I300 PolarHBondContact N-O 2.74Å; V257-I300 PolarHBondContact O-N 2.89Å; D286-I300 CarbonylContact O-C 3.6Å; D286-I300 WeakPolarHBondContact O-CA 3.31Å; V287-I300 HydrophobicContact CG2-CG1 4.34Å; V287-I300 HydrophobicContact CG2-CG2 4.42Å; L298-I300 HydrophobicContact CD2-CD1 4.14Å; L298-I300 HydrophobicContact CD2-CG1 3.72Å; I300-S302 VanDerWaalsContact C-N 3.26Å; I300-S302 PolarHBondContact O-N 3.34Å; I300-H307 HydrophobicContact CD1-CB 4.06Å; I300-H307 VanDerWaalsContact CG2-CD2 3.44Å; I300-H307 WeakPolarHBondContact CG2-CD2 3.39Å; I300-L328 HydrophobicContact CD1-CD2 3.68Å
301	S	87.1	Confident	81.5	Confident	78 Å²	78	42.9 Å²	42.9	55%	0.545	25%	0.247	S	C	.	.	S	Bend	trans	-66.9	-26.1	-171	57.1	0	0	0	0	114.1	D286	D286-S301 PolarHBondContact O-N 3.17Å; D286-S301 PolarHBondContact O-OG 3.13Å
302	S	86.8	Confident	80.9	Confident	37 Å²	37	40.4 Å²	40.4	26%	0.259	23%	0.232	S	C	.	.	S	Bend	trans	-156.5	122	174.2	-174.4	0	0	0	0	109.3	G254 I300 Q304	G254-S302 VanDerWaalsContact C-OG 3.3Å; G254-S302 VanDerWaalsContact CA-OG 3.3Å; G254-S302 WeakPolarHBondContact CA-OG 3.45Å; G254-S302 PolarHBondContact O-OG 2.84Å; I300-S302 VanDerWaalsContact C-N 3.26Å; I300-S302 PolarHBondContact O-N 3.34Å; S302-Q304 PolarHBondContact O-N 3.28Å; S302-Q304 PolarHBondContact OG-NE2 2.72Å; S302-Q304 VanDerWaalsContact OG-NE2 3.13Å
303	G	79.9	Confident	80.6	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.			trans	-70.2	116.4	-179.9	0	0	0	0	0	111	G254 E255	G254-G303 PolarHBondContact N-O 3.07Å; E255-G303 PolarHBondContact O-N 3.29Å
304	Q	79.8	Confident	80.6	Confident	81 Å²	81	32.6 Å²	32.6	38%	0.379	19%	0.186	S	C	.	.			trans	-119.8	156	175.5	-57.4	-59.5	-39.1	0	0	109.1	S302 E306 H307 I330	S302-Q304 PolarHBondContact O-N 3.28Å; S302-Q304 PolarHBondContact OG-NE2 2.72Å; S302-Q304 VanDerWaalsContact OG-NE2 3.13Å; Q304-E306 HydrophobicContact CB-CG 4.18Å; Q304-E306 PolarHBondContact O-N 2.76Å; Q304-H307 PolarHBondContact N-ND1 2.82Å; Q304-H307 WeakPolarHBondContact O-CA 3.32Å; Q304-H307 VanDerWaalsContact O-CB 3.24Å; Q304-H307 WeakPolarHBondContact O-CB 3.27Å; Q304-H307 PolarHBondContact O-N 3.15Å; Q304-H307 PolarHBondContact O-ND1 3.42Å; Q304-I330 WeakPolarHBondContact O-CG1 3.42Å
305	Q	64.8	Low	80.1	Confident	58 Å²	58	29.9 Å²	29.9	27%	0.271	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-57.1	-26.6	-174.4	-178.8	61.7	3.5	0	0	114.1	H307 C308 Y360	Q305-H307 PolarHBondContact O-N 2.82Å; Q305-C308 WeakPolarHBondContact O-CB 3.42Å; Q305-C308 PolarHBondContact O-N 2.76Å; Q305-C308 PolarHBondContact O-SG 3.5Å; Q305-C308 VanDerWaalsContact O-SG 3.4Å; Q305-C308 PolarHBondContact OE1-SG 2.84Å; Q305-Y360 PolarHBondContact OE1-OH 3.04Å; Q305-Y360 VanDerWaalsContact OE1-OH 3.07Å
306	E	67.6	Low	79.4	Confident	136 Å²	136	35.6 Å²	35.6	64%	0.636	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-64.4	-21.1	172	72.4	-160.8	149.9	0	0	114.1	K275 Q304	K275-E306 PolarHBondContact NZ-O 2.98Å; Q304-E306 HydrophobicContact CB-CG 4.18Å; Q304-E306 PolarHBondContact O-N 2.76Å
307	H	76.3	Confident	78.8	Confident	14 Å²	14	36.3 Å²	36.3	7%	0.065	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-80.5	-14.4	178.3	-66.8	89.9	0	0	0	113.1	K275 I300 Q304 Q305 Y311 L328	K275-H307 WeakPolarHBondContact CE-O 3.21Å; K275-H307 VanDerWaalsContact NZ-C 3.25Å; K275-H307 PolarHBondContact NZ-O 2.93Å; K275-H307 VanDerWaalsContact NZ-O 3.09Å; I300-H307 HydrophobicContact CD1-CB 4.06Å; I300-H307 VanDerWaalsContact CG2-CD2 3.44Å; I300-H307 WeakPolarHBondContact CG2-CD2 3.39Å; Q304-H307 PolarHBondContact N-ND1 2.82Å; Q304-H307 WeakPolarHBondContact O-CA 3.32Å; Q304-H307 VanDerWaalsContact O-CB 3.24Å; Q304-H307 WeakPolarHBondContact O-CB 3.27Å; Q304-H307 PolarHBondContact O-N 3.15Å; Q304-H307 PolarHBondContact O-ND1 3.42Å; Q305-H307 PolarHBondContact O-N 2.82Å; H307-Y311 VanDerWaalsContact O-CE2 3.26Å; H307-Y311 WeakPolarHBondContact O-CE2 3.3Å; H307-Y311 PolarHBondContact O-OH 3.39Å; H307-L328 HydrophobicContact CB-CD2 4.35Å
308	C	66.7	Low	77.4	Confident	22 Å²	22	38 Å²	38	15%	0.149	22%	0.218	C	C	.	.			trans	-55.7	152.2	174.3	-66.4	0	0	0	0	113	K275 Q305 L328 I330	K275-C308 WeakPolarHBondContact CE-O 3.47Å; K275-C308 PolarHBondContact NZ-O 2.86Å; Q305-C308 WeakPolarHBondContact O-CB 3.42Å; Q305-C308 PolarHBondContact O-N 2.76Å; Q305-C308 PolarHBondContact O-SG 3.5Å; Q305-C308 VanDerWaalsContact O-SG 3.4Å; Q305-C308 PolarHBondContact OE1-SG 2.84Å; C308-L328 VanDerWaalsContact CA-O 3.28Å; C308-L328 WeakPolarHBondContact CA-O 3.39Å; C308-I330 PolarHBondContact SG-N 3.41Å
309	G	54.7	Low	76.3	Confident	16 Å²	16	44.8 Å²	44.8	17%	0.165	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.7	-176.9	172.6	0	0	0	0	0	114.7	Y311 L328	G309-Y311 WeakPolarHBondContact O-CD2 3.39Å; G309-L328 PolarHBondContact N-O 3.35Å; G309-L328 PolarHBondContact O-N 3.12Å
310	C	65	Low	74.5	Confident	41 Å²	41	45.6 Å²	45.6	28%	0.277	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	123.2	176.7	178.9	0	0	0	0	111	F276 L326	F276-C310 PolarHBondContact N-O 3.41Å; C310-L326 WeakPolarHBondContact CA-O 3.26Å
311	Y	78	Confident	72.8	Confident	6 Å²	6	48.2 Å²	48.2	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.5	172	-69.2	-106.7	0	0	0	109.7	L274 K275 I280 L298 H307 G309 A325 L326 L328	L274-Y311 CarbonylContact O-C 3.53Å; L274-Y311 VanDerWaalsContact O-CA 3.26Å; L274-Y311 WeakPolarHBondContact O-CA 3.27Å; K275-Y311 HydrophobicContact CB-CD1 4.16Å; K275-Y311 HydrophobicContact CB-CE1 4.1Å; K275-Y311 HydrophobicContact CD-CE1 3.94Å; K275-Y311 HydrophobicContact CD-CE2 4.11Å; K275-Y311 WeakPolarHBondContact CE-OH 3.44Å; K275-Y311 HydrophobicContact CG-CD1 4.15Å; K275-Y311 HydrophobicContact CG-CD2 4.32Å; K275-Y311 HydrophobicContact CG-CE1 3.9Å; K275-Y311 HydrophobicContact CG-CE2 4.07Å; K275-Y311 HydrophobicContact CG-CG 4.35Å; I280-Y311 HydrophobicContact CD1-CD1 3.74Å; I280-Y311 HydrophobicContact CD1-CE1 3.76Å; L298-Y311 HydrophobicContact CD1-CD1 4.08Å; L298-Y311 HydrophobicContact CD1-CE1 4.23Å; L298-Y311 HydrophobicContact CD2-CE1 4.47Å; H307-Y311 VanDerWaalsContact O-CE2 3.26Å; H307-Y311 WeakPolarHBondContact O-CE2 3.3Å; H307-Y311 PolarHBondContact O-OH 3.39Å; G309-Y311 WeakPolarHBondContact O-CD2 3.39Å; Y311-A325 CarbonylContact O-C 3.55Å; Y311-A325 VanDerWaalsContact O-CA 3.24Å; Y311-A325 WeakPolarHBondContact O-CA 3.42Å; Y311-L326 PolarHBondContact N-O 2.83Å; Y311-L326 PolarHBondContact O-N 3.31Å; Y311-L328 HydrophobicContact CD2-CB 4.04Å; Y311-L328 HydrophobicContact CE2-CB 3.81Å; Y311-L328 HydrophobicContact CE2-CD2 3.88Å; Y311-L328 HydrophobicContact CE2-CG 4.49Å
312	T	75.1	Confident	72	Confident	19 Å²	19	50.2 Å²	50.2	12%	0.117	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.2	176.3	-49.7	0	0	0	0	109.5	W273 L274 E314 Q323 A324	W273-T312 CarbonylContact C-O 3.52Å; W273-T312 WeakPolarHBondContact CA-O 3.41Å; L274-T312 PolarHBondContact N-O 2.81Å; L274-T312 PolarHBondContact O-N 3.04Å; T312-E314 HydrophobicContact CG2-CG 4.07Å; T312-Q323 HydrophobicContact CG2-CB 4.2Å; T312-A324 CarbonylContact C-O 3.51Å; T312-A324 VanDerWaalsContact CA-O 3.32Å; T312-A324 WeakPolarHBondContact CA-O 3.45Å
313	V	83.6	Confident	71	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.3	161.1	60.2	0	0	0	0	109	P246 C261 W273 L315 Q323 A324	P246-V313 HydrophobicContact CG-CG1 4.07Å; C261-V313 HydrophobicContact CB-CB 4.49Å; C261-V313 HydrophobicContact CB-CG1 4.01Å; C261-V313 HydrophobicContact CB-CG2 4.21Å; W273-V313 HydrophobicContact CD2-CB 4.06Å; W273-V313 HydrophobicContact CD2-CG2 4.27Å; W273-V313 HydrophobicContact CE3-CB 3.84Å; W273-V313 HydrophobicContact CH2-CB 3.65Å; W273-V313 HydrophobicContact CH2-CG1 4.09Å; W273-V313 HydrophobicContact CH2-CG2 4.19Å; W273-V313 HydrophobicContact CZ2-CB 3.88Å; W273-V313 HydrophobicContact CZ2-CG2 3.9Å; W273-V313 HydrophobicContact CZ3-CB 3.65Å; W273-V313 HydrophobicContact CZ3-CG1 4.28Å; V313-L315 HydrophobicContact CG2-CD2 4.12Å; V313-L315 HydrophobicContact CG2-CG 4.42Å; V313-Q323 CarbonylContact O-C 3.32Å; V313-Q323 WeakPolarHBondContact O-CA 3.48Å; V313-A324 HydrophobicContact CG1-CB 3.96Å; V313-A324 PolarHBondContact N-O 2.7Å; V313-A324 PolarHBondContact O-N 3.15Å
314	E	82.7	Confident	70	Confident	42 Å²	42	54 Å²	54	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134	175.1	-59.2	-169.1	159.4	0	0	110.3	C271 T272 L274 T312 L321 Q323	C271-E314 CarbonylContact C-O 3.59Å; C271-E314 VanDerWaalsContact CA-O 3.31Å; C271-E314 WeakPolarHBondContact CA-O 3.49Å; T272-E314 PolarHBondContact N-O 2.82Å; T272-E314 PolarHBondContact O-N 3.06Å; L274-E314 HydrophobicContact CD1-CB 4.24Å; L274-E314 VanDerWaalsContact CD1-CD 3.42Å; L274-E314 HydrophobicContact CD1-CG 3.4Å; L274-E314 VanDerWaalsContact CD1-CG 3.4Å; T312-E314 HydrophobicContact CG2-CG 4.07Å; E314-L321 HydrophobicContact CB-CD1 4.26Å; E314-Q323 HydrophobicContact CG-CG 3.99Å; E314-Q323 PolarHBondContact OE1-NE2 3.2Å
315	L	76.9	Confident	69.2	Low	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.9	-179.5	-56.8	176.2	0	0	0	108.3	P240 I242 Y263 I269 T270 C271 V313 L321 R322	P240-L315 HydrophobicContact CB-CB 3.64Å; P240-L315 HydrophobicContact CB-CD1 4.4Å; P240-L315 HydrophobicContact CG-CB 4.1Å; P240-L315 WeakPolarHBondContact CG-O 3.42Å; I242-L315 HydrophobicContact CD1-CD1 4.22Å; I242-L315 HydrophobicContact CG1-CD1 3.59Å; Y263-L315 VanDerWaalsContact CB-CD1 3.44Å; Y263-L315 HydrophobicContact CD1-CD1 3.59Å; Y263-L315 HydrophobicContact CD1-CD2 3.46Å; Y263-L315 VanDerWaalsContact CD1-CD2 3.46Å; Y263-L315 HydrophobicContact CD1-CG 4.19Å; Y263-L315 HydrophobicContact CE1-CD1 4.5Å; Y263-L315 HydrophobicContact CE1-CD2 3.52Å; Y263-L315 HydrophobicContact CG-CD1 3.68Å; Y263-L315 HydrophobicContact CG-CD2 4.05Å; I269-L315 HydrophobicContact CG2-CB 4.14Å; I269-L315 HydrophobicContact CG2-CD2 4.36Å; T270-L315 WeakPolarHBondContact O-CA 3.09Å; C271-L315 HydrophobicContact CB-CD2 3.82Å; C271-L315 VanDerWaalsContact SG-CD2 3.59Å; V313-L315 HydrophobicContact CG2-CD2 4.12Å; V313-L315 HydrophobicContact CG2-CG 4.42Å; L315-L321 CarbonylContact O-C 3.57Å; L315-L321 WeakPolarHBondContact O-CA 3.22Å; L315-R322 PolarHBondContact N-O 2.62Å; L315-R322 PolarHBondContact O-N 2.81Å
316	R	77.8	Confident	70	Confident	147 Å²	147	50.2 Å²	50.2	56%	0.555	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	133.4	-178	-174.1	-179.4	-70.2	-110.1	3.4	110.9	I269 T270 L321	I269-R316 CarbonylContact C-O 3.54Å; I269-R316 WeakPolarHBondContact CA-O 3.39Å; T270-R316 PolarHBondContact N-O 3.45Å; T270-R316 PolarHBondContact O-N 2.73Å; R316-L321 HydrophobicContact CB-CD1 4.22Å
317	N	79.3	Confident	69.9	Low	15 Å²	15	46.2 Å²	46.2	8%	0.08	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	179.3	160.7	74.7	9.5	0	0	0	109.9	L238 P240 A266 P268 I269 Y319 G320	L238-N317 PolarHBondContact O-ND2 2.93Å; P240-N317 WeakPolarHBondContact CD-OD1 3.46Å; P240-N317 HydrophobicContact CG-CB 4.23Å; A266-N317 PolarHBondContact N-ND2 2.86Å; A266-N317 PolarHBondContact O-ND2 2.83Å; P268-N317 WeakPolarHBondContact O-CB 3.34Å; I269-N317 HydrophobicContact CG1-CB 4.31Å; N317-Y319 PolarHBondContact O-N 3.5Å; N317-Y319 WeakPolarHBondContact OD1-CA 3.38Å; N317-Y319 WeakPolarHBondContact OD1-CB 3.37Å; N317-Y319 PolarHBondContact OD1-N 3.06Å; N317-G320 PolarHBondContact N-O 3.26Å; N317-G320 VanDerWaalsContact N-O 3.1Å; N317-G320 PolarHBondContact O-N 2.76Å; N317-G320 VanDerWaalsContact O-N 3.14Å; N317-G320 PolarHBondContact OD1-N 2.91Å
318	G	64.9	Low	69.7	Low	78 Å²	78	45.7 Å²	45.7	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	9.4	178.6	0	0	0	0	0	116.2
319	Y	69.9	Low	70	Confident	141 Å²	141	46.9 Å²	46.9	55%	0.553	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	1.5	176.7	-50.6	-60.6	0	0	0	113	A237 A266 N317	A237-Y319 HydrophobicContact CB-CD1 3.81Å; A237-Y319 HydrophobicContact CB-CD2 3.9Å; A237-Y319 HydrophobicContact CB-CE1 3.56Å; A237-Y319 HydrophobicContact CB-CE2 3.65Å; A237-Y319 HydrophobicContact CB-CG 3.98Å; A237-Y319 VanDerWaalsContact CB-CZ 3.47Å; A266-Y319 HydrophobicContact CB-CD2 3.89Å; A266-Y319 HydrophobicContact CB-CE2 3.78Å; N317-Y319 PolarHBondContact O-N 3.5Å; N317-Y319 WeakPolarHBondContact OD1-CA 3.38Å; N317-Y319 WeakPolarHBondContact OD1-CB 3.37Å; N317-Y319 PolarHBondContact OD1-N 3.06Å
320	G	55.8	Low	71.1	Confident	27 Å²	27	46.2 Å²	46.2	28%	0.278	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	150.2	175.9	168.8	0	0	0	0	0	115.6	P240 N317	P240-G320 VanDerWaalsContact CD-O 3.22Å; P240-G320 WeakPolarHBondContact CD-O 3.47Å; N317-G320 PolarHBondContact N-O 3.26Å; N317-G320 VanDerWaalsContact N-O 3.1Å; N317-G320 PolarHBondContact O-N 2.76Å; N317-G320 VanDerWaalsContact O-N 3.14Å; N317-G320 PolarHBondContact OD1-N 2.91Å
321	L	56.4	Low	71.8	Confident	54 Å²	54	44.4 Å²	44.4	28%	0.283	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	144.5	172.8	-179.3	66.4	0	0	0	110.1	E314 L315 R316 Q323	E314-L321 HydrophobicContact CB-CD1 4.26Å; L315-L321 CarbonylContact O-C 3.57Å; L315-L321 WeakPolarHBondContact O-CA 3.22Å; R316-L321 HydrophobicContact CB-CD1 4.22Å; L321-Q323 HydrophobicContact CD1-CG 4.25Å; L321-Q323 HydrophobicContact CD2-CG 4.06Å; L321-Q323 HydrophobicContact CG-CG 3.98Å
322	R	70.8	Confident	72.1	Confident	120 Å²	120	47.3 Å²	47.3	45%	0.453	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	151.1	155.5	-71.5	-58.7	-179.7	-89.1	1.6	109.7	P240 L315	P240-R322 WeakPolarHBondContact O-CG 3.12Å; L315-R322 PolarHBondContact N-O 2.62Å; L315-R322 PolarHBondContact O-N 2.81Å
323	Q	64	Low	72.6	Confident	105 Å²	105	51.5 Å²	51.5	49%	0.491	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.9	179.2	-50.9	172.3	-73	0	0	108.4	T312 V313 E314 L321	T312-Q323 HydrophobicContact CG2-CB 4.2Å; V313-Q323 CarbonylContact O-C 3.32Å; V313-Q323 WeakPolarHBondContact O-CA 3.48Å; E314-Q323 HydrophobicContact CG-CG 3.99Å; E314-Q323 PolarHBondContact OE1-NE2 3.2Å; L321-Q323 HydrophobicContact CD1-CG 4.25Å; L321-Q323 HydrophobicContact CD2-CG 4.06Å; L321-Q323 HydrophobicContact CG-CG 3.98Å
324	A	60.4	Low	72.5	Confident	11 Å²	11	51.7 Å²	51.7	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.9	162	0	0	0	0	0	109.2	I242 F245 P246 T312 V313	I242-A324 HydrophobicContact CD1-CB 3.5Å; F245-A324 HydrophobicContact CD1-CB 3.65Å; F245-A324 HydrophobicContact CE1-CB 4.15Å; P246-A324 HydrophobicContact CG-CB 4.05Å; T312-A324 CarbonylContact C-O 3.51Å; T312-A324 VanDerWaalsContact CA-O 3.32Å; T312-A324 WeakPolarHBondContact CA-O 3.45Å; V313-A324 HydrophobicContact CG1-CB 3.96Å; V313-A324 PolarHBondContact N-O 2.7Å; V313-A324 PolarHBondContact O-N 3.15Å
325	A	63.5	Low	72.4	Confident	61 Å²	61	52.8 Å²	52.8	50%	0.504	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.7	178.7	0	0	0	0	0	110.8	Y311	Y311-A325 CarbonylContact O-C 3.55Å; Y311-A325 VanDerWaalsContact O-CA 3.24Å; Y311-A325 WeakPolarHBondContact O-CA 3.42Å
326	L	80.9	Confident	72.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	156	172.5	79.2	106.8	0	0	0	110	P246 D248 I259 W273 C310 Y311 L328	P246-L326 HydrophobicContact CB-CB 4.22Å; P246-L326 HydrophobicContact CB-CD2 3.52Å; P246-L326 HydrophobicContact CB-CG 4.45Å; P246-L326 HydrophobicContact CG-CD2 4.1Å; D248-L326 WeakPolarHBondContact OD1-CA 3.44Å; I259-L326 HydrophobicContact CB-CD2 4.34Å; I259-L326 HydrophobicContact CD1-CD1 3.9Å; I259-L326 HydrophobicContact CD1-CD2 3.97Å; I259-L326 HydrophobicContact CG1-CD1 4.15Å; I259-L326 HydrophobicContact CG1-CD2 3.98Å; I259-L326 HydrophobicContact CG2-CD2 3.42Å; I259-L326 VanDerWaalsContact CG2-CD2 3.42Å; W273-L326 HydrophobicContact CZ3-CD2 4.14Å; C310-L326 WeakPolarHBondContact CA-O 3.26Å; Y311-L326 PolarHBondContact N-O 2.83Å; Y311-L326 PolarHBondContact O-N 3.31Å; L326-L328 HydrophobicContact CD1-CB 4.19Å
327	N	64.6	Low	73.1	Confident	51 Å²	51	48.4 Å²	48.4	27%	0.273	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.7	169	-55.6	-70.6	0	0	0	110.2	D248 M249	D248-N327 PolarHBondContact OD1-N 2.54Å; D248-N327 PolarHBondContact OD1-ND2 3.41Å; D248-N327 WeakPolarHBondContact OD2-CB 3.06Å; D248-N327 PolarHBondContact OD2-ND2 2.87Å; M249-N327 PolarHBondContact N-O 3.08Å
328	L	71.7	Confident	72.4	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123	169.9	178.6	60.9	0	0	0	109	M249 I251 V257 I259 I300 H307 C308 G309 Y311 L326 I330	M249-L328 HydrophobicContact CB-CD1 3.91Å; I251-L328 HydrophobicContact CG1-CD1 4.27Å; V257-L328 HydrophobicContact CG1-CD1 3.73Å; V257-L328 HydrophobicContact CG1-CD2 3.99Å; V257-L328 HydrophobicContact CG2-CD1 4.29Å; V257-L328 HydrophobicContact CG2-CD2 4.26Å; I259-L328 HydrophobicContact CD1-CD2 4.45Å; I300-L328 HydrophobicContact CD1-CD2 3.68Å; H307-L328 HydrophobicContact CB-CD2 4.35Å; C308-L328 VanDerWaalsContact CA-O 3.28Å; C308-L328 WeakPolarHBondContact CA-O 3.39Å; G309-L328 PolarHBondContact N-O 3.35Å; G309-L328 PolarHBondContact O-N 3.12Å; Y311-L328 HydrophobicContact CD2-CB 4.04Å; Y311-L328 HydrophobicContact CE2-CB 3.81Å; Y311-L328 HydrophobicContact CE2-CD2 3.88Å; Y311-L328 HydrophobicContact CE2-CG 4.49Å; L326-L328 HydrophobicContact CD1-CB 4.19Å; L328-I330 HydrophobicContact CD1-CD1 4.17Å; L328-I330 HydrophobicContact CG-CD1 4.3Å
329	T	74.2	Confident	72.8	Confident	48 Å²	48	51.3 Å²	51.3	29%	0.294	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.5	171.8	-44.1	0	0	0	0	109	M249 K250 I251 V331	M249-T329 PolarHBondContact O-N 3.39Å; K250-T329 WeakPolarHBondContact CA-O 3.34Å; I251-T329 PolarHBondContact N-O 3.41Å; T329-V331 HydrophobicContact CG2-CG1 3.97Å
330	I	77.4	Confident	72.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	138	164.9	-54.3	-52.7	0	0	0	108	I251 A253 V257 Q304 C308 L328	I251-I330 HydrophobicContact CB-CD1 4.03Å; I251-I330 HydrophobicContact CG2-CD1 4.4Å; I251-I330 WeakPolarHBondContact O-CA 3.44Å; A253-I330 HydrophobicContact CB-CG2 3.93Å; V257-I330 HydrophobicContact CG2-CD1 4.17Å; Q304-I330 WeakPolarHBondContact O-CG1 3.42Å; C308-I330 PolarHBondContact SG-N 3.41Å; L328-I330 HydrophobicContact CD1-CD1 4.17Å; L328-I330 HydrophobicContact CG-CD1 4.3Å
331	V	79.8	Confident	73.9	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.8	-177.4	-69.7	0	0	0	0	111.3	I251 L252 A253 T329 G362 Y413	I251-V331 WeakPolarHBondContact O-CG2 3.35Å; I251-V331 PolarHBondContact O-N 2.99Å; L252-V331 CarbonylContact C-O 3.57Å; L252-V331 VanDerWaalsContact CA-O 3.27Å; L252-V331 WeakPolarHBondContact CA-O 3.47Å; L252-V331 HydrophobicContact CD2-CG2 4.2Å; A253-V331 PolarHBondContact N-O 2.89Å; T329-V331 HydrophobicContact CG2-CG1 3.97Å; V331-G362 CarbonylContact C-O 3.58Å; V331-G362 VanDerWaalsContact CA-O 3.26Å; V331-G362 WeakPolarHBondContact CA-O 3.24Å; V331-Y413 HydrophobicContact CB-CD2 3.94Å; V331-Y413 HydrophobicContact CB-CE2 3.51Å; V331-Y413 HydrophobicContact CG1-CE2 3.83Å; V331-Y413 HydrophobicContact CG2-CD2 4.26Å; V331-Y413 HydrophobicContact CG2-CE1 4.2Å; V331-Y413 HydrophobicContact CG2-CE2 3.73Å
332	D	83.6	Confident	74.9	Confident	68 Å²	68	47.1 Å²	47.1	36%	0.364	26%	0.256	S	S	.	.			trans	-150.5	-170.8	178.9	-156.4	-13.8	0	0	0	109.8	A253 G362 N411	A253-D332 HydrophobicContact CB-CB 3.9Å; D332-G362 PolarHBondContact N-O 2.92Å; D332-G362 WeakPolarHBondContact O-CA 3.49Å; D332-N411 PolarHBondContact O-ND2 2.68Å
333	K	85.8	Confident	75.3	Confident	106 Å²	106	43.6 Å²	43.6	46%	0.461	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-72.8	163.1	165.1	-64.1	165.7	-170.8	164.6	0	110.4	G362	K333-G362 WeakPolarHBondContact O-CA 3.49Å
334	P	82.4	Confident	75.5	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.032	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-71.2	153.2	174.3	-11.7	28.8	0	0	0	111.5	P358 V366 A409 N411 G414 G416	P334-P358 HydrophobicContact CB-CB 4.37Å; P334-P358 HydrophobicContact CB-CG 3.86Å; P334-V366 HydrophobicContact CB-CG2 4.09Å; P334-V366 HydrophobicContact CG-CG2 4.14Å; P334-A409 HydrophobicContact CB-CB 3.74Å; P334-A409 HydrophobicContact CG-CB 4.13Å; P334-N411 HydrophobicContact CG-CB 3.8Å; P334-G414 WeakPolarHBondContact CD-O 3.11Å; P334-G416 VanDerWaalsContact O-CA 3.22Å; P334-G416 WeakPolarHBondContact O-CA 3.21Å
335	D	81.1	Confident	75.9	Confident	64 Å²	64	44.8 Å²	44.8	34%	0.342	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-61.6	172	167	-91.8	-25.8	0	0	0	112.5	P358 Y360	D335-P358 HydrophobicContact CB-CB 3.83Å; D335-P358 VanDerWaalsContact O-CB 3.25Å; D335-P358 WeakPolarHBondContact O-CB 3.44Å; D335-Y360 WeakPolarHBondContact CB-O 3.43Å; D335-Y360 PolarHBondContact N-O 2.78Å
336	P	82.9	Confident	76.7	Confident	52 Å²	52	45.8 Å²	45.8	34%	0.338	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-52.4	135.1	158.6	-26.5	36.6	0	0	0	112.6	A338 P358 E417	P336-A338 PolarHBondContact O-N 2.87Å; P336-P358 WeakPolarHBondContact O-CA 3.46Å; P336-E417 WeakPolarHBondContact CA-O 3.42Å; P336-E417 HydrophobicContact CG-CB 4.13Å
337	P	85.5	Confident	76.5	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.026	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-50.6	131.9	170.5	-29.4	36.9	0	0	0	112.2	Y356 Y369 I407 A409 S419	P337-Y356 WeakPolarHBondContact CB-O 3.42Å; P337-Y369 HydrophobicContact CG-CD1 4.35Å; P337-Y369 HydrophobicContact CG-CE1 4.47Å; P337-I407 HydrophobicContact CB-CB 4.42Å; P337-I407 VanDerWaalsContact CD-O 3.26Å; P337-I407 WeakPolarHBondContact CD-O 3.34Å; P337-I407 HydrophobicContact CG-CB 4.06Å; P337-I407 HydrophobicContact CG-CG2 3.95Å; P337-I407 WeakPolarHBondContact CG-O 3.35Å; P337-A409 HydrophobicContact CG-CB 4.15Å; P337-S419 WeakPolarHBondContact O-CB 3.34Å
338	A	64.3	Low	77.1	Confident	16 Å²	16	55.8 Å²	55.8	13%	0.132	29%	0.289	C	S	.	.	S	Bend	trans	-74.1	142.4	-164.6	0	0	0	0	0	113.1	P336 Y356 G357	P336-A338 PolarHBondContact O-N 2.87Å; A338-Y356 WeakPolarHBondContact O-CB 3.41Å; A338-G357 WeakPolarHBondContact CB-O 3.36Å; A338-G357 PolarHBondContact N-O 2.61Å
339	K	73.9	Confident	77.5	Confident	138 Å²	138	58.3 Å²	58.3	60%	0.6	31%	0.307	S	S	*	.	S	Bend	trans	64	176.1	-176.8	-50.5	166.1	-167.3	148.1	0	112.9	Y356	K339-Y356 HydrophobicContact CB-CD2 4.32Å; K339-Y356 HydrophobicContact CD-CD2 3.75Å; K339-Y356 HydrophobicContact CD-CE2 3.71Å; K339-Y356 HydrophobicContact CD-CG 4.39Å; K339-Y356 HydrophobicContact CG-CD2 4.44Å
340	V	67.8	Low	78	Confident	76 Å²	76	56.9 Å²	56.9	46%	0.461	30%	0.299	S	S	.	.			trans	-74.7	134.9	174.9	-179.5	0	0	0	0	109.2	A342 A420 E421	V340-A342 PolarHBondContact O-N 3.34Å; V340-A420 HydrophobicContact CG2-CB 4.01Å; V340-E421 WeakPolarHBondContact CG1-O 3.45Å
341	P	80.7	Confident	78.4	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.039	30%	0.299	C	S	.	.			trans	-59.5	133.8	174.7	-24	34.6	0	0	0	112.1	L353 I407 S419 A420	P341-L353 HydrophobicContact CB-CD1 3.83Å; P341-L353 HydrophobicContact CB-CG 4.5Å; P341-I407 HydrophobicContact CB-CD1 3.64Å; P341-I407 HydrophobicContact CG-CD1 3.37Å; P341-S419 WeakPolarHBondContact CG-OG 3.44Å; P341-A420 WeakPolarHBondContact CD-O 3.47Å
342	A	76.8	Confident	78.4	Confident	52 Å²	52	57.7 Å²	57.7	43%	0.43	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.2	-174.7	0	0	0	0	0	111.6	V340 S354	V340-A342 PolarHBondContact O-N 3.34Å; A342-S354 PolarHBondContact N-O 2.71Å; A342-S354 PolarHBondContact O-N 3.34Å; A342-S354 PolarHBondContact O-OG 3.11Å
343	T	79.4	Confident	78.3	Confident	45 Å²	45	54.4 Å²	54.4	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.7	179.7	54.4	0	0	0	0	111.8	L351 T352 L353 F405 V425	T343-L351 HydrophobicContact CG2-CD1 3.86Å; T343-L351 HydrophobicContact CG2-CD2 4.27Å; T343-T352 CarbonylContact C-O 3.53Å; T343-T352 VanDerWaalsContact CA-O 3.31Å; T343-T352 WeakPolarHBondContact CA-O 3.48Å; T343-L353 HydrophobicContact CG2-CD1 3.76Å; T343-F405 HydrophobicContact CG2-CD2 3.99Å; T343-F405 HydrophobicContact CG2-CE2 4.05Å; T343-V425 HydrophobicContact CG2-CG2 3.96Å
344	S	69.5	Low	77.9	Confident	46 Å²	46	51.3 Å²	51.3	32%	0.322	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	176.8	171.4	60.4	0	0	0	0	111	I346 T352	S344-I346 PolarHBondContact O-N 2.85Å; S344-I346 VanDerWaalsContact O-N 3.1Å; S344-T352 PolarHBondContact N-O 3.17Å; S344-T352 PolarHBondContact O-N 3.2Å; S344-T352 WeakPolarHBondContact OG-CB 3.33Å
345	D	69.1	Low	78	Confident	95 Å²	95	51.7 Å²	51.7	51%	0.508	28%	0.279	S	S	.	.	S	Bend	trans	55	36.4	167.4	-36.8	-50.9	0	0	0	114	R347 T352	D345-R347 PolarHBondContact O-N 3.44Å; D345-R347 VanDerWaalsContact O-N 3.16Å; D345-T352 WeakPolarHBondContact OD2-CB 3.47Å; D345-T352 PolarHBondContact OD2-OG1 2.97Å
346	I	79.3	Confident	77.5	Confident	83 Å²	83	53.3 Å²	53.3	43%	0.426	28%	0.281	S	S	.	.			trans	-72.1	108.4	-173.8	-54.9	167.3	0	0	0	109.2	S344 L351 V425 M427	S344-I346 PolarHBondContact O-N 2.85Å; S344-I346 VanDerWaalsContact O-N 3.1Å; I346-L351 HydrophobicContact CB-CB 4.35Å; I346-L351 HydrophobicContact CG1-CB 3.94Å; I346-V425 HydrophobicContact CD1-CG1 3.92Å; I346-V425 HydrophobicContact CG1-CG1 4.45Å; I346-V425 HydrophobicContact CG2-CG1 4.1Å; I346-M427 HydrophobicContact CG2-CE 4.26Å
347	R	77.1	Confident	76.8	Confident	162 Å²	162	52 Å²	52	61%	0.611	28%	0.276	S	S	*	.			trans	-107.4	-175.7	176.1	-62.9	179.2	-176.3	-131.2	-2.8	110.1	D345 S349 S350 M427	D345-R347 PolarHBondContact O-N 3.44Å; D345-R347 VanDerWaalsContact O-N 3.16Å; R347-S349 VanDerWaalsContact C-N 3.29Å; R347-S349 PolarHBondContact O-N 2.81Å; R347-S350 PolarHBondContact N-O 3.11Å; R347-M427 WeakPolarHBondContact O-CE 3.42Å
348	R	77.2	Confident	76	Confident	99 Å²	99	52.7 Å²	52.7	37%	0.374	28%	0.281	S	S	.	.	S	Bend	trans	-57.1	-34.1	180	-174.8	175.3	-167.4	129.8	14.3	115.3	P399 L429 D431	R348-P399 HydrophobicContact CG-CG 4.03Å; R348-L429 VanDerWaalsContact CZ-O 3.27Å; R348-L429 PolarHBondContact NH1-O 3.18Å; R348-D431 WeakPolarHBondContact CB-OD1 3.47Å
349	S	80.5	Confident	75.9	Confident	56 Å²	56	55 Å²	55	39%	0.392	29%	0.294	S	S	.	.	S	Bend	trans	-140.4	12.6	-174.4	59.2	0	0	0	0	114.4	R347 Q395 N396 L397	R347-S349 VanDerWaalsContact C-N 3.29Å; R347-S349 PolarHBondContact O-N 2.81Å; S349-Q395 CarbonylContact O-C 3.55Å; S349-N396 PolarHBondContact O-N 3.3Å; S349-L397 VanDerWaalsContact CA-O 3.31Å; S349-L397 WeakPolarHBondContact CA-O 3.29Å; S349-L397 VanDerWaalsContact CB-O 3.3Å; S349-L397 WeakPolarHBondContact CB-O 2.93Å; S349-L397 PolarHBondContact O-N 3.05Å
350	S	83.4	Confident	75.1	Confident	18 Å²	18	51 Å²	51	13%	0.126	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	158.9	177.6	56.8	0	0	0	0	112.1	R347 I394	R347-S350 PolarHBondContact N-O 3.11Å; S350-I394 CarbonylContact C-O 3.57Å; S350-I394 WeakPolarHBondContact CA-O 3.28Å; S350-I394 WeakPolarHBondContact CB-O 3.45Å
351	L	87.2	Confident	75.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.1	167.9	62.2	79.9	0	0	0	109.7	T343 I346 L353 N393 I394 L397 F405 V425 M427	T343-L351 HydrophobicContact CG2-CD1 3.86Å; T343-L351 HydrophobicContact CG2-CD2 4.27Å; I346-L351 HydrophobicContact CB-CB 4.35Å; I346-L351 HydrophobicContact CG1-CB 3.94Å; L351-L353 HydrophobicContact CD1-CB 4.24Å; L351-N393 CarbonylContact O-C 3.56Å; L351-I394 HydrophobicContact CD1-CB 4.42Å; L351-I394 HydrophobicContact CD1-CD1 4.25Å; L351-I394 PolarHBondContact N-O 3.09Å; L351-I394 PolarHBondContact O-N 2.88Å; L351-L397 HydrophobicContact CD2-CD1 3.87Å; L351-L397 HydrophobicContact CG-CD1 3.81Å; L351-F405 HydrophobicContact CD1-CE2 4.19Å; L351-F405 HydrophobicContact CD1-CZ 4.15Å; L351-F405 HydrophobicContact CD2-CE2 3.91Å; L351-F405 HydrophobicContact CD2-CZ 3.94Å; L351-F405 HydrophobicContact CG-CZ 4.44Å; L351-V425 HydrophobicContact CD2-CB 4.32Å; L351-V425 HydrophobicContact CD2-CG1 3.9Å; L351-M427 HydrophobicContact CD2-SD 4.13Å
352	T	78.7	Confident	74.6	Confident	20 Å²	20	49 Å²	49	12%	0.123	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124.5	169.4	-56.7	0	0	0	0	109	T343 S344 D345 S391 N393	T343-T352 CarbonylContact C-O 3.53Å; T343-T352 VanDerWaalsContact CA-O 3.31Å; T343-T352 WeakPolarHBondContact CA-O 3.48Å; S344-T352 PolarHBondContact N-O 3.17Å; S344-T352 PolarHBondContact O-N 3.2Å; S344-T352 WeakPolarHBondContact OG-CB 3.33Å; D345-T352 WeakPolarHBondContact OD2-CB 3.47Å; D345-T352 PolarHBondContact OD2-OG1 2.97Å; T352-S391 WeakPolarHBondContact CG2-OG 3.32Å; T352-N393 PolarHBondContact OG1-ND2 2.7Å; T352-N393 VanDerWaalsContact OG1-ND2 3.16Å
353	L	82.7	Confident	73.8	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133	170.3	-174	69.9	0	0	0	108.8	P341 T343 L351 W355 L371 S391 Y392 I394 F405 I407	P341-L353 HydrophobicContact CB-CD1 3.83Å; P341-L353 HydrophobicContact CB-CG 4.5Å; T343-L353 HydrophobicContact CG2-CD1 3.76Å; L351-L353 HydrophobicContact CD1-CB 4.24Å; L353-W355 HydrophobicContact CB-CZ3 4.43Å; L353-W355 HydrophobicContact CD2-CE3 4.34Å; L353-W355 HydrophobicContact CD2-CZ3 4.34Å; L353-W355 HydrophobicContact CG-CE3 4.1Å; L353-W355 HydrophobicContact CG-CZ3 4.25Å; L353-W355 WeakPolarHBondContact O-CZ3 3.46Å; L353-L371 HydrophobicContact CD2-CD2 4.06Å; L353-L371 HydrophobicContact CD2-CG 4.41Å; L353-S391 CarbonylContact O-C 3.53Å; L353-S391 VanDerWaalsContact O-CA 3.32Å; L353-S391 WeakPolarHBondContact O-CA 3.23Å; L353-S391 PolarHBondContact O-OG 2.59Å; L353-Y392 PolarHBondContact N-O 3.39Å; L353-Y392 PolarHBondContact O-N 3.04Å; L353-I394 HydrophobicContact CB-CD1 3.85Å; L353-I394 HydrophobicContact CB-CG1 4.38Å; L353-I394 HydrophobicContact CD2-CD1 3.99Å; L353-F405 HydrophobicContact CD1-CB 3.73Å; L353-F405 HydrophobicContact CD1-CD2 3.94Å; L353-F405 HydrophobicContact CD1-CG 3.85Å; L353-F405 HydrophobicContact CD2-CB 3.66Å; L353-F405 HydrophobicContact CD2-CD1 4.13Å; L353-F405 HydrophobicContact CD2-CG 3.95Å; L353-F405 HydrophobicContact CG-CB 4.37Å; L353-I407 HydrophobicContact CD2-CD1 4.05Å
354	S	76.8	Confident	73.2	Confident	40 Å²	40	47 Å²	47	28%	0.28	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.6	177.5	62.6	0	0	0	0	110.8	A342	A342-S354 PolarHBondContact N-O 2.71Å; A342-S354 PolarHBondContact O-N 3.34Å; A342-S354 PolarHBondContact O-OG 3.11Å
355	W	84.4	Confident	73.1	Confident	13 Å²	13	48 Å²	48	5%	0.049	26%	0.262	C	S	.	.			trans	-145.7	173.4	-179.2	58.6	99.7	0	0	0	110.5	L353 Y369 L371 S389 T390 I407	L353-W355 HydrophobicContact CB-CZ3 4.43Å; L353-W355 HydrophobicContact CD2-CE3 4.34Å; L353-W355 HydrophobicContact CD2-CZ3 4.34Å; L353-W355 HydrophobicContact CG-CE3 4.1Å; L353-W355 HydrophobicContact CG-CZ3 4.25Å; L353-W355 WeakPolarHBondContact O-CZ3 3.46Å; W355-Y369 AromaticContact CD1-CD1 3.95Å; W355-Y369 HydrophobicContact CZ2-CD2 4.42Å; W355-Y369 HydrophobicContact CZ2-CG 4.14Å; W355-Y369 AromaticContact NE1-CD1 3.25Å; W355-Y369 AromaticContact NE1-CD2 3.84Å; W355-Y369 AromaticContact NE1-CE1 3.69Å; W355-Y369 AromaticContact NE1-CG 3.33Å; W355-Y369 VanDerWaalsContact NE1-CG 3.33Å; W355-L371 HydrophobicContact CH2-CD1 3.59Å; W355-L371 HydrophobicContact CH2-CD2 3.76Å; W355-L371 HydrophobicContact CH2-CG 3.96Å; W355-L371 HydrophobicContact CZ2-CD1 3.69Å; W355-L371 HydrophobicContact CZ2-CG 4.39Å; W355-L371 HydrophobicContact CZ3-CD1 4.35Å; W355-L371 HydrophobicContact CZ3-CD2 3.87Å; W355-L371 HydrophobicContact CZ3-CG 4.24Å; W355-S389 WeakPolarHBondContact CZ2-O 3.35Å; W355-T390 PolarHBondContact N-O 2.78Å; W355-T390 WeakPolarHBondContact O-CB 3.18Å; W355-I407 HydrophobicContact CB-CD1 3.88Å; W355-I407 HydrophobicContact CD2-CD1 3.84Å; W355-I407 HydrophobicContact CD2-CG1 3.81Å; W355-I407 HydrophobicContact CE3-CD1 3.97Å; W355-I407 HydrophobicContact CE3-CG1 4.12Å; W355-I407 HydrophobicContact CG-CB 4.47Å; W355-I407 HydrophobicContact CG-CD1 3.81Å; W355-I407 HydrophobicContact CG-CG1 4.02Å
356	Y	70.9	Confident	73.3	Confident	98 Å²	98	45 Å²	45	38%	0.384	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-101	157.5	170.3	-61.2	-97.1	0	0	0	108.9	P337 A338 K339 H754	P337-Y356 WeakPolarHBondContact CB-O 3.42Å; A338-Y356 WeakPolarHBondContact O-CB 3.41Å; K339-Y356 HydrophobicContact CB-CD2 4.32Å; K339-Y356 HydrophobicContact CD-CD2 3.75Å; K339-Y356 HydrophobicContact CD-CE2 3.71Å; K339-Y356 HydrophobicContact CD-CG 4.39Å; K339-Y356 HydrophobicContact CG-CD2 4.44Å; Y356-H754 AromaticContact CD1-NE2 3.95Å; Y356-H754 AromaticContact CE1-NE2 3.36Å; Y356-H754 WeakPolarHBondContact CE1-NE2 3.21Å
357	G	67.4	Low	73.4	Confident	24 Å²	24	46.7 Å²	46.7	25%	0.247	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-58.6	167.4	164.7	0	0	0	0	0	111.8	A338 Y369	A338-G357 WeakPolarHBondContact CB-O 3.36Å; A338-G357 PolarHBondContact N-O 2.61Å; G357-Y369 VanDerWaalsContact CA-OH 3.24Å; G357-Y369 WeakPolarHBondContact CA-OH 3.46Å
358	P	70.1	Confident	73.7	Confident	19 Å²	19	40.6 Å²	40.6	12%	0.123	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-63.2	154.2	172	31.8	-36.3	0	0	0	110.7	P334 D335 P336 Y360 V366 A409	P334-P358 HydrophobicContact CB-CB 4.37Å; P334-P358 HydrophobicContact CB-CG 3.86Å; D335-P358 HydrophobicContact CB-CB 3.83Å; D335-P358 VanDerWaalsContact O-CB 3.25Å; D335-P358 WeakPolarHBondContact O-CB 3.44Å; P336-P358 WeakPolarHBondContact O-CA 3.46Å; P358-Y360 VanDerWaalsContact C-N 3.34Å; P358-V366 HydrophobicContact CG-CG2 3.63Å; P358-A409 HydrophobicContact CB-CB 4.45Å; P358-A409 HydrophobicContact CG-CB 3.91Å
359	T	60.9	Low	74.4	Confident	66 Å²	66	36.9 Å²	36.9	41%	0.405	22%	0.221	S	C	.	.	S	Bend	trans	-65.6	-39.1	179.1	-70.7	0	0	0	0	111.4
360	Y	58.3	Low	75.1	Confident	54 Å²	54	35.4 Å²	35.4	21%	0.212	21%	0.207	C	C	.	.			trans	-123.6	134.7	169.3	174	-116.9	0	0	0	109.9	Q305 D335 P358 G362 G363	Q305-Y360 PolarHBondContact OE1-OH 3.04Å; Q305-Y360 VanDerWaalsContact OE1-OH 3.07Å; D335-Y360 WeakPolarHBondContact CB-O 3.43Å; D335-Y360 PolarHBondContact N-O 2.78Å; P358-Y360 VanDerWaalsContact C-N 3.34Å; Y360-G362 VanDerWaalsContact CE1-CA 3.42Å; Y360-G363 PolarHBondContact OH-N 3.14Å
361	D	69.8	Low	75.7	Confident	39 Å²	39	34.6 Å²	34.6	21%	0.209	20%	0.202	C	C	.	.			trans	-91.3	3.4	-175.8	73	-8	0	0	0	114.1	G363 S364 A365 V366 N411	D361-G363 WeakPolarHBondContact OD1-CA 3.4Å; D361-G363 PolarHBondContact OD1-N 2.97Å; D361-S364 PolarHBondContact OD1-N 3.23Å; D361-S364 VanDerWaalsContact OD1-N 3.15Å; D361-A365 WeakPolarHBondContact OD2-CA 3.37Å; D361-A365 PolarHBondContact OD2-N 3.32Å; D361-V366 HydrophobicContact CB-CG2 3.93Å; D361-N411 PolarHBondContact O-ND2 2.86Å
362	G	68	Low	76.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	82.6	17.7	-172.2	0	0	0	0	0	113.8	V331 D332 K333 Y360 S364	V331-G362 CarbonylContact C-O 3.58Å; V331-G362 VanDerWaalsContact CA-O 3.26Å; V331-G362 WeakPolarHBondContact CA-O 3.24Å; D332-G362 PolarHBondContact N-O 2.92Å; D332-G362 WeakPolarHBondContact O-CA 3.49Å; K333-G362 WeakPolarHBondContact O-CA 3.49Å; Y360-G362 VanDerWaalsContact CE1-CA 3.42Å; G362-S364 PolarHBondContact O-N 2.6Å
363	G	59	Low	76.8	Confident	32 Å²	32	35.9 Å²	35.9	33%	0.33	21%	0.207	S	C	.	.	S	Bend	trans	70.4	22.4	-174.7	0	0	0	0	0	112.8	Y360 D361	Y360-G363 PolarHBondContact OH-N 3.14Å; D361-G363 WeakPolarHBondContact OD1-CA 3.4Å; D361-G363 PolarHBondContact OD1-N 2.97Å
364	S	66.7	Low	77.4	Confident	22 Å²	22	38.7 Å²	38.7	15%	0.154	22%	0.218	C	C	.	.	S	Bend	trans	-157.9	124.8	-178.8	-165	0	0	0	0	111.3	D361 G362 V366 N411 I412	D361-S364 PolarHBondContact OD1-N 3.23Å; D361-S364 VanDerWaalsContact OD1-N 3.15Å; G362-S364 PolarHBondContact O-N 2.6Å; S364-V366 PolarHBondContact O-N 3.36Å; S364-N411 WeakPolarHBondContact O-CB 2.86Å; S364-N411 PolarHBondContact O-ND2 2.94Å; S364-I412 WeakPolarHBondContact OG-CD1 3.47Å; S364-I412 WeakPolarHBondContact OG-CG1 3.38Å
365	A	67.8	Low	78.1	Confident	67 Å²	67	37.6 Å²	37.6	55%	0.554	21%	0.208	S	C	*	.			trans	-52.4	131.4	-170.3	0	0	0	0	0	113.4	D361 Q367	D361-A365 WeakPolarHBondContact OD2-CA 3.37Å; D361-A365 PolarHBondContact OD2-N 3.32Å; A365-Q367 PolarHBondContact O-N 2.95Å; A365-Q367 VanDerWaalsContact O-N 3.13Å
366	V	72.9	Confident	78.2	Confident	34 Å²	34	38.4 Å²	38.4	21%	0.206	22%	0.216	C	C	.	.			trans	-61.3	114.6	173.8	-177.5	0	0	0	0	109.8	P334 P358 D361 S364 T368 Y369 A409 Q410	P334-V366 HydrophobicContact CB-CG2 4.09Å; P334-V366 HydrophobicContact CG-CG2 4.14Å; P358-V366 HydrophobicContact CG-CG2 3.63Å; D361-V366 HydrophobicContact CB-CG2 3.93Å; S364-V366 PolarHBondContact O-N 3.36Å; V366-T368 WeakPolarHBondContact CG1-O 3.29Å; V366-Y369 HydrophobicContact CG1-CD1 4.4Å; V366-Y369 HydrophobicContact CG1-CD2 4.49Å; V366-Y369 HydrophobicContact CG1-CE1 3.92Å; V366-Y369 HydrophobicContact CG1-CE2 3.99Å; V366-A409 HydrophobicContact CG1-CB 3.81Å; V366-A409 HydrophobicContact CG2-CB 4.12Å; V366-Q410 CarbonylContact C-O 3.57Å; V366-Q410 WeakPolarHBondContact CA-O 3.32Å; V366-Q410 WeakPolarHBondContact CG1-O 3.25Å
367	Q	80.8	Confident	78.9	Confident	117 Å²	117	38 Å²	38	55%	0.547	22%	0.223	S	C	.	.			trans	-86.3	-27.1	-179.6	-62.6	-170.7	-26.2	0	0	112.5	A365 Q410 I412	A365-Q367 PolarHBondContact O-N 2.95Å; A365-Q367 VanDerWaalsContact O-N 3.13Å; Q367-Q410 PolarHBondContact N-O 3.45Å; Q367-I412 VanDerWaalsContact NE2-CG2 3.25Å
368	T	83.6	Confident	79.7	Confident	34 Å²	34	40 Å²	40	21%	0.209	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	148.6	-173.6	-75.8	0	0	0	0	111.5	V366 H370 Q410	V366-T368 WeakPolarHBondContact CG1-O 3.29Å; T368-H370 WeakPolarHBondContact CG2-NE2 2.98Å; T368-Q410 PolarHBondContact N-O 2.78Å; T368-Q410 PolarHBondContact O-N 3.46Å
369	Y	91.8	Very high	80.5	Confident	22 Å²	22	45.6 Å²	45.6	9%	0.086	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.9	168.6	-65.5	-81.1	0	0	0	109.7	P337 W355 G357 V366 S386 C387 S389 T390 I407 R408 A409	P337-Y369 HydrophobicContact CG-CD1 4.35Å; P337-Y369 HydrophobicContact CG-CE1 4.47Å; W355-Y369 AromaticContact CD1-CD1 3.95Å; W355-Y369 HydrophobicContact CZ2-CD2 4.42Å; W355-Y369 HydrophobicContact CZ2-CG 4.14Å; W355-Y369 AromaticContact NE1-CD1 3.25Å; W355-Y369 AromaticContact NE1-CD2 3.84Å; W355-Y369 AromaticContact NE1-CE1 3.69Å; W355-Y369 AromaticContact NE1-CG 3.33Å; W355-Y369 VanDerWaalsContact NE1-CG 3.33Å; G357-Y369 VanDerWaalsContact CA-OH 3.24Å; G357-Y369 WeakPolarHBondContact CA-OH 3.46Å; V366-Y369 HydrophobicContact CG1-CD1 4.4Å; V366-Y369 HydrophobicContact CG1-CD2 4.49Å; V366-Y369 HydrophobicContact CG1-CE1 3.92Å; V366-Y369 HydrophobicContact CG1-CE2 3.99Å; Y369-S386 CarbonylContact O-C 3.57Å; Y369-S386 VanDerWaalsContact O-CA 3.27Å; Y369-S386 WeakPolarHBondContact O-CA 3.17Å; Y369-C387 PolarHBondContact N-O 3.17Å; Y369-C387 PolarHBondContact O-N 3.2Å; Y369-S389 WeakPolarHBondContact CD2-O 3.26Å; Y369-T390 HydrophobicContact CD2-CG2 4.38Å; Y369-T390 HydrophobicContact CE2-CG2 3.66Å; Y369-I407 HydrophobicContact CD1-CG2 3.78Å; Y369-I407 HydrophobicContact CG-CG2 4.18Å; Y369-R408 CarbonylContact C-O 3.55Å; Y369-R408 VanDerWaalsContact CA-O 3.28Å; Y369-R408 WeakPolarHBondContact CA-O 3.25Å; Y369-A409 HydrophobicContact CD1-CB 4.17Å; Y369-A409 HydrophobicContact CE1-CB 3.98Å
370	H	95.6	Very high	82	Confident	24 Å²	24	47.7 Å²	47.7	11%	0.111	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.7	171.5	-50.3	-68.6	0	0	0	109.3	T368 Q383 S386 I407 R408 Q410	T368-H370 WeakPolarHBondContact CG2-NE2 2.98Å; H370-Q383 PolarHBondContact CE1-NE2 2.65Å; H370-Q383 PolarHBondContact ND1-NE2 3Å; H370-S386 WeakPolarHBondContact CE1-CB 3.24Å; H370-S386 PolarHBondContact CE1-OG 3.14Å; H370-S386 PolarHBondContact ND1-OG 3.22Å; H370-I407 CarbonylContact O-C 3.56Å; H370-I407 VanDerWaalsContact O-CA 3.31Å; H370-I407 WeakPolarHBondContact O-CA 3.16Å; H370-R408 HydrophobicContact CB-CB 4.45Å; H370-R408 PolarHBondContact N-O 3.37Å; H370-R408 PolarHBondContact O-N 3.48Å; H370-Q410 PolarHBondContact NE2-OE1 3.44Å
371	L	95.8	Very high	83.6	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.4	177.5	-73.9	63.7	0	0	0	108	L353 W355 L384 V385 Y392 I407	L353-L371 HydrophobicContact CD2-CD2 4.06Å; L353-L371 HydrophobicContact CD2-CG 4.41Å; W355-L371 HydrophobicContact CH2-CD1 3.59Å; W355-L371 HydrophobicContact CH2-CD2 3.76Å; W355-L371 HydrophobicContact CH2-CG 3.96Å; W355-L371 HydrophobicContact CZ2-CD1 3.69Å; W355-L371 HydrophobicContact CZ2-CG 4.39Å; W355-L371 HydrophobicContact CZ3-CD1 4.35Å; W355-L371 HydrophobicContact CZ3-CD2 3.87Å; W355-L371 HydrophobicContact CZ3-CG 4.24Å; L371-L384 PolarHBondContact O-N 3.02Å; L371-V385 HydrophobicContact CB-CG1 3.98Å; L371-V385 HydrophobicContact CD1-CG1 4.24Å; L371-V385 HydrophobicContact CD2-CG1 3.79Å; L371-V385 HydrophobicContact CG-CG1 4.22Å; L371-V385 PolarHBondContact N-O 2.88Å; L371-Y392 HydrophobicContact CD2-CD1 4.13Å; L371-Y392 HydrophobicContact CD2-CG 4.03Å; L371-I407 HydrophobicContact CD1-CG1 4.41Å; L371-I407 HydrophobicContact CD1-CG2 4.49Å; L371-I407 HydrophobicContact CG-CG1 4.02Å
372	E	95.6	Very high	84.8	Confident	23 Å²	23	50.4 Å²	50.4	11%	0.107	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136.4	170.6	-62.6	-179.3	-150.6	0	0	109.7	W381 K382 F405 R406 R408	E372-W381 HydrophobicContact CB-CE3 3.85Å; E372-W381 WeakPolarHBondContact O-CZ3 3.15Å; E372-W381 WeakPolarHBondContact OE2-CB 3.3Å; E372-K382 CarbonylContact C-O 3.59Å; E372-K382 VanDerWaalsContact CA-O 3.27Å; E372-K382 WeakPolarHBondContact CA-O 3.37Å; E372-F405 WeakPolarHBondContact O-CA 3.24Å; E372-R406 HydrophobicContact CB-CG 3.88Å; E372-R406 PolarHBondContact N-O 2.84Å; E372-R406 PolarHBondContact O-N 3.23Å; E372-R406 IonicContact OE1-NH2 2.62Å; E372-R406 IonicContact OE2-CZ 3.81Å; E372-R406 IonicContact OE2-NE 3.15Å; E372-R406 PolarHBondContact OE2-NE 3.43Å; E372-R406 IonicContact OE2-NH2 3.4Å; E372-R406 PolarHBondContact OE2-NH2 3.25Å; E372-R408 WeakPolarHBondContact OE1-CD 3.33Å; E372-R408 IonicContact OE1-CZ 3.85Å; E372-R408 IonicContact OE1-NE 2.68Å; E372-R408 PolarHBondContact OE1-NE 3Å
373	I	95.1	Very high	85.9	Confident	24 Å²	24	56.2 Å²	56.2	12%	0.123	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.2	176.2	-169.8	172.3	0	0	0	110	W381 K382 L384 L397 Y403 F405	I373-W381 WeakPolarHBondContact O-CA 3Å; I373-K382 HydrophobicContact CG2-CB 4.47Å; I373-K382 PolarHBondContact N-O 3.4Å; I373-K382 PolarHBondContact O-N 3.03Å; I373-L384 HydrophobicContact CB-CB 4.37Å; I373-L384 HydrophobicContact CG2-CB 4.01Å; I373-L384 HydrophobicContact CG2-CD1 4.43Å; I373-L397 HydrophobicContact CD1-CD2 3.83Å; I373-Y403 HydrophobicContact CD1-CD1 3.66Å; I373-Y403 HydrophobicContact CD1-CE1 4.09Å; I373-Y403 HydrophobicContact CD1-CG 4.36Å; I373-Y403 HydrophobicContact CG1-CD1 3.99Å; I373-F405 HydrophobicContact CB-CD1 4.35Å; I373-F405 HydrophobicContact CB-CE1 4.42Å; I373-F405 HydrophobicContact CD1-CD1 4.43Å; I373-F405 HydrophobicContact CD1-CE1 3.67Å; I373-F405 HydrophobicContact CD1-CZ 4.46Å; I373-F405 HydrophobicContact CG1-CD1 4.01Å; I373-F405 HydrophobicContact CG1-CE1 3.68Å
374	W	95.2	Very high	87.5	Confident	59 Å²	59	58.2 Å²	58.2	22%	0.223	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.4	171.4	-177.9	100.6	0	0	0	108.8	Q379 W381 Y403 K404	W374-Q379 HydrophobicContact CZ2-CB 4.08Å; W374-Q379 HydrophobicContact CZ2-CG 4.04Å; W374-Q379 PolarHBondContact NE1-O 3.29Å; W374-Q379 VanDerWaalsContact NE1-O 3.08Å; W374-W381 HydrophobicContact CB-CD2 3.76Å; W374-W381 HydrophobicContact CB-CE3 3.65Å; W374-W381 HydrophobicContact CB-CG 4.45Å; W374-W381 HydrophobicContact CB-CH2 3.91Å; W374-W381 HydrophobicContact CB-CZ2 4Å; W374-W381 HydrophobicContact CB-CZ3 3.71Å; W374-W381 HydrophobicContact CG-CD2 4.42Å; W374-Y403 VanDerWaalsContact O-CA 3.3Å; W374-Y403 WeakPolarHBondContact O-CA 3.4Å; W374-K404 HydrophobicContact CB-CB 4.29Å; W374-K404 HydrophobicContact CE3-CB 4.47Å; W374-K404 HydrophobicContact CE3-CD 4.46Å; W374-K404 HydrophobicContact CE3-CG 4.24Å; W374-K404 PolarHBondContact N-O 3.23Å; W374-K404 PolarHBondContact O-N 3.49Å
375	D	90.5	Very high	88.7	Confident	16 Å²	16	58.8 Å²	58.8	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.9	176.9	-175.2	-34.3	0	0	0	109.8	V377 D378 Q379 R401 Y403	D375-V377 PolarHBondContact O-N 3.08Å; D375-V377 PolarHBondContact OD1-N 2.88Å; D375-D378 HydrophobicContact CB-CB 4.39Å; D375-D378 PolarHBondContact O-N 2.88Å; D375-D378 VanDerWaalsContact O-N 3.11Å; D375-Q379 PolarHBondContact O-N 3.47Å; D375-R401 IonicContact OD1-NH1 2.71Å; D375-R401 WeakPolarHBondContact OD2-CD 3.36Å; D375-R401 IonicContact OD2-CZ 3.75Å; D375-R401 IonicContact OD2-NE 3.66Å; D375-R401 IonicContact OD2-NH1 2.62Å; D375-R401 PolarHBondContact OD2-NH1 3.21Å; D375-Y403 HydrophobicContact CB-CD1 3.99Å; D375-Y403 HydrophobicContact CB-CE1 3.74Å; D375-Y403 WeakPolarHBondContact OD2-CE1 3.06Å; D375-Y403 PolarHBondContact OD2-OH 2.64Å
376	S	86.6	Confident	89.8	Confident	31 Å²	31	58.2 Å²	58.2	22%	0.217	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-37.1	-34.5	167.8	53.6	0	0	0	0	117	Q379 Q402	S376-Q379 VanDerWaalsContact O-CG 3.25Å; S376-Q379 WeakPolarHBondContact O-CG 3.46Å; S376-Q379 PolarHBondContact O-NE2 3.3Å; S376-Q402 WeakPolarHBondContact CB-O 3.26Å; S376-Q402 PolarHBondContact N-O 2.99Å; S376-Q402 PolarHBondContact OG-N 2.75Å; S376-Q402 PolarHBondContact OG-O 3.1Å
377	V	86.6	Confident	90.3	Very high	88 Å²	88	57.4 Å²	57.4	53%	0.533	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-44.1	-178.4	-179.5	0	0	0	0	112.1	D375	D375-V377 PolarHBondContact O-N 3.08Å; D375-V377 PolarHBondContact OD1-N 2.88Å
378	D	82.4	Confident	90.3	Very high	66 Å²	66	58 Å²	58	35%	0.353	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-20.2	-174.5	-73.7	3.5	0	0	0	112.8	D375 Q380 K382	D375-D378 HydrophobicContact CB-CB 4.39Å; D375-D378 PolarHBondContact O-N 2.88Å; D375-D378 VanDerWaalsContact O-N 3.11Å; D378-Q380 HydrophobicContact CB-CG 4.44Å; D378-Q380 PolarHBondContact O-N 2.79Å; D378-Q380 PolarHBondContact O-NE2 2.72Å; D378-K382 IonicContact OD2-NZ 2.71Å; D378-K382 PolarHBondContact OD2-NZ 3.49Å
379	Q	88.4	Confident	89.7	Confident	138 Å²	138	59 Å²	59	65%	0.645	30%	0.303	S	S	*	.			trans	51.2	21.5	174.2	-57.2	-166	-2.5	0	0	116.6	W374 D375 S376	W374-Q379 HydrophobicContact CZ2-CB 4.08Å; W374-Q379 HydrophobicContact CZ2-CG 4.04Å; W374-Q379 PolarHBondContact NE1-O 3.29Å; W374-Q379 VanDerWaalsContact NE1-O 3.08Å; D375-Q379 PolarHBondContact O-N 3.47Å; S376-Q379 VanDerWaalsContact O-CG 3.25Å; S376-Q379 WeakPolarHBondContact O-CG 3.46Å; S376-Q379 PolarHBondContact O-NE2 3.3Å
380	Q	90.9	Very high	89.2	Confident	109 Å²	109	60.9 Å²	60.9	51%	0.509	32%	0.317	S	S	.	.	S	Bend	trans	-132.8	147.2	-179.7	70.8	-157.6	-105.6	0	0	110.6	D378 K382	D378-Q380 HydrophobicContact CB-CG 4.44Å; D378-Q380 PolarHBondContact O-N 2.79Å; D378-Q380 PolarHBondContact O-NE2 2.72Å; Q380-K382 VanDerWaalsContact CD-CE 3.48Å; Q380-K382 HydrophobicContact CG-CD 4.39Å; Q380-K382 HydrophobicContact CG-CG 4.02Å
381	W	93.8	Very high	88.5	Confident	63 Å²	63	62 Å²	62	24%	0.239	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.7	171	-70.6	101	0	0	0	110.1	E372 I373 W374 K404 R406 E421	E372-W381 HydrophobicContact CB-CE3 3.85Å; E372-W381 WeakPolarHBondContact O-CZ3 3.15Å; E372-W381 WeakPolarHBondContact OE2-CB 3.3Å; I373-W381 WeakPolarHBondContact O-CA 3Å; W374-W381 HydrophobicContact CB-CD2 3.76Å; W374-W381 HydrophobicContact CB-CE3 3.65Å; W374-W381 HydrophobicContact CB-CG 4.45Å; W374-W381 HydrophobicContact CB-CH2 3.91Å; W374-W381 HydrophobicContact CB-CZ2 4Å; W374-W381 HydrophobicContact CB-CZ3 3.71Å; W374-W381 HydrophobicContact CG-CD2 4.42Å; W381-K404 HydrophobicContact CH2-CB 3.74Å; W381-K404 HydrophobicContact CZ2-CB 4.33Å; W381-K404 HydrophobicContact CZ3-CB 4.49Å; W381-K404 WeakPolarHBondContact CZ3-O 3.23Å; W381-R406 HydrophobicContact CD2-CG 4.19Å; W381-R406 HydrophobicContact CE3-CG 3.75Å; W381-R406 HydrophobicContact CH2-CB 4.03Å; W381-R406 HydrophobicContact CH2-CG 3.9Å; W381-R406 HydrophobicContact CZ2-CG 4.32Å; W381-R406 HydrophobicContact CZ3-CB 4.07Å; W381-R406 HydrophobicContact CZ3-CG 3.61Å; W381-E421 HydrophobicContact CH2-CB 3.95Å; W381-E421 HydrophobicContact CZ2-CB 3.78Å
382	K	93.1	Very high	87.8	Confident	88 Å²	88	66.1 Å²	66.1	38%	0.383	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.2	176.3	-62.4	179.9	179.5	178.8	0	108.9	E372 I373 D378 Q380 L384	E372-K382 CarbonylContact C-O 3.59Å; E372-K382 VanDerWaalsContact CA-O 3.27Å; E372-K382 WeakPolarHBondContact CA-O 3.37Å; I373-K382 HydrophobicContact CG2-CB 4.47Å; I373-K382 PolarHBondContact N-O 3.4Å; I373-K382 PolarHBondContact O-N 3.03Å; D378-K382 IonicContact OD2-NZ 2.71Å; D378-K382 PolarHBondContact OD2-NZ 3.49Å; Q380-K382 VanDerWaalsContact CD-CE 3.48Å; Q380-K382 HydrophobicContact CG-CD 4.39Å; Q380-K382 HydrophobicContact CG-CG 4.02Å; K382-L384 PolarHBondContact O-N 3.22Å
383	Q	92.7	Very high	87.4	Confident	121 Å²	121	68 Å²	68	57%	0.565	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	121.9	170	-175	174.1	-13.5	0	0	109.1	H370 S386	H370-Q383 PolarHBondContact CE1-NE2 2.65Å; H370-Q383 PolarHBondContact ND1-NE2 3Å; Q383-S386 PolarHBondContact NE2-OG 2.75Å
384	L	91.6	Very high	87.1	Confident	75 Å²	75	67 Å²	67	39%	0.393	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-50.1	-178.7	175.8	65.4	0	0	0	111	L371 I373 K382 I394	L371-L384 PolarHBondContact O-N 3.02Å; I373-L384 HydrophobicContact CB-CB 4.37Å; I373-L384 HydrophobicContact CG2-CB 4.01Å; I373-L384 HydrophobicContact CG2-CD1 4.43Å; K382-L384 PolarHBondContact O-N 3.22Å; L384-I394 HydrophobicContact CD2-CB 4.49Å; L384-I394 HydrophobicContact CD2-CD1 3.8Å; L384-I394 HydrophobicContact CD2-CG1 3.89Å; L384-I394 HydrophobicContact CD2-CG2 3.87Å
385	V	92.1	Very high	86.7	Confident	34 Å²	34	70 Å²	70	21%	0.206	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	158.1	-174.9	66.3	0	0	0	0	110.3	L371 Y392	L371-V385 HydrophobicContact CB-CG1 3.98Å; L371-V385 HydrophobicContact CD1-CG1 4.24Å; L371-V385 HydrophobicContact CD2-CG1 3.79Å; L371-V385 HydrophobicContact CG-CG1 4.22Å; L371-V385 PolarHBondContact N-O 2.88Å; V385-Y392 HydrophobicContact CG1-CD1 4.08Å; V385-Y392 HydrophobicContact CG1-CD2 4.23Å; V385-Y392 HydrophobicContact CG1-CE1 3.89Å; V385-Y392 HydrophobicContact CG1-CE2 4.05Å; V385-Y392 HydrophobicContact CG1-CG 4.26Å; V385-Y392 HydrophobicContact CG2-CE2 3.98Å
386	S	91.7	Very high	86.5	Confident	54 Å²	54	76 Å²	76	38%	0.378	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.1	166.8	-56.4	0	0	0	0	108.9	Y369 H370 Q383	Y369-S386 CarbonylContact O-C 3.57Å; Y369-S386 VanDerWaalsContact O-CA 3.27Å; Y369-S386 WeakPolarHBondContact O-CA 3.17Å; H370-S386 WeakPolarHBondContact CE1-CB 3.24Å; H370-S386 PolarHBondContact CE1-OG 3.14Å; H370-S386 PolarHBondContact ND1-OG 3.22Å; Q383-S386 PolarHBondContact NE2-OG 2.75Å
387	C	82.1	Confident	86.6	Confident	17 Å²	17	75 Å²	75	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157	178.3	64.1	0	0	0	0	113.2	Y369 S389 Y392	Y369-C387 PolarHBondContact N-O 3.17Å; Y369-C387 PolarHBondContact O-N 3.2Å; C387-S389 PolarHBondContact SG-O 3.43Å; C387-Y392 HydrophobicContact CB-CD2 4.45Å
388	N	80.3	Confident	86.5	Confident	130 Å²	130	74.7 Å²	74.7	70%	0.695	39%	0.385	S	S	*	.	S	Bend	trans	-92.2	-5.6	176.3	58.3	-7.7	0	0	0	113.8
389	S	72.6	Confident	86.5	Confident	55 Å²	55	73.8 Å²	73.8	39%	0.385	38%	0.382	S	S	.	.	S	Bend	trans	-84.4	156.3	171	177.1	0	0	0	0	111.3	W355 Y369 C387 S391	W355-S389 WeakPolarHBondContact CZ2-O 3.35Å; Y369-S389 WeakPolarHBondContact CD2-O 3.26Å; C387-S389 PolarHBondContact SG-O 3.43Å; S389-S391 WeakPolarHBondContact CB-O 3.38Å; S389-S391 PolarHBondContact OG-N 3.25Å; S389-S391 PolarHBondContact OG-O 3.06Å
390	T	80	Confident	86.2	Confident	62 Å²	62	74 Å²	74	38%	0.38	38%	0.384	S	S	.	.	S	Bend	trans	-94.9	12.6	168.5	54	0	0	0	0	113.8	W355 Y369	W355-T390 PolarHBondContact N-O 2.78Å; W355-T390 WeakPolarHBondContact O-CB 3.18Å; Y369-T390 HydrophobicContact CD2-CG2 4.38Å; Y369-T390 HydrophobicContact CE2-CG2 3.66Å
391	S	81.3	Confident	86	Confident	48 Å²	48	72.3 Å²	72.3	34%	0.336	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.3	172.3	-179.3	0	0	0	0	110.8	T352 L353 S389	T352-S391 WeakPolarHBondContact CG2-OG 3.32Å; L353-S391 CarbonylContact O-C 3.53Å; L353-S391 VanDerWaalsContact O-CA 3.32Å; L353-S391 WeakPolarHBondContact O-CA 3.23Å; L353-S391 PolarHBondContact O-OG 2.59Å; S389-S391 WeakPolarHBondContact CB-O 3.38Å; S389-S391 PolarHBondContact OG-N 3.25Å; S389-S391 PolarHBondContact OG-O 3.06Å
392	Y	81	Confident	85.8	Confident	88 Å²	88	73.5 Å²	73.5	35%	0.345	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	131.7	-178.5	-170.7	-91.1	0	0	0	111.6	L353 L371 V385 C387 I394	L353-Y392 PolarHBondContact N-O 3.39Å; L353-Y392 PolarHBondContact O-N 3.04Å; L371-Y392 HydrophobicContact CD2-CD1 4.13Å; L371-Y392 HydrophobicContact CD2-CG 4.03Å; V385-Y392 HydrophobicContact CG1-CD1 4.08Å; V385-Y392 HydrophobicContact CG1-CD2 4.23Å; V385-Y392 HydrophobicContact CG1-CE1 3.89Å; V385-Y392 HydrophobicContact CG1-CE2 4.05Å; V385-Y392 HydrophobicContact CG1-CG 4.26Å; V385-Y392 HydrophobicContact CG2-CE2 3.98Å; C387-Y392 HydrophobicContact CB-CD2 4.45Å; Y392-I394 HydrophobicContact CD1-CG1 3.83Å; Y392-I394 HydrophobicContact CE1-CG1 4.35Å; Y392-I394 PolarHBondContact O-N 2.74Å
393	N	86.8	Confident	85.8	Confident	62 Å²	62	69.9 Å²	69.9	33%	0.332	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	108	174.1	-171.7	-104.9	0	0	0	110	L351 T352 Q395	L351-N393 CarbonylContact O-C 3.56Å; T352-N393 PolarHBondContact OG1-ND2 2.7Å; T352-N393 VanDerWaalsContact OG1-ND2 3.16Å; N393-Q395 WeakPolarHBondContact OD1-CG 3.44Å; N393-Q395 PolarHBondContact OD1-NE2 2.86Å
394	I	89.2	Confident	85.9	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.015	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130	178.6	-59	178.5	0	0	0	108.4	S350 L351 L353 L384 Y392 L397 F405	S350-I394 CarbonylContact C-O 3.57Å; S350-I394 WeakPolarHBondContact CA-O 3.28Å; S350-I394 WeakPolarHBondContact CB-O 3.45Å; L351-I394 HydrophobicContact CD1-CB 4.42Å; L351-I394 HydrophobicContact CD1-CD1 4.25Å; L351-I394 PolarHBondContact N-O 3.09Å; L351-I394 PolarHBondContact O-N 2.88Å; L353-I394 HydrophobicContact CB-CD1 3.85Å; L353-I394 HydrophobicContact CB-CG1 4.38Å; L353-I394 HydrophobicContact CD2-CD1 3.99Å; L384-I394 HydrophobicContact CD2-CB 4.49Å; L384-I394 HydrophobicContact CD2-CD1 3.8Å; L384-I394 HydrophobicContact CD2-CG1 3.89Å; L384-I394 HydrophobicContact CD2-CG2 3.87Å; Y392-I394 HydrophobicContact CD1-CG1 3.83Å; Y392-I394 HydrophobicContact CE1-CG1 4.35Å; Y392-I394 PolarHBondContact O-N 2.74Å; I394-L397 HydrophobicContact CG2-CD1 3.97Å; I394-L397 HydrophobicContact CG2-CD2 3.74Å; I394-L397 HydrophobicContact CG2-CG 3.87Å; I394-F405 HydrophobicContact CD1-CD1 3.62Å; I394-F405 HydrophobicContact CD1-CE1 3.38Å; I394-F405 HydrophobicContact CD1-CZ 4.14Å
395	Q	86.5	Confident	86	Confident	121 Å²	121	62.9 Å²	62.9	57%	0.565	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	165.5	-175.8	-60.1	-175.3	-2.5	0	0	111.4	S349 N393 L397	S349-Q395 CarbonylContact O-C 3.55Å; N393-Q395 WeakPolarHBondContact OD1-CG 3.44Å; N393-Q395 PolarHBondContact OD1-NE2 2.86Å; Q395-L397 VanDerWaalsContact C-N 3.25Å; Q395-L397 PolarHBondContact O-N 2.95Å
396	N	86.3	Confident	86.2	Confident	143 Å²	143	63.8 Å²	63.8	77%	0.765	33%	0.329	S	S	*	.			trans	63.9	26.6	-177.5	-48.5	-72.5	0	0	0	114	S349	S349-N396 PolarHBondContact O-N 3.3Å
397	L	88.4	Confident	86.4	Confident	9 Å²	9	61.2 Å²	61.2	5%	0.047	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-67.8	145.1	167.2	-61.5	179	0	0	0	109.7	S349 L351 I373 I394 Q395 Y403 M427	S349-L397 VanDerWaalsContact CA-O 3.31Å; S349-L397 WeakPolarHBondContact CA-O 3.29Å; S349-L397 VanDerWaalsContact CB-O 3.3Å; S349-L397 WeakPolarHBondContact CB-O 2.93Å; S349-L397 PolarHBondContact O-N 3.05Å; L351-L397 HydrophobicContact CD2-CD1 3.87Å; L351-L397 HydrophobicContact CG-CD1 3.81Å; I373-L397 HydrophobicContact CD1-CD2 3.83Å; I394-L397 HydrophobicContact CG2-CD1 3.97Å; I394-L397 HydrophobicContact CG2-CD2 3.74Å; I394-L397 HydrophobicContact CG2-CG 3.87Å; Q395-L397 VanDerWaalsContact C-N 3.25Å; Q395-L397 PolarHBondContact O-N 2.95Å; L397-Y403 HydrophobicContact CB-CD2 4.44Å; L397-Y403 HydrophobicContact CB-CE2 3.88Å; L397-Y403 HydrophobicContact CD1-CD2 4.4Å; L397-Y403 HydrophobicContact CD2-CD1 4.25Å; L397-Y403 HydrophobicContact CD2-CD2 4.05Å; L397-Y403 HydrophobicContact CD2-CE1 4.08Å; L397-Y403 HydrophobicContact CD2-CE2 3.88Å; L397-Y403 HydrophobicContact CD2-CG 4.23Å; L397-Y403 HydrophobicContact CG-CE2 4.34Å; L397-M427 HydrophobicContact CB-CE 4.01Å; L397-M427 HydrophobicContact CB-CG 4.1Å; L397-M427 HydrophobicContact CB-SD 4.24Å; L397-M427 HydrophobicContact CD1-CE 3.82Å; L397-M427 HydrophobicContact CD1-SD 3.75Å
398	L	86	Confident	87.1	Confident	82 Å²	82	62.9 Å²	62.9	43%	0.429	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-91.2	132.9	-177.3	-66.6	170	0	0	0	110.6	R401 Y403 M427	L398-R401 HydrophobicContact CB-CG 4Å; L398-R401 PolarHBondContact O-N 3.18Å; L398-Y403 PolarHBondContact N-OH 2.96Å; L398-Y403 VanDerWaalsContact N-OH 3.13Å; L398-M427 WeakPolarHBondContact O-CB 2.93Å
399	P	82.3	Confident	87.5	Confident	47 Å²	47	56.7 Å²	56.7	31%	0.305	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	152.8	173.8	-26	34.4	0	0	0	112.7	R348 R401 L429	R348-P399 HydrophobicContact CG-CG 4.03Å; P399-R401 PolarHBondContact O-N 2.94Å; P399-L429 HydrophobicContact CB-CD2 4.01Å
400	E	82.3	Confident	88.4	Confident	144 Å²	144	56.6 Å²	56.6	67%	0.673	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-8.2	-179.3	-51.9	-174.2	143.1	0	0	116.1	M427 L429	E400-M427 PolarHBondContact N-O 2.86Å; E400-L429 HydrophobicContact CG-CD2 4.12Å; E400-L429 HydrophobicContact CG-CG 4.31Å
401	R	85.2	Confident	88.8	Confident	72 Å²	72	53.7 Å²	53.7	27%	0.272	26%	0.257	S	S	.	.			trans	-78	156.2	172.2	-64.4	-155.9	-178.8	-169.2	-2.6	112.1	D375 L398 P399 Y403 T426 M427	D375-R401 IonicContact OD1-NH1 2.71Å; D375-R401 WeakPolarHBondContact OD2-CD 3.36Å; D375-R401 IonicContact OD2-CZ 3.75Å; D375-R401 IonicContact OD2-NE 3.66Å; D375-R401 IonicContact OD2-NH1 2.62Å; D375-R401 PolarHBondContact OD2-NH1 3.21Å; L398-R401 HydrophobicContact CB-CG 4Å; L398-R401 PolarHBondContact O-N 3.18Å; P399-R401 PolarHBondContact O-N 2.94Å; R401-Y403 HydrophobicContact CB-CE2 3.74Å; R401-T426 WeakPolarHBondContact O-CA 3.13Å; R401-M427 PolarHBondContact O-N 3.15Å; R401-M427 VanDerWaalsContact O-N 3.07Å
402	Q	90.3	Very high	88.7	Confident	89 Å²	89	56 Å²	56	42%	0.416	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.6	171.7	-57.1	-167.9	-41.5	0	0	111.3	S376 V425 T426	S376-Q402 WeakPolarHBondContact CB-O 3.26Å; S376-Q402 PolarHBondContact N-O 2.99Å; S376-Q402 PolarHBondContact OG-N 2.75Å; S376-Q402 PolarHBondContact OG-O 3.1Å; Q402-V425 CarbonylContact C-O 3.59Å; Q402-V425 VanDerWaalsContact CA-O 3.29Å; Q402-V425 WeakPolarHBondContact CA-O 3.47Å; Q402-T426 HydrophobicContact CG-CG2 4.14Å; Q402-T426 WeakPolarHBondContact CG-OG1 3.31Å; Q402-T426 PolarHBondContact NE2-OG1 3.16Å
403	Y	92.7	Very high	88.7	Confident	12 Å²	12	55.6 Å²	55.6	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.3	-179.5	-63.8	-76	0	0	0	111.7	I373 W374 D375 L397 L398 R401 F405 A424 V425 M427	I373-Y403 HydrophobicContact CD1-CD1 3.66Å; I373-Y403 HydrophobicContact CD1-CE1 4.09Å; I373-Y403 HydrophobicContact CD1-CG 4.36Å; I373-Y403 HydrophobicContact CG1-CD1 3.99Å; W374-Y403 VanDerWaalsContact O-CA 3.3Å; W374-Y403 WeakPolarHBondContact O-CA 3.4Å; D375-Y403 HydrophobicContact CB-CD1 3.99Å; D375-Y403 HydrophobicContact CB-CE1 3.74Å; D375-Y403 WeakPolarHBondContact OD2-CE1 3.06Å; D375-Y403 PolarHBondContact OD2-OH 2.64Å; L397-Y403 HydrophobicContact CB-CD2 4.44Å; L397-Y403 HydrophobicContact CB-CE2 3.88Å; L397-Y403 HydrophobicContact CD1-CD2 4.4Å; L397-Y403 HydrophobicContact CD2-CD1 4.25Å; L397-Y403 HydrophobicContact CD2-CD2 4.05Å; L397-Y403 HydrophobicContact CD2-CE1 4.08Å; L397-Y403 HydrophobicContact CD2-CE2 3.88Å; L397-Y403 HydrophobicContact CD2-CG 4.23Å; L397-Y403 HydrophobicContact CG-CE2 4.34Å; L398-Y403 PolarHBondContact N-OH 2.96Å; L398-Y403 VanDerWaalsContact N-OH 3.13Å; R401-Y403 HydrophobicContact CB-CE2 3.74Å; Y403-F405 HydrophobicContact CG-CZ 4.46Å; Y403-A424 WeakPolarHBondContact O-CA 3.28Å; Y403-V425 PolarHBondContact N-O 2.67Å; Y403-V425 PolarHBondContact O-N 3.09Å; Y403-M427 HydrophobicContact CD2-CG 3.78Å; Y403-M427 HydrophobicContact CD2-SD 4.22Å; Y403-M427 HydrophobicContact CE2-CG 3.7Å
404	K	94.5	Very high	88.6	Confident	47 Å²	47	53.4 Å²	53.4	20%	0.204	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	155.7	163	-62.1	-175	179.9	-179.3	0	110.2	W374 W381 E421 S422 A424	W374-K404 HydrophobicContact CB-CB 4.29Å; W374-K404 HydrophobicContact CE3-CB 4.47Å; W374-K404 HydrophobicContact CE3-CD 4.46Å; W374-K404 HydrophobicContact CE3-CG 4.24Å; W374-K404 PolarHBondContact N-O 3.23Å; W374-K404 PolarHBondContact O-N 3.49Å; W381-K404 HydrophobicContact CH2-CB 3.74Å; W381-K404 HydrophobicContact CZ2-CB 4.33Å; W381-K404 HydrophobicContact CZ3-CB 4.49Å; W381-K404 WeakPolarHBondContact CZ3-O 3.23Å; K404-E421 HydrophobicContact CD-CB 4.49Å; K404-E421 VanDerWaalsContact NZ-CD 3.28Å; K404-E421 IonicContact NZ-OE1 3.16Å; K404-E421 PolarHBondContact NZ-OE1 3.43Å; K404-E421 IonicContact NZ-OE2 2.72Å; K404-E421 PolarHBondContact NZ-OE2 3.24Å; K404-S422 WeakPolarHBondContact CA-OG 3.45Å; K404-A424 HydrophobicContact CG-CB 4.17Å
405	F	95.1	Very high	88.7	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.009	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.5	-177.8	-51.7	-78.4	0	0	0	111	T343 L351 L353 E372 I373 I394 Y403 S422	T343-F405 HydrophobicContact CG2-CD2 3.99Å; T343-F405 HydrophobicContact CG2-CE2 4.05Å; L351-F405 HydrophobicContact CD1-CE2 4.19Å; L351-F405 HydrophobicContact CD1-CZ 4.15Å; L351-F405 HydrophobicContact CD2-CE2 3.91Å; L351-F405 HydrophobicContact CD2-CZ 3.94Å; L351-F405 HydrophobicContact CG-CZ 4.44Å; L353-F405 HydrophobicContact CD1-CB 3.73Å; L353-F405 HydrophobicContact CD1-CD2 3.94Å; L353-F405 HydrophobicContact CD1-CG 3.85Å; L353-F405 HydrophobicContact CD2-CB 3.66Å; L353-F405 HydrophobicContact CD2-CD1 4.13Å; L353-F405 HydrophobicContact CD2-CG 3.95Å; L353-F405 HydrophobicContact CG-CB 4.37Å; E372-F405 WeakPolarHBondContact O-CA 3.24Å; I373-F405 HydrophobicContact CB-CD1 4.35Å; I373-F405 HydrophobicContact CB-CE1 4.42Å; I373-F405 HydrophobicContact CD1-CD1 4.43Å; I373-F405 HydrophobicContact CD1-CE1 3.67Å; I373-F405 HydrophobicContact CD1-CZ 4.46Å; I373-F405 HydrophobicContact CG1-CD1 4.01Å; I373-F405 HydrophobicContact CG1-CE1 3.68Å; I394-F405 HydrophobicContact CD1-CD1 3.62Å; I394-F405 HydrophobicContact CD1-CE1 3.38Å; I394-F405 HydrophobicContact CD1-CZ 4.14Å; Y403-F405 HydrophobicContact CG-CZ 4.46Å; F405-S422 PolarHBondContact N-OG 2.71Å; F405-S422 PolarHBondContact O-N 2.93Å
406	R	95.9	Very high	88.9	Confident	53 Å²	53	51.6 Å²	51.6	20%	0.2	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	156.7	166.7	71.3	-170.6	-172	169.2	1.2	109.4	E372 W381 P418 S419	E372-R406 HydrophobicContact CB-CG 3.88Å; E372-R406 PolarHBondContact N-O 2.84Å; E372-R406 PolarHBondContact O-N 3.23Å; E372-R406 IonicContact OE1-NH2 2.62Å; E372-R406 IonicContact OE2-CZ 3.81Å; E372-R406 IonicContact OE2-NE 3.15Å; E372-R406 PolarHBondContact OE2-NE 3.43Å; E372-R406 IonicContact OE2-NH2 3.4Å; E372-R406 PolarHBondContact OE2-NH2 3.25Å; W381-R406 HydrophobicContact CD2-CG 4.19Å; W381-R406 HydrophobicContact CE3-CG 3.75Å; W381-R406 HydrophobicContact CH2-CB 4.03Å; W381-R406 HydrophobicContact CH2-CG 3.9Å; W381-R406 HydrophobicContact CZ2-CG 4.32Å; W381-R406 HydrophobicContact CZ3-CB 4.07Å; W381-R406 HydrophobicContact CZ3-CG 3.61Å; R406-P418 HydrophobicContact CG-CB 4.11Å; R406-S419 WeakPolarHBondContact CA-OG 3.27Å
407	I	95.8	Very high	89.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.3	-178.1	-59.4	92.1	0	0	0	109.9	P337 P341 L353 W355 Y369 H370 L371 P418 S419	P337-I407 HydrophobicContact CB-CB 4.42Å; P337-I407 VanDerWaalsContact CD-O 3.26Å; P337-I407 WeakPolarHBondContact CD-O 3.34Å; P337-I407 HydrophobicContact CG-CB 4.06Å; P337-I407 HydrophobicContact CG-CG2 3.95Å; P337-I407 WeakPolarHBondContact CG-O 3.35Å; P341-I407 HydrophobicContact CB-CD1 3.64Å; P341-I407 HydrophobicContact CG-CD1 3.37Å; L353-I407 HydrophobicContact CD2-CD1 4.05Å; W355-I407 HydrophobicContact CB-CD1 3.88Å; W355-I407 HydrophobicContact CD2-CD1 3.84Å; W355-I407 HydrophobicContact CD2-CG1 3.81Å; W355-I407 HydrophobicContact CE3-CD1 3.97Å; W355-I407 HydrophobicContact CE3-CG1 4.12Å; W355-I407 HydrophobicContact CG-CB 4.47Å; W355-I407 HydrophobicContact CG-CD1 3.81Å; W355-I407 HydrophobicContact CG-CG1 4.02Å; Y369-I407 HydrophobicContact CD1-CG2 3.78Å; Y369-I407 HydrophobicContact CG-CG2 4.18Å; H370-I407 CarbonylContact O-C 3.56Å; H370-I407 VanDerWaalsContact O-CA 3.31Å; H370-I407 WeakPolarHBondContact O-CA 3.16Å; L371-I407 HydrophobicContact CD1-CG1 4.41Å; L371-I407 HydrophobicContact CD1-CG2 4.49Å; L371-I407 HydrophobicContact CG-CG1 4.02Å; I407-P418 CarbonylContact O-C 3.59Å; I407-P418 WeakPolarHBondContact O-CA 3.41Å; I407-S419 PolarHBondContact N-OG 2.81Å; I407-S419 PolarHBondContact O-N 3.13Å
408	R	95.9	Very high	89.4	Confident	51 Å²	51	51.5 Å²	51.5	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.9	162.8	-64.8	175.9	179.3	-89.5	-3.4	109.9	Y369 H370 E372 I415 G416 E417 P418	Y369-R408 CarbonylContact C-O 3.55Å; Y369-R408 VanDerWaalsContact CA-O 3.28Å; Y369-R408 WeakPolarHBondContact CA-O 3.25Å; H370-R408 HydrophobicContact CB-CB 4.45Å; H370-R408 PolarHBondContact N-O 3.37Å; H370-R408 PolarHBondContact O-N 3.48Å; E372-R408 WeakPolarHBondContact OE1-CD 3.33Å; E372-R408 IonicContact OE1-CZ 3.85Å; E372-R408 IonicContact OE1-NE 2.68Å; E372-R408 PolarHBondContact OE1-NE 3Å; R408-I415 HydrophobicContact CB-CG2 3.74Å; R408-I415 HydrophobicContact CG-CG2 4.33Å; R408-G416 PolarHBondContact NH1-O 3.19Å; R408-E417 IonicContact CZ-OE2 2.72Å; R408-E417 IonicContact NH1-OE2 3.9Å; R408-E417 PolarHBondContact NH1-OE2 3.22Å; R408-E417 IonicContact NH2-OE2 2.7Å; R408-E417 PolarHBondContact NH2-OE2 3.01Å; R408-P418 HydrophobicContact CG-CB 3.92Å
409	A	90.3	Very high	89.7	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	152.8	168.3	0	0	0	0	0	110.9	P334 P337 P358 V366 Y369 I415 G416	P334-A409 HydrophobicContact CB-CB 3.74Å; P334-A409 HydrophobicContact CG-CB 4.13Å; P337-A409 HydrophobicContact CG-CB 4.15Å; P358-A409 HydrophobicContact CB-CB 4.45Å; P358-A409 HydrophobicContact CG-CB 3.91Å; V366-A409 HydrophobicContact CG1-CB 3.81Å; V366-A409 HydrophobicContact CG2-CB 4.12Å; Y369-A409 HydrophobicContact CD1-CB 4.17Å; Y369-A409 HydrophobicContact CE1-CB 3.98Å; A409-I415 WeakPolarHBondContact O-CA 3.36Å; A409-G416 PolarHBondContact O-N 2.81Å
410	Q	90.8	Very high	90	Very high	54 Å²	54	48.5 Å²	48.5	25%	0.252	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.3	174.5	-178.9	-178.5	6.8	0	0	111.2	V366 Q367 T368 H370 G414 I415	V366-Q410 CarbonylContact C-O 3.57Å; V366-Q410 WeakPolarHBondContact CA-O 3.32Å; V366-Q410 WeakPolarHBondContact CG1-O 3.25Å; Q367-Q410 PolarHBondContact N-O 3.45Å; T368-Q410 PolarHBondContact N-O 2.78Å; T368-Q410 PolarHBondContact O-N 3.46Å; H370-Q410 PolarHBondContact NE2-OE1 3.44Å; Q410-G414 WeakPolarHBondContact CA-O 3.22Å; Q410-I415 HydrophobicContact CB-CG1 4.07Å; Q410-I415 HydrophobicContact CG-CG1 3.85Å
411	N	87.5	Confident	90.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-169.6	163.9	71.9	11	0	0	0	110.3	D332 P334 D361 S364 Y413 G414	D332-N411 PolarHBondContact O-ND2 2.68Å; P334-N411 HydrophobicContact CG-CB 3.8Å; D361-N411 PolarHBondContact O-ND2 2.86Å; S364-N411 WeakPolarHBondContact O-CB 2.86Å; S364-N411 PolarHBondContact O-ND2 2.94Å; N411-Y413 VanDerWaalsContact C-N 3.25Å; N411-Y413 PolarHBondContact O-N 2.82Å; N411-Y413 WeakPolarHBondContact OD1-CA 3.45Å; N411-Y413 WeakPolarHBondContact OD1-CB 3.03Å; N411-Y413 PolarHBondContact OD1-N 2.86Å; N411-G414 PolarHBondContact N-O 2.79Å; N411-G414 PolarHBondContact O-N 2.96Å; N411-G414 PolarHBondContact OD1-N 2.98Å; N411-G414 PolarHBondContact OD1-O 2.7Å
412	I	79.1	Confident	90.6	Very high	98 Å²	98	42.9 Å²	42.9	50%	0.503	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.5	179.4	66.4	-176.3	0	0	0	114.3	S364 Q367	S364-I412 WeakPolarHBondContact OG-CD1 3.47Å; S364-I412 WeakPolarHBondContact OG-CG1 3.38Å; Q367-I412 VanDerWaalsContact NE2-CG2 3.25Å
413	Y	82.4	Confident	90.3	Very high	78 Å²	78	46.6 Å²	46.6	31%	0.306	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-14.1	180	-56.1	-61.3	0	0	0	112.7	L252 V331 N411	L252-Y413 HydrophobicContact CD2-CD1 4.05Å; L252-Y413 HydrophobicContact CD2-CG 4.25Å; V331-Y413 HydrophobicContact CB-CD2 3.94Å; V331-Y413 HydrophobicContact CB-CE2 3.51Å; V331-Y413 HydrophobicContact CG1-CE2 3.83Å; V331-Y413 HydrophobicContact CG2-CD2 4.26Å; V331-Y413 HydrophobicContact CG2-CE1 4.2Å; V331-Y413 HydrophobicContact CG2-CE2 3.73Å; N411-Y413 VanDerWaalsContact C-N 3.25Å; N411-Y413 PolarHBondContact O-N 2.82Å; N411-Y413 WeakPolarHBondContact OD1-CA 3.45Å; N411-Y413 WeakPolarHBondContact OD1-CB 3.03Å; N411-Y413 PolarHBondContact OD1-N 2.86Å
414	G	84.4	Confident	90.1	Very high	17 Å²	17	48 Å²	48	18%	0.175	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.1	-169	161.7	0	0	0	0	0	115.1	P334 Q410 N411	P334-G414 WeakPolarHBondContact CD-O 3.11Å; Q410-G414 WeakPolarHBondContact CA-O 3.22Å; N411-G414 PolarHBondContact N-O 2.79Å; N411-G414 PolarHBondContact O-N 2.96Å; N411-G414 PolarHBondContact OD1-N 2.98Å; N411-G414 PolarHBondContact OD1-O 2.7Å
415	I	91.4	Very high	89.7	Confident	80 Å²	80	46.6 Å²	46.6	41%	0.41	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.9	176.6	-52.4	173.8	0	0	0	109	R408 A409 Q410	R408-I415 HydrophobicContact CB-CG2 3.74Å; R408-I415 HydrophobicContact CG-CG2 4.33Å; A409-I415 WeakPolarHBondContact O-CA 3.36Å; Q410-I415 HydrophobicContact CB-CG1 4.07Å; Q410-I415 HydrophobicContact CG-CG1 3.85Å
416	G	90.3	Very high	89.3	Confident	5 Å²	5	50.1 Å²	50.1	5%	0.052	26%	0.264	C	S	.	.			trans	-77	179	175.8	0	0	0	0	0	114.3	P334 R408 A409	P334-G416 VanDerWaalsContact O-CA 3.22Å; P334-G416 WeakPolarHBondContact O-CA 3.21Å; R408-G416 PolarHBondContact NH1-O 3.19Å; A409-G416 PolarHBondContact O-N 2.81Å
417	E	92.3	Very high	88.7	Confident	122 Å²	122	47.7 Å²	47.7	57%	0.57	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-74.5	160.7	172.8	-73.6	-55.9	168.5	0	0	112.4	P336 R408	P336-E417 WeakPolarHBondContact CA-O 3.42Å; P336-E417 HydrophobicContact CG-CB 4.13Å; R408-E417 IonicContact CZ-OE2 2.72Å; R408-E417 IonicContact NH1-OE2 3.9Å; R408-E417 PolarHBondContact NH1-OE2 3.22Å; R408-E417 IonicContact NH2-OE2 2.7Å; R408-E417 PolarHBondContact NH2-OE2 3.01Å
418	P	92.5	Very high	87.4	Confident	29 Å²	29	49.5 Å²	49.5	19%	0.188	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-81.3	151.1	-171.7	34.6	-33.9	0	0	0	110.8	R406 I407 R408	R406-P418 HydrophobicContact CG-CB 4.11Å; I407-P418 CarbonylContact O-C 3.59Å; I407-P418 WeakPolarHBondContact O-CA 3.41Å; R408-P418 HydrophobicContact CG-CB 3.92Å
419	S	92.1	Very high	85.3	Confident	7 Å²	7	51 Å²	51	5%	0.049	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-53.8	163.3	168.6	73.3	0	0	0	0	111.4	P337 P341 R406 I407	P337-S419 WeakPolarHBondContact O-CB 3.34Å; P341-S419 WeakPolarHBondContact CG-OG 3.44Å; R406-S419 WeakPolarHBondContact CA-OG 3.27Å; I407-S419 PolarHBondContact N-OG 2.81Å; I407-S419 PolarHBondContact O-N 3.13Å
420	A	88.8	Confident	83.2	Confident	58 Å²	58	56.8 Å²	56.8	48%	0.479	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-50.7	144.1	159.2	0	0	0	0	0	110.1	V340 P341	V340-A420 HydrophobicContact CG2-CB 4.01Å; P341-A420 WeakPolarHBondContact CD-O 3.47Å
421	E	91.8	Very high	81	Confident	94 Å²	94	58.5 Å²	58.5	44%	0.439	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-71	145.2	176.2	54.2	169.9	-146.3	0	0	111.2	V340 W381 K404	V340-E421 WeakPolarHBondContact CG1-O 3.45Å; W381-E421 HydrophobicContact CH2-CB 3.95Å; W381-E421 HydrophobicContact CZ2-CB 3.78Å; K404-E421 HydrophobicContact CD-CB 4.49Å; K404-E421 VanDerWaalsContact NZ-CD 3.28Å; K404-E421 IonicContact NZ-OE1 3.16Å; K404-E421 PolarHBondContact NZ-OE1 3.43Å; K404-E421 IonicContact NZ-OE2 2.72Å; K404-E421 PolarHBondContact NZ-OE2 3.24Å
422	S	89.1	Confident	78.8	Confident	5 Å²	5	64.9 Å²	64.9	4%	0.035	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-65	158.8	173.6	77.5	0	0	0	0	111.8	K404 F405	K404-S422 WeakPolarHBondContact CA-OG 3.45Å; F405-S422 PolarHBondContact N-OG 2.71Å; F405-S422 PolarHBondContact O-N 2.93Å
423	E	84.2	Confident	76.9	Confident	166 Å²	166	66.8 Å²	66.8	78%	0.776	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-53.9	152.3	157.9	-69.9	-62.7	164	0	0	110.8	V425	E423-V425 PolarHBondContact O-N 2.82Å
424	A	87.9	Confident	75.1	Confident	42 Å²	42	69.4 Å²	69.4	35%	0.347	40%	0.396	S	S	.	.			trans	-80.8	109.2	-176.1	0	0	0	0	0	111.3	Y403 K404	Y403-A424 WeakPolarHBondContact O-CA 3.28Å; K404-A424 HydrophobicContact CG-CB 4.17Å
425	V	85.6	Confident	72.8	Confident	18 Å²	18	77.4 Å²	77.4	11%	0.109	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.1	178.6	179.5	0	0	0	0	110	T343 I346 L351 Q402 Y403 E423 M427	T343-V425 HydrophobicContact CG2-CG2 3.96Å; I346-V425 HydrophobicContact CD1-CG1 3.92Å; I346-V425 HydrophobicContact CG1-CG1 4.45Å; I346-V425 HydrophobicContact CG2-CG1 4.1Å; L351-V425 HydrophobicContact CD2-CB 4.32Å; L351-V425 HydrophobicContact CD2-CG1 3.9Å; Q402-V425 CarbonylContact C-O 3.59Å; Q402-V425 VanDerWaalsContact CA-O 3.29Å; Q402-V425 WeakPolarHBondContact CA-O 3.47Å; Y403-V425 PolarHBondContact N-O 2.67Å; Y403-V425 PolarHBondContact O-N 3.09Å; E423-V425 PolarHBondContact O-N 2.82Å; V425-M427 HydrophobicContact CG1-SD 4.2Å
426	T	87.5	Confident	70.1	Confident	75 Å²	75	80.9 Å²	80.9	46%	0.46	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.8	174.7	-48.3	0	0	0	0	109.6	R401 Q402	R401-T426 WeakPolarHBondContact O-CA 3.13Å; Q402-T426 HydrophobicContact CG-CG2 4.14Å; Q402-T426 WeakPolarHBondContact CG-OG1 3.31Å; Q402-T426 PolarHBondContact NE2-OG1 3.16Å
427	M	83.1	Confident	67.4	Low	3 Å²	3	88.5 Å²	88.5	2%	0.015	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-77.7	125.4	-176.2	-58.1	-50.8	-63.3	0	0	112.1	I346 R347 L351 L397 L398 E400 R401 Y403 V425	I346-M427 HydrophobicContact CG2-CE 4.26Å; R347-M427 WeakPolarHBondContact O-CE 3.42Å; L351-M427 HydrophobicContact CD2-SD 4.13Å; L397-M427 HydrophobicContact CB-CE 4.01Å; L397-M427 HydrophobicContact CB-CG 4.1Å; L397-M427 HydrophobicContact CB-SD 4.24Å; L397-M427 HydrophobicContact CD1-CE 3.82Å; L397-M427 HydrophobicContact CD1-SD 3.75Å; L398-M427 WeakPolarHBondContact O-CB 2.93Å; E400-M427 PolarHBondContact N-O 2.86Å; R401-M427 PolarHBondContact O-N 3.15Å; R401-M427 VanDerWaalsContact O-N 3.07Å; Y403-M427 HydrophobicContact CD2-CG 3.78Å; Y403-M427 HydrophobicContact CD2-SD 4.22Å; Y403-M427 HydrophobicContact CE2-CG 3.7Å; V425-M427 HydrophobicContact CG1-SD 4.2Å
428	G	67.8	Low	64.6	Low	37 Å²	37	86.9 Å²	86.9	38%	0.381	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-76.5	173	-174.9	0	0	0	0	0	115.5
429	L	52.2	Low	61.8	Low	84 Å²	84	94.1 Å²	94.1	44%	0.44	53%	0.526	S	S	.	.	S	Bend	trans	-108.8	-5.1	-178.5	-73.6	177.7	0	0	0	115	R348 P399 E400	R348-L429 VanDerWaalsContact CZ-O 3.27Å; R348-L429 PolarHBondContact NH1-O 3.18Å; P399-L429 HydrophobicContact CB-CD2 4.01Å; E400-L429 HydrophobicContact CG-CD2 4.12Å; E400-L429 HydrophobicContact CG-CG 4.31Å
430	V	47	Very low	59	Low	120 Å²	120	97.8 Å²	97.8	73%	0.727	56%	0.556	S	S	*	*			trans	-128.1	136.7	-171.8	-175.4	0	0	0	0	109
431	D	43.3	Very low	56.3	Low	90 Å²	90	103.9 Å²	103.9	48%	0.481	58%	0.575	S	S	.	*			trans	-93.9	114.4	172.8	-52.7	-76.4	0	0	0	107.2	R348 D433	R348-D431 WeakPolarHBondContact CB-OD1 3.47Å; D431-D433 PolarHBondContact O-N 3.06Å
432	D	41.2	Very low	53.8	Low	134 Å²	134	104.5 Å²	104.5	72%	0.717	58%	0.578	S	S	*	*			trans	-95.5	76.1	-179.8	-163	5.5	0	0	0	109.7	N434	D432-N434 PolarHBondContact O-N 3.41Å; D432-N434 PolarHBondContact OD1-ND2 3.08Å; D432-N434 VanDerWaalsContact OD1-ND2 3.11Å
433	D	41.1	Very low	51.2	Low	139 Å²	139	113.1 Å²	113.1	74%	0.743	62%	0.618	S	S	*	*			trans	-72.2	68.6	172.6	-73.4	-38.7	0	0	0	110.2	D431	D431-D433 PolarHBondContact O-N 3.06Å
434	N	42.7	Very low	48.9	Very low	133 Å²	133	111 Å²	111	71%	0.711	61%	0.612	S	S	*	*			trans	-138.7	85.3	167.8	-72.5	-73.2	0	0	0	110.3	D432	D432-N434 PolarHBondContact O-N 3.41Å; D432-N434 PolarHBondContact OD1-ND2 3.08Å; D432-N434 VanDerWaalsContact OD1-ND2 3.11Å
435	Q	37	Very low	47	Very low	185 Å²	185	115.8 Å²	115.8	86%	0.864	63%	0.627	S	S	*	*			trans	-130.5	108.1	159.3	-168.3	153.5	16.3	0	0	107.1	D437	Q435-D437 PolarHBondContact O-N 2.84Å
436	D	34.8	Very low	44.9	Very low	153 Å²	153	120.8 Å²	120.8	82%	0.818	65%	0.653	S	S	*	*			trans	-61.2	120.7	-180	-68	-64.7	0	0	0	109.7	A438	D436-A438 PolarHBondContact O-N 2.99Å
437	D	34	Very low	43.1	Very low	165 Å²	165	122 Å²	122	88%	0.882	66%	0.656	S	S	*	*			trans	-69.8	72.4	165.2	-78.5	-45.6	0	0	0	109.1	Q435 E439	Q435-D437 PolarHBondContact O-N 2.84Å; D437-E439 PolarHBondContact O-N 2.84Å
438	A	32.5	Very low	41.2	Very low	87 Å²	87	129.2 Å²	129.2	72%	0.719	70%	0.695	S	S	*	*			trans	-73	78.7	169.8	0	0	0	0	0	109.1	D436 A440	D436-A438 PolarHBondContact O-N 2.99Å; A438-A440 VanDerWaalsContact C-N 3.28Å; A438-A440 PolarHBondContact O-N 2.71Å
439	E	34.1	Very low	40.3	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	71%	0.707	S	S	*	*			trans	-57.2	96.8	159.9	-71	-168	142	0	0	108	D437 E441	D437-E439 PolarHBondContact O-N 2.84Å; E439-E441 PolarHBondContact O-N 2.98Å
440	A	33.2	Very low	40.3	Very low	83 Å²	83	139.6 Å²	139.6	69%	0.686	73%	0.729	S	S	*	*			trans	-70.5	102.4	173.4	0	0	0	0	0	108.3	A438 E442	A438-A440 VanDerWaalsContact C-N 3.28Å; A438-A440 PolarHBondContact O-N 2.71Å; A440-E442 VanDerWaalsContact C-N 3.29Å; A440-E442 PolarHBondContact O-N 2.65Å
441	E	32.9	Very low	40.7	Very low	187 Å²	187	137 Å²	137	87%	0.874	71%	0.714	S	S	*	*			trans	-58.6	98.2	159.2	-68.3	-170.2	154.2	0	0	107.6	E439 E443	E439-E441 PolarHBondContact O-N 2.98Å; E441-E443 PolarHBondContact O-N 3.12Å; E441-E443 VanDerWaalsContact O-N 3.08Å
442	E	37.7	Very low	41.6	Very low	107 Å²	107	139.5 Å²	139.5	50%	0.5	72%	0.723	S	S	.	*			trans	-68.6	101.5	169.8	-77.8	174.4	-143.7	0	0	107.9	A440 D444 K600	A440-E442 VanDerWaalsContact C-N 3.29Å; A440-E442 PolarHBondContact O-N 2.65Å; E442-D444 PolarHBondContact O-N 3.25Å; E442-K600 IonicContact OE1-NZ 2.84Å; E442-K600 PolarHBondContact OE1-NZ 3.29Å; E442-K600 IonicContact OE2-NZ 3.85Å; E442-K600 PolarHBondContact OE2-NZ 3.37Å
443	E	35.2	Very low	42.9	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	71%	0.705	S	S	*	*			trans	-61.8	101.3	162.5	-68.6	-171.8	149.7	0	0	108.3	E441 E445	E441-E443 PolarHBondContact O-N 3.12Å; E441-E443 VanDerWaalsContact O-N 3.08Å; E443-E445 VanDerWaalsContact C-N 3.32Å; E443-E445 PolarHBondContact O-N 3.45Å
444	D	36.8	Very low	44.4	Very low	122 Å²	122	139 Å²	139	65%	0.652	70%	0.701	S	S	*	*			trans	-61.8	90.6	168.6	-89.2	-45.7	0	0	0	108.7	E442 D446	E442-D444 PolarHBondContact O-N 3.25Å; D444-D446 PolarHBondContact O-N 3.36Å
445	E	47.6	Very low	46.1	Very low	141 Å²	141	138.5 Å²	138.5	66%	0.659	70%	0.699	S	S	*	*			trans	-54.5	133.4	172.4	-73.6	-164.8	141.8	0	0	110.3	E443 L447	E443-E445 VanDerWaalsContact C-N 3.32Å; E443-E445 PolarHBondContact O-N 3.45Å; E445-L447 PolarHBondContact O-N 3Å
446	D	41.3	Very low	48.5	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	66%	0.66	S	S	*	*			trans	-47.5	97.8	-179.8	-71.1	-48	0	0	0	113.2	D444 D448 K449	D444-D446 PolarHBondContact O-N 3.36Å; D446-D448 PolarHBondContact O-N 2.78Å; D446-D448 VanDerWaalsContact O-N 3.16Å; D446-K449 IonicContact OD2-NZ 3.55Å
447	L	48.8	Very low	51	Low	101 Å²	101	128.2 Å²	128.2	53%	0.529	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-6.6	-179.7	-69.1	173.4	0	0	0	113.8	E445 K449 V598 N599	E445-L447 PolarHBondContact O-N 3Å; L447-K449 PolarHBondContact O-N 3.23Å; L447-V598 HydrophobicContact CD1-CG1 4.09Å; L447-N599 HydrophobicContact CD1-CB 4.41Å
448	D	44.7	Very low	53.7	Low	153 Å²	153	122.3 Å²	122.3	82%	0.818	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	6	-178	-78.1	-10.5	0	0	0	114.4	D446	D446-D448 PolarHBondContact O-N 2.78Å; D446-D448 VanDerWaalsContact O-N 3.16Å
449	K	47.6	Very low	56.6	Low	149 Å²	149	121.3 Å²	121.3	65%	0.648	60%	0.602	S	S	*	*	S	Bend	trans	-90.7	120.3	171.9	-65	-173.9	-173.3	87.2	0	110.3	D446 L447	D446-K449 IonicContact OD2-NZ 3.55Å; L447-K449 PolarHBondContact O-N 3.23Å
450	E	52.2	Low	59.2	Low	191 Å²	191	116.7 Å²	116.7	89%	0.893	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-53	125.5	171.3	-67.3	-171.7	141.3	0	0	110.3
451	P	56	Low	61.4	Low	64 Å²	64	120.5 Å²	120.5	42%	0.416	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-71.6	134.8	-177.4	27.8	-33.9	0	0	0	110.9	Y453	P451-Y453 HydrophobicContact CG-CE1 3.91Å; P451-Y453 HydrophobicContact CG-CE2 4.22Å; P451-Y453 VanDerWaalsContact O-CD2 3.3Å; P451-Y453 WeakPolarHBondContact O-CD2 3.16Å; P451-Y453 PolarHBondContact O-N 2.99Å
452	E	62.1	Low	64.1	Low	144 Å²	144	114 Å²	114	67%	0.673	57%	0.568	S	S	*	*			trans	-75.2	91.4	175.7	-167.2	-170.9	-124.4	0	0	110.1	R454	E452-R454 IonicContact OE2-CZ 2.68Å; E452-R454 IonicContact OE2-NE 3.56Å; E452-R454 PolarHBondContact OE2-NE 2.85Å; E452-R454 IonicContact OE2-NH2 3.28Å; E452-R454 PolarHBondContact OE2-NH2 3Å
453	Y	68	Low	66.5	Low	84 Å²	84	116 Å²	116	33%	0.329	58%	0.575	S	S	.	*			trans	-62	140.5	178	-56.1	-75.8	0	0	0	112.2	P451 H521 Q527	P451-Y453 HydrophobicContact CG-CE1 3.91Å; P451-Y453 HydrophobicContact CG-CE2 4.22Å; P451-Y453 VanDerWaalsContact O-CD2 3.3Å; P451-Y453 WeakPolarHBondContact O-CD2 3.16Å; P451-Y453 PolarHBondContact O-N 2.99Å; Y453-H521 HydrophobicContact CD1-CB 3.67Å; Y453-H521 AromaticContact CD1-CD2 3.51Å; Y453-H521 AromaticContact CD1-CG 3.85Å; Y453-H521 HydrophobicContact CD2-CB 4.36Å; Y453-H521 HydrophobicContact CE1-CB 4.02Å; Y453-H521 HydrophobicContact CG-CB 3.84Å; Y453-H521 AromaticContact CG-CD2 3.91Å; Y453-H521 AromaticContact CG-CG 3.98Å; Y453-Q527 HydrophobicContact CD1-CG 4.34Å; Y453-Q527 HydrophobicContact CE1-CG 3.97Å
454	R	72.9	Confident	69.2	Low	178 Å²	178	107.7 Å²	107.7	67%	0.672	54%	0.536	S	S	*	.			trans	-148.5	132	-179.7	-60.4	179.5	-177	-177.6	0.1	109.9	E452 V456	E452-R454 IonicContact OE2-CZ 2.68Å; E452-R454 IonicContact OE2-NE 3.56Å; E452-R454 PolarHBondContact OE2-NE 2.85Å; E452-R454 IonicContact OE2-NH2 3.28Å; E452-R454 PolarHBondContact OE2-NH2 3Å; R454-V456 PolarHBondContact O-N 3.4Å
455	D	79.1	Confident	71.8	Confident	123 Å²	123	108.4 Å²	108.4	66%	0.658	53%	0.534	S	S	*	.			trans	-60.9	123.5	-179.2	-59.1	-34.7	0	0	0	112.2	T457 H521	D455-T457 PolarHBondContact O-N 3.27Å; D455-T457 VanDerWaalsContact O-N 3.16Å; D455-H521 IonicContact OD1-CE1 3.25Å
456	V	86.2	Confident	74	Confident	9 Å²	9	106.6 Å²	106.6	6%	0.055	53%	0.525	C	S	.	.			trans	-75.6	108.6	179.4	-177.4	0	0	0	0	110.7	R454 N518 C528 D530 A531	R454-V456 PolarHBondContact O-N 3.4Å; V456-N518 WeakPolarHBondContact CB-OD1 3.46Å; V456-N518 WeakPolarHBondContact CG2-OD1 3.15Å; V456-N518 PolarHBondContact N-OD1 3.05Å; V456-N518 PolarHBondContact O-ND2 2.96Å; V456-C528 HydrophobicContact CG2-CB 4.34Å; V456-C528 VanDerWaalsContact CG2-O 3.23Å; V456-C528 WeakPolarHBondContact CG2-O 3.37Å; V456-D530 VanDerWaalsContact CG1-C 3.46Å; V456-A531 HydrophobicContact CG1-CB 3.56Å; V456-A531 VanDerWaalsContact CG1-N 3.34Å
457	T	88.4	Confident	76.5	Confident	113 Å²	113	104.5 Å²	104.5	69%	0.693	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-85.9	119.7	165.4	-58.9	0	0	0	0	109.5	D455 K459	D455-T457 PolarHBondContact O-N 3.27Å; D455-T457 VanDerWaalsContact O-N 3.16Å; T457-K459 PolarHBondContact O-N 2.98Å
458	I	90.8	Very high	78.7	Confident	40 Å²	40	100.3 Å²	100.3	21%	0.205	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-65.1	116.8	-180	-55.3	177.4	0	0	0	109.7	T460 R511 I514 A531 E533	I458-T460 PolarHBondContact O-N 3.24Å; I458-R511 HydrophobicContact CD1-CB 4.26Å; I458-R511 HydrophobicContact CD1-CG 3.74Å; I458-I514 HydrophobicContact CD1-CB 4.39Å; I458-I514 HydrophobicContact CD1-CD1 3.77Å; I458-I514 HydrophobicContact CD1-CG2 4.18Å; I458-I514 HydrophobicContact CG1-CD1 4.23Å; I458-I514 HydrophobicContact CG1-CG2 4.15Å; I458-A531 HydrophobicContact CB-CB 4.41Å; I458-A531 HydrophobicContact CG1-CB 3.96Å; I458-A531 HydrophobicContact CG2-CB 4.4Å; I458-E533 HydrophobicContact CG2-CB 3.88Å
459	K	93.8	Very high	80.8	Confident	67 Å²	67	95.9 Å²	95.9	29%	0.291	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118	-180	-62.4	-172.9	173.8	81.5	0	110.6	T457 V462 F467 D530 A531 F532 E533	T457-K459 PolarHBondContact O-N 2.98Å; K459-V462 HydrophobicContact CB-CG2 3.79Å; K459-V462 HydrophobicContact CD-CG2 4.28Å; K459-F467 HydrophobicContact CD-CE2 4.35Å; K459-F467 HydrophobicContact CD-CZ 4.32Å; K459-D530 IonicContact NZ-OD1 2.68Å; K459-D530 PolarHBondContact NZ-OD1 2.69Å; K459-D530 IonicContact NZ-OD2 3.45Å; K459-D530 PolarHBondContact NZ-OD2 3.42Å; K459-A531 PolarHBondContact N-O 3.35Å; K459-F532 HydrophobicContact CB-CD1 3.89Å; K459-F532 HydrophobicContact CB-CE1 4.16Å; K459-F532 HydrophobicContact CD-CD1 4.24Å; K459-F532 HydrophobicContact CD-CE1 3.64Å; K459-F532 HydrophobicContact CD-CZ 4Å; K459-F532 HydrophobicContact CG-CE1 4.44Å; K459-F532 WeakPolarHBondContact O-CA 3.48Å; K459-E533 PolarHBondContact O-N 3.37Å
460	T	87.6	Confident	82.8	Confident	84 Å²	84	90.6 Å²	90.6	52%	0.515	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	160.6	171	59.4	0	0	0	0	111.2	I458 V462 E533	I458-T460 PolarHBondContact O-N 3.24Å; T460-V462 PolarHBondContact O-N 3.37Å; T460-E533 HydrophobicContact CG2-CB 4.41Å
461	D	80.9	Confident	84.4	Confident	163 Å²	163	85.6 Å²	85.6	87%	0.872	42%	0.421	S	S	*	.	S	Bend	trans	61	-10.3	173.6	-60.1	-60.7	0	0	0	117.9
462	V	88.5	Confident	85.1	Confident	52 Å²	52	86.8 Å²	86.8	32%	0.315	42%	0.421	S	S	.	.	S	Bend	trans	-107.3	152.3	171.3	-62.5	0	0	0	0	111.7	K459 T460 F467 F532	K459-V462 HydrophobicContact CB-CG2 3.79Å; K459-V462 HydrophobicContact CD-CG2 4.28Å; T460-V462 PolarHBondContact O-N 3.37Å; V462-F467 HydrophobicContact CB-CE2 4.14Å; V462-F467 HydrophobicContact CG2-CE2 3.87Å; V462-F467 HydrophobicContact CG2-CZ 4.47Å; V462-F532 HydrophobicContact CG2-CD1 4.28Å; V462-F532 HydrophobicContact CG2-CE1 4.27Å
463	K	87.9	Confident	85.7	Confident	149 Å²	149	87 Å²	87	65%	0.648	42%	0.415	S	S	*	.			trans	-98.4	143.2	-178.9	-61.6	174.6	-177.5	172.6	0	111.6	K465 E466	K463-K465 PolarHBondContact O-N 2.78Å; K463-E466 HydrophobicContact CB-CG 4.43Å; K463-E466 WeakPolarHBondContact CB-OE1 3.4Å; K463-E466 PolarHBondContact N-OE1 2.91Å; K463-E466 VanDerWaalsContact O-CB 3.31Å; K463-E466 WeakPolarHBondContact O-CB 3.11Å; K463-E466 PolarHBondContact O-N 3.3Å
464	V	92	Very high	85.7	Confident	10 Å²	10	83.3 Å²	83.3	6%	0.061	40%	0.401	C	S	.	.	H	α-helix	trans	-50	-35.9	170.9	65.1	0	0	0	0	112.8	E466 F467 Y468 L485 F498 F532 V539	V464-E466 PolarHBondContact O-N 2.73Å; V464-E466 VanDerWaalsContact O-N 3.1Å; V464-F467 PolarHBondContact O-N 3.33Å; V464-F467 VanDerWaalsContact O-N 3.13Å; V464-Y468 HydrophobicContact CG2-CD2 3.76Å; V464-Y468 HydrophobicContact CG2-CG 4.31Å; V464-Y468 PolarHBondContact O-N 2.95Å; V464-L485 HydrophobicContact CG2-CD1 4.09Å; V464-F498 HydrophobicContact CG1-CE1 3.79Å; V464-F498 HydrophobicContact CG1-CZ 3.85Å; V464-F532 HydrophobicContact CB-CD1 4.32Å; V464-F532 HydrophobicContact CB-CD2 3.78Å; V464-F532 HydrophobicContact CB-CE1 4.48Å; V464-F532 HydrophobicContact CB-CE2 3.98Å; V464-F532 HydrophobicContact CB-CG 3.98Å; V464-F532 HydrophobicContact CB-CZ 4.33Å; V464-F532 HydrophobicContact CG2-CD2 3.9Å; V464-F532 HydrophobicContact CG2-CE2 3.77Å; V464-F532 HydrophobicContact CG2-CZ 4.35Å; V464-V539 HydrophobicContact CG1-CG2 4.32Å; V464-V539 HydrophobicContact CG2-CG1 4.33Å
465	K	91.5	Very high	84.9	Confident	137 Å²	137	75.2 Å²	75.2	60%	0.596	37%	0.373	S	S	*	.	H	α-helix	trans	-64.9	-7.6	176.4	-68.5	-155.3	173.2	-161	0	115.3	K463 Y468 V470 K488	K463-K465 PolarHBondContact O-N 2.78Å; K465-Y468 WeakPolarHBondContact CA-O 3.47Å; K465-V470 HydrophobicContact CD-CG2 4.32Å; K465-V470 HydrophobicContact CG-CG2 3.77Å; K465-K488 PolarHBondContact O-NZ 3.27Å
466	E	93.3	Very high	83.6	Confident	104 Å²	104	71.8 Å²	71.8	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-81.4	-40	172.7	-67.6	164.3	-125.9	0	0	110.4	K463 V464 K488	K463-E466 HydrophobicContact CB-CG 4.43Å; K463-E466 WeakPolarHBondContact CB-OE1 3.4Å; K463-E466 PolarHBondContact N-OE1 2.91Å; K463-E466 VanDerWaalsContact O-CB 3.31Å; K463-E466 WeakPolarHBondContact O-CB 3.11Å; K463-E466 PolarHBondContact O-N 3.3Å; V464-E466 PolarHBondContact O-N 2.73Å; V464-E466 VanDerWaalsContact O-N 3.1Å; E466-K488 WeakPolarHBondContact O-CD 3.31Å; E466-K488 PolarHBondContact O-NZ 2.76Å
467	F	94.3	Very high	81.9	Confident	80 Å²	80	72.4 Å²	72.4	35%	0.351	37%	0.365	S	S	.	.	H	α-helix	trans	-94.9	-33.4	-176.3	-60.3	-95.4	0	0	0	113.7	K459 V462 V464 K488 F532	K459-F467 HydrophobicContact CD-CE2 4.35Å; K459-F467 HydrophobicContact CD-CZ 4.32Å; V462-F467 HydrophobicContact CB-CE2 4.14Å; V462-F467 HydrophobicContact CG2-CE2 3.87Å; V462-F467 HydrophobicContact CG2-CZ 4.47Å; V464-F467 PolarHBondContact O-N 3.33Å; V464-F467 VanDerWaalsContact O-N 3.13Å; F467-K488 WeakPolarHBondContact O-CB 3.49Å; F467-K488 WeakPolarHBondContact O-CG 3.11Å; F467-K488 PolarHBondContact O-N 3.12Å; F467-F532 HydrophobicContact CB-CZ 4.24Å; F467-F532 AromaticContact CD2-CE1 3.54Å; F467-F532 HydrophobicContact CD2-CE1 3.54Å; F467-F532 AromaticContact CD2-CZ 3.78Å; F467-F532 HydrophobicContact CD2-CZ 3.78Å; F467-F532 AromaticContact CE2-CE1 3.9Å; F467-F532 HydrophobicContact CE2-CE1 3.9Å; F467-F532 HydrophobicContact CE2-CZ 4.48Å; F467-F532 HydrophobicContact CG-CE1 4.35Å; F467-F532 HydrophobicContact CG-CZ 4.15Å
468	Y	94.9	Very high	80.1	Confident	13 Å²	13	72 Å²	72	5%	0.051	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.6	-176.5	-60.1	-93.4	0	0	0	111.1	V464 K465 L485 V486 E487 W494 D530 F532 V541	V464-Y468 HydrophobicContact CG2-CD2 3.76Å; V464-Y468 HydrophobicContact CG2-CG 4.31Å; V464-Y468 PolarHBondContact O-N 2.95Å; K465-Y468 WeakPolarHBondContact CA-O 3.47Å; Y468-L485 HydrophobicContact CD1-CB 4.01Å; Y468-L485 HydrophobicContact CD1-CD1 4.4Å; Y468-L485 HydrophobicContact CG-CB 4.37Å; Y468-L485 HydrophobicContact CG-CD1 4.26Å; Y468-V486 CarbonylContact C-O 3.51Å; Y468-V486 WeakPolarHBondContact CA-O 3.42Å; Y468-E487 HydrophobicContact CD1-CB 3.84Å; Y468-E487 HydrophobicContact CD1-CG 4.19Å; Y468-E487 HydrophobicContact CE1-CB 3.64Å; Y468-E487 HydrophobicContact CE1-CG 3.73Å; Y468-W494 AromaticContact CE1-CD1 3.59Å; Y468-W494 HydrophobicContact CE1-CG 4.28Å; Y468-D530 HydrophobicContact CE2-CB 4.39Å; Y468-F532 HydrophobicContact CD2-CE2 4.16Å; Y468-F532 HydrophobicContact CD2-CZ 4.21Å; Y468-F532 AromaticContact CE2-CE2 3.84Å; Y468-F532 HydrophobicContact CE2-CE2 3.84Å; Y468-F532 AromaticContact CE2-CZ 3.94Å; Y468-F532 HydrophobicContact CE2-CZ 3.94Å; Y468-V541 HydrophobicContact CE1-CG1 4.02Å; Y468-V541 HydrophobicContact CE2-CG2 4.11Å
469	D	88.6	Confident	78.3	Confident	59 Å²	59	71.6 Å²	71.6	32%	0.316	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	133.9	160.1	-62.4	-46.6	0	0	0	107.8	L485 V486 K488 K491	D469-L485 WeakPolarHBondContact O-CA 3.45Å; D469-V486 HydrophobicContact CB-CB 4.4Å; D469-V486 PolarHBondContact N-O 3.31Å; D469-V486 PolarHBondContact O-N 3.42Å; D469-K488 WeakPolarHBondContact OD1-CE 3.45Å; D469-K491 IonicContact OD2-NZ 3.48Å; D469-K491 PolarHBondContact OD2-NZ 2.59Å
470	V	89.6	Confident	76.7	Confident	38 Å²	38	69 Å²	69	23%	0.23	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.6	-178.6	-175.6	0	0	0	0	108	K465 F483 L485 F498	K465-V470 HydrophobicContact CD-CG2 4.32Å; K465-V470 HydrophobicContact CG-CG2 3.77Å; V470-F483 HydrophobicContact CG1-CB 3.93Å; V470-F483 HydrophobicContact CG1-CD1 4.01Å; V470-F483 HydrophobicContact CG1-CG 3.98Å; V470-L485 HydrophobicContact CB-CD2 4.06Å; V470-L485 HydrophobicContact CG1-CD2 4.02Å; V470-L485 HydrophobicContact CG2-CD2 3.63Å; V470-F498 HydrophobicContact CG1-CZ 4.37Å; V470-F498 HydrophobicContact CG2-CZ 4.33Å
471	E	86.8	Confident	76	Confident	86 Å²	86	68.5 Å²	68.5	40%	0.402	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-137.7	-171.8	-57.6	-169.4	155.4	0	0	111.6	K484 V486	E471-K484 HydrophobicContact CB-CB 4.3Å; E471-K484 HydrophobicContact CB-CD 4.48Å; E471-K484 PolarHBondContact N-O 3.4Å; E471-K484 VanDerWaalsContact OE2-CD 3.26Å; E471-K484 WeakPolarHBondContact OE2-CD 3.44Å; E471-K484 WeakPolarHBondContact OE2-CE 3.23Å; E471-K484 IonicContact OE2-NZ 2.6Å; E471-K484 PolarHBondContact OE2-NZ 2.88Å; E471-V486 VanDerWaalsContact CD-CG2 3.46Å; E471-V486 HydrophobicContact CG-CG2 4.2Å; E471-V486 WeakPolarHBondContact OE1-CG2 3.26Å
472	E	70.3	Confident	75.7	Confident	89 Å²	89	60.8 Å²	60.8	42%	0.416	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	149.4	-178.9	55.9	172.7	-153.2	0	0	113.7	L474 F483 K484 R757	E472-L474 HydrophobicContact CG-CD2 4.42Å; E472-L474 PolarHBondContact O-N 3Å; E472-F483 WeakPolarHBondContact O-CA 3.35Å; E472-K484 HydrophobicContact CG-CB 3.85Å; E472-K484 HydrophobicContact CG-CD 3.94Å; E472-K484 PolarHBondContact O-N 3.32Å; E472-R757 IonicContact OE1-CZ 3.52Å; E472-R757 IonicContact OE1-NH1 2.72Å; E472-R757 PolarHBondContact OE1-NH1 2.98Å; E472-R757 IonicContact OE2-NH1 2.67Å
473	R	74.7	Confident	75.3	Confident	148 Å²	148	60.3 Å²	60.3	56%	0.558	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.4	178.2	-171.1	-179.9	63.4	-170.5	-6.4	110.1	G475 T476 Q481 V482 F483	R473-G475 WeakPolarHBondContact CG-O 3.38Å; R473-T476 WeakPolarHBondContact CD-OG1 3.29Å; R473-T476 PolarHBondContact NE-OG1 3.11Å; R473-Q481 VanDerWaalsContact CD-OE1 3.25Å; R473-V482 CarbonylContact C-O 3.56Å; R473-V482 WeakPolarHBondContact CG-O 3.2Å; R473-F483 HydrophobicContact CB-CD1 3.77Å; R473-F483 HydrophobicContact CB-CE1 3.6Å; R473-F483 HydrophobicContact CB-CZ 4.27Å; R473-F483 HydrophobicContact CG-CD1 4.08Å; R473-F483 HydrophobicContact CG-CE1 3.79Å; R473-F483 HydrophobicContact CG-CE2 4.39Å; R473-F483 HydrophobicContact CG-CZ 3.95Å
474	L	67.1	Low	75.2	Confident	7 Å²	7	55.9 Å²	55.9	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-19.6	178.4	-57.8	174.4	0	0	0	112.7	E472 V482 K484 M544 I759 G760	E472-L474 HydrophobicContact CG-CD2 4.42Å; E472-L474 PolarHBondContact O-N 3Å; L474-V482 HydrophobicContact CB-CG1 4.2Å; L474-V482 PolarHBondContact N-O 2.66Å; L474-K484 HydrophobicContact CD1-CB 4.05Å; L474-K484 HydrophobicContact CD2-CB 4.38Å; L474-K484 HydrophobicContact CG-CB 4.19Å; L474-M544 HydrophobicContact CD1-CE 3.79Å; L474-M544 HydrophobicContact CD1-SD 4.2Å; L474-I759 HydrophobicContact CB-CB 4.48Å; L474-I759 HydrophobicContact CB-CG2 4.19Å; L474-I759 HydrophobicContact CD1-CB 4.46Å; L474-I759 HydrophobicContact CD1-CD1 4.35Å; L474-I759 HydrophobicContact CD1-CG2 3.78Å; L474-G760 WeakPolarHBondContact O-CA 3.17Å; L474-G760 PolarHBondContact O-N 3Å
475	G	56.5	Low	75	Confident	8 Å²	8	55.4 Å²	55.4	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	179.2	170.5	0	0	0	0	0	116.5	R473 V482	R473-G475 WeakPolarHBondContact CG-O 3.38Å; G475-V482 PolarHBondContact N-O 3.04Å; G475-V482 PolarHBondContact O-N 2.73Å
476	T	51.2	Low	74.9	Confident	51 Å²	51	49.4 Å²	49.4	31%	0.313	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	137.7	-179.5	-64.7	0	0	0	0	109	R473 Q481 S763	R473-T476 WeakPolarHBondContact CD-OG1 3.29Å; R473-T476 PolarHBondContact NE-OG1 3.11Å; T476-Q481 HydrophobicContact CG2-CG 4.01Å; T476-S763 VanDerWaalsContact CA-OG 3.31Å; T476-S763 WeakPolarHBondContact CA-OG 3.47Å; T476-S763 PolarHBondContact N-OG 2.92Å; T476-S763 PolarHBondContact O-OG 3.3Å
477	G	50.5	Low	74.9	Confident	23 Å²	23	46.1 Å²	46.1	24%	0.237	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	-177.5	-166.9	0	0	0	0	0	112.2	F479 G480 S763 S764	G477-F479 PolarHBondContact O-N 3Å; G477-F479 VanDerWaalsContact O-N 3.09Å; G477-G480 PolarHBondContact N-O 3.28Å; G477-G480 VanDerWaalsContact N-O 3.13Å; G477-G480 PolarHBondContact O-N 3.17Å; G477-S763 CarbonylContact C-O 3.57Å; G477-S763 VanDerWaalsContact C-O 3.27Å; G477-S763 WeakPolarHBondContact CA-OG 3.24Å; G477-S763 PolarHBondContact N-OG 2.84Å; G477-S764 WeakPolarHBondContact CA-OG 3.34Å
478	K	51	Low	74.9	Confident	103 Å²	103	46.4 Å²	46.4	45%	0.448	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-29	-165.7	-174.7	161.7	177.7	157.9	0	114.5	S764 D782 N783	K478-S764 PolarHBondContact N-OG 2.84Å; K478-S764 VanDerWaalsContact N-OG 3.14Å; K478-D782 PolarHBondContact NZ-O 2.89Å; K478-N783 WeakPolarHBondContact CE-OD1 3.2Å; K478-N783 PolarHBondContact NZ-OD1 2.91Å
479	F	52.6	Low	74.7	Confident	33 Å²	33	50.3 Å²	50.3	15%	0.145	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-5.3	-173.7	-52.5	-59.8	0	0	0	114.3	G477 I499 K500 S763 S764 A766 M768 A769	G477-F479 PolarHBondContact O-N 3Å; G477-F479 VanDerWaalsContact O-N 3.09Å; F479-I499 WeakPolarHBondContact O-CA 3.25Å; F479-K500 PolarHBondContact O-N 3.27Å; F479-S763 PolarHBondContact N-O 3.32Å; F479-S763 VanDerWaalsContact N-O 3.11Å; F479-S764 WeakPolarHBondContact CD2-O 3.49Å; F479-S764 WeakPolarHBondContact CE2-O 3.48Å; F479-A766 HydrophobicContact CB-CB 3.9Å; F479-A766 HydrophobicContact CD2-CB 3.96Å; F479-A766 HydrophobicContact CG-CB 4.02Å; F479-M768 HydrophobicContact CB-CB 4.38Å; F479-M768 HydrophobicContact CD1-CB 3.46Å; F479-M768 VanDerWaalsContact CD1-CB 3.46Å; F479-M768 HydrophobicContact CE1-CB 3.9Å; F479-M768 HydrophobicContact CG-CB 3.93Å; F479-A769 HydrophobicContact CE1-CB 4.26Å; F479-A769 HydrophobicContact CE2-CB 4.33Å; F479-A769 HydrophobicContact CZ-CB 3.59Å
480	G	60.4	Low	74.7	Confident	12 Å²	12	51.6 Å²	51.6	12%	0.124	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.1	-158.5	-174.4	0	0	0	0	0	116.4	G477 F498 S763	G477-G480 PolarHBondContact N-O 3.28Å; G477-G480 VanDerWaalsContact N-O 3.13Å; G477-G480 PolarHBondContact O-N 3.17Å; G480-F498 WeakPolarHBondContact CA-O 3.41Å; G480-S763 PolarHBondContact N-O 2.93Å; G480-S763 VanDerWaalsContact N-O 3.16Å
481	Q	73.1	Confident	74.7	Confident	73 Å²	73	55.7 Å²	55.7	34%	0.341	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.1	173.3	-64.2	-175	30.5	0	0	109.2	R473 T476 F483 F498	R473-Q481 VanDerWaalsContact CD-OE1 3.25Å; T476-Q481 HydrophobicContact CG2-CG 4.01Å; Q481-F483 HydrophobicContact CB-CD2 4.28Å; Q481-F483 HydrophobicContact CB-CE2 3.6Å; Q481-F483 HydrophobicContact CB-CZ 4.31Å; Q481-F498 PolarHBondContact N-O 2.95Å; Q481-F498 VanDerWaalsContact N-O 3.17Å; Q481-F498 WeakPolarHBondContact O-CB 3.38Å; Q481-F498 PolarHBondContact O-N 2.87Å
482	V	75.9	Confident	74.7	Confident	1 Å²	1	56 Å²	56	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.3	177.3	179.5	0	0	0	0	109	R473 L474 G475 G496 K497 I759 L762	R473-V482 CarbonylContact C-O 3.56Å; R473-V482 WeakPolarHBondContact CG-O 3.2Å; L474-V482 HydrophobicContact CB-CG1 4.2Å; L474-V482 PolarHBondContact N-O 2.66Å; G475-V482 PolarHBondContact N-O 3.04Å; G475-V482 PolarHBondContact O-N 2.73Å; V482-G496 CarbonylContact C-O 3.53Å; V482-G496 VanDerWaalsContact CA-O 3.27Å; V482-G496 WeakPolarHBondContact CA-O 3.4Å; V482-K497 HydrophobicContact CG2-CB 4.38Å; V482-K497 HydrophobicContact CG2-CG 4.45Å; V482-I759 HydrophobicContact CG1-CG2 3.94Å; V482-L762 HydrophobicContact CG2-CB 3.8Å
483	F	80.1	Confident	75.5	Confident	43 Å²	43	54.4 Å²	54.4	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	151.6	-178.8	-68.3	-95.8	0	0	0	110.9	V470 E472 R473 Q481 G496 F498	V470-F483 HydrophobicContact CG1-CB 3.93Å; V470-F483 HydrophobicContact CG1-CD1 4.01Å; V470-F483 HydrophobicContact CG1-CG 3.98Å; E472-F483 WeakPolarHBondContact O-CA 3.35Å; R473-F483 HydrophobicContact CB-CD1 3.77Å; R473-F483 HydrophobicContact CB-CE1 3.6Å; R473-F483 HydrophobicContact CB-CZ 4.27Å; R473-F483 HydrophobicContact CG-CD1 4.08Å; R473-F483 HydrophobicContact CG-CE1 3.79Å; R473-F483 HydrophobicContact CG-CE2 4.39Å; R473-F483 HydrophobicContact CG-CZ 3.95Å; Q481-F483 HydrophobicContact CB-CD2 4.28Å; Q481-F483 HydrophobicContact CB-CE2 3.6Å; Q481-F483 HydrophobicContact CB-CZ 4.31Å; F483-G496 PolarHBondContact N-O 3.41Å; F483-G496 PolarHBondContact O-N 3.24Å; F483-F498 HydrophobicContact CB-CE2 4.18Å; F483-F498 AromaticContact CD2-CD2 3.62Å; F483-F498 HydrophobicContact CD2-CD2 3.62Å; F483-F498 AromaticContact CD2-CE2 3.75Å; F483-F498 HydrophobicContact CD2-CE2 3.75Å; F483-F498 HydrophobicContact CD2-CG 4.39Å; F483-F498 HydrophobicContact CE2-CD2 4.27Å; F483-F498 HydrophobicContact CG-CE2 4.31Å
484	K	84.7	Confident	76.2	Confident	56 Å²	56	49 Å²	49	24%	0.243	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.4	163.2	-174.8	-176.9	174	-145.5	0	108.1	E471 E472 L474 V493 M544	E471-K484 HydrophobicContact CB-CB 4.3Å; E471-K484 HydrophobicContact CB-CD 4.48Å; E471-K484 PolarHBondContact N-O 3.4Å; E471-K484 VanDerWaalsContact OE2-CD 3.26Å; E471-K484 WeakPolarHBondContact OE2-CD 3.44Å; E471-K484 WeakPolarHBondContact OE2-CE 3.23Å; E471-K484 IonicContact OE2-NZ 2.6Å; E471-K484 PolarHBondContact OE2-NZ 2.88Å; E472-K484 HydrophobicContact CG-CB 3.85Å; E472-K484 HydrophobicContact CG-CD 3.94Å; E472-K484 PolarHBondContact O-N 3.32Å; L474-K484 HydrophobicContact CD1-CB 4.05Å; L474-K484 HydrophobicContact CD2-CB 4.38Å; L474-K484 HydrophobicContact CG-CB 4.19Å; K484-V493 HydrophobicContact CD-CG1 4.33Å; K484-V493 HydrophobicContact CG-CG1 3.84Å; K484-M544 HydrophobicContact CG-CE 4.25Å
485	L	87.9	Confident	77.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140	174	-62.9	-173.6	0	0	0	109.2	V464 Y468 D469 V470 V493 W494 G496 F498 V541	V464-L485 HydrophobicContact CG2-CD1 4.09Å; Y468-L485 HydrophobicContact CD1-CB 4.01Å; Y468-L485 HydrophobicContact CD1-CD1 4.4Å; Y468-L485 HydrophobicContact CG-CB 4.37Å; Y468-L485 HydrophobicContact CG-CD1 4.26Å; D469-L485 WeakPolarHBondContact O-CA 3.45Å; V470-L485 HydrophobicContact CB-CD2 4.06Å; V470-L485 HydrophobicContact CG1-CD2 4.02Å; V470-L485 HydrophobicContact CG2-CD2 3.63Å; L485-V493 CarbonylContact O-C 3.52Å; L485-V493 WeakPolarHBondContact O-CA 3.44Å; L485-W494 HydrophobicContact CB-CB 4.27Å; L485-W494 PolarHBondContact N-O 3.1Å; L485-W494 PolarHBondContact O-N 2.9Å; L485-G496 VanDerWaalsContact CD1-CA 3.46Å; L485-F498 HydrophobicContact CD2-CE2 4.33Å; L485-F498 HydrophobicContact CD2-CZ 4.46Å; L485-V541 HydrophobicContact CD1-CB 4.49Å; L485-V541 HydrophobicContact CD1-CG1 4.14Å; L485-V541 HydrophobicContact CD1-CG2 3.79Å
486	V	90.3	Very high	78.8	Confident	11 Å²	11	48.3 Å²	48.3	7%	0.067	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.7	171.2	179.4	0	0	0	0	108.2	Y468 D469 E471 K488 K491 V493	Y468-V486 CarbonylContact C-O 3.51Å; Y468-V486 WeakPolarHBondContact CA-O 3.42Å; D469-V486 HydrophobicContact CB-CB 4.4Å; D469-V486 PolarHBondContact N-O 3.31Å; D469-V486 PolarHBondContact O-N 3.42Å; E471-V486 VanDerWaalsContact CD-CG2 3.46Å; E471-V486 HydrophobicContact CG-CG2 4.2Å; E471-V486 WeakPolarHBondContact OE1-CG2 3.26Å; V486-K488 PolarHBondContact O-N 2.78Å; V486-K491 HydrophobicContact CG1-CB 4.44Å; V486-K491 HydrophobicContact CG1-CD 3.73Å; V486-V493 HydrophobicContact CG2-CG2 4.39Å
487	E	92.7	Very high	80.5	Confident	34 Å²	34	46.1 Å²	46.1	16%	0.159	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	126.3	-178.9	-167.9	-160.8	146.9	0	0	110.2	Y468 S489 T490 K491 K492 W494	Y468-E487 HydrophobicContact CD1-CB 3.84Å; Y468-E487 HydrophobicContact CD1-CG 4.19Å; Y468-E487 HydrophobicContact CE1-CB 3.64Å; Y468-E487 HydrophobicContact CE1-CG 3.73Å; E487-S489 VanDerWaalsContact C-N 3.3Å; E487-S489 PolarHBondContact O-N 3.03Å; E487-S489 WeakPolarHBondContact OE1-CB 3Å; E487-S489 PolarHBondContact OE1-OG 3.16Å; E487-T490 WeakPolarHBondContact CB-OG1 3.49Å; E487-T490 WeakPolarHBondContact OE1-CG2 3.35Å; E487-T490 PolarHBondContact OE2-OG1 2.73Å; E487-K491 WeakPolarHBondContact O-CA 3.37Å; E487-K491 PolarHBondContact O-N 2.88Å; E487-K492 PolarHBondContact N-O 2.95Å; E487-W494 PolarHBondContact OE2-NE1 3.4Å
488	K	93.1	Very high	82.1	Confident	86 Å²	86	46.9 Å²	46.9	37%	0.374	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.8	-172.7	-68.3	174.5	-171.8	172.4	0	113.9	K465 E466 F467 D469 V486	K465-K488 PolarHBondContact O-NZ 3.27Å; E466-K488 WeakPolarHBondContact O-CD 3.31Å; E466-K488 PolarHBondContact O-NZ 2.76Å; F467-K488 WeakPolarHBondContact O-CB 3.49Å; F467-K488 WeakPolarHBondContact O-CG 3.11Å; F467-K488 PolarHBondContact O-N 3.12Å; D469-K488 WeakPolarHBondContact OD1-CE 3.45Å; V486-K488 PolarHBondContact O-N 2.78Å
489	S	91.7	Very high	83.5	Confident	96 Å²	96	42.1 Å²	42.1	67%	0.671	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-42.4	-178	10.5	0	0	0	0	113.1	E487	E487-S489 VanDerWaalsContact C-N 3.3Å; E487-S489 PolarHBondContact O-N 3.03Å; E487-S489 WeakPolarHBondContact OE1-CB 3Å; E487-S489 PolarHBondContact OE1-OG 3.16Å
490	T	89.4	Confident	84.6	Confident	86 Å²	86	44.6 Å²	44.6	53%	0.528	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-19.5	-171.4	59.9	0	0	0	0	113.3	E487 K492	E487-T490 WeakPolarHBondContact CB-OG1 3.49Å; E487-T490 WeakPolarHBondContact OE1-CG2 3.35Å; E487-T490 PolarHBondContact OE2-OG1 2.73Å; T490-K492 PolarHBondContact O-N 3.47Å; T490-K492 WeakPolarHBondContact OG1-CB 3.38Å; T490-K492 PolarHBondContact OG1-N 3.24Å; T490-K492 VanDerWaalsContact OG1-N 3.11Å
491	K	89.6	Confident	85.1	Confident	123 Å²	123	44 Å²	44	54%	0.535	22%	0.217	S	C	.	.			trans	59.6	14.4	-164.3	-63.1	-60	-175.2	175.5	0	115.5	D469 V486 E487	D469-K491 IonicContact OD2-NZ 3.48Å; D469-K491 PolarHBondContact OD2-NZ 2.59Å; V486-K491 HydrophobicContact CG1-CB 4.44Å; V486-K491 HydrophobicContact CG1-CD 3.73Å; E487-K491 WeakPolarHBondContact O-CA 3.37Å; E487-K491 PolarHBondContact O-N 2.88Å
492	K	86.4	Confident	85.1	Confident	94 Å²	94	48.3 Å²	48.3	41%	0.409	23%	0.231	S	C	.	.			trans	-66.7	143.5	170.3	-176.3	157.6	177.5	143.5	0	111.9	E487 T490 W494	E487-K492 PolarHBondContact N-O 2.95Å; T490-K492 PolarHBondContact O-N 3.47Å; T490-K492 WeakPolarHBondContact OG1-CB 3.38Å; T490-K492 PolarHBondContact OG1-N 3.24Å; T490-K492 VanDerWaalsContact OG1-N 3.11Å; K492-W494 HydrophobicContact CB-CZ2 4.49Å; K492-W494 HydrophobicContact CD-CH2 4Å; K492-W494 HydrophobicContact CD-CZ2 3.58Å; K492-W494 HydrophobicContact CG-CD2 4.41Å; K492-W494 HydrophobicContact CG-CZ2 3.9Å; K492-W494 VanDerWaalsContact O-CD1 3.3Å
493	V	85.6	Confident	84.8	Confident	54 Å²	54	50.4 Å²	50.4	33%	0.327	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.8	-178.7	-174.1	0	0	0	0	111	K484 L485 V486 M544	K484-V493 HydrophobicContact CD-CG1 4.33Å; K484-V493 HydrophobicContact CG-CG1 3.84Å; L485-V493 CarbonylContact O-C 3.52Å; L485-V493 WeakPolarHBondContact O-CA 3.44Å; V486-V493 HydrophobicContact CG2-CG2 4.39Å; V493-M544 HydrophobicContact CG1-CE 3.69Å
494	W	90.8	Very high	84.4	Confident	34 Å²	34	52.3 Å²	52.3	13%	0.129	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	159.4	-174.7	-57.5	103.4	0	0	0	111.7	Y468 L485 E487 K492 V529 V541 M544	Y468-W494 AromaticContact CE1-CD1 3.59Å; Y468-W494 HydrophobicContact CE1-CG 4.28Å; L485-W494 HydrophobicContact CB-CB 4.27Å; L485-W494 PolarHBondContact N-O 3.1Å; L485-W494 PolarHBondContact O-N 2.9Å; E487-W494 PolarHBondContact OE2-NE1 3.4Å; K492-W494 HydrophobicContact CB-CZ2 4.49Å; K492-W494 HydrophobicContact CD-CH2 4Å; K492-W494 HydrophobicContact CD-CZ2 3.58Å; K492-W494 HydrophobicContact CG-CD2 4.41Å; K492-W494 HydrophobicContact CG-CZ2 3.9Å; K492-W494 VanDerWaalsContact O-CD1 3.3Å; W494-V529 HydrophobicContact CD2-CG2 3.94Å; W494-V529 HydrophobicContact CE3-CG1 4.42Å; W494-V529 HydrophobicContact CE3-CG2 3.62Å; W494-V529 HydrophobicContact CH2-CB 4.25Å; W494-V529 HydrophobicContact CH2-CG1 3.93Å; W494-V529 HydrophobicContact CH2-CG2 3.99Å; W494-V529 HydrophobicContact CZ2-CG2 4.29Å; W494-V529 HydrophobicContact CZ3-CB 4.17Å; W494-V529 HydrophobicContact CZ3-CG1 3.67Å; W494-V529 HydrophobicContact CZ3-CG2 3.66Å; W494-V541 HydrophobicContact CB-CG1 3.61Å; W494-V541 HydrophobicContact CG-CG1 4.01Å; W494-M544 VanDerWaalsContact C-CE 3.46Å; W494-M544 VanDerWaalsContact O-CE 3.22Å; W494-M544 WeakPolarHBondContact O-CE 3.05Å
495	A	87.6	Confident	83.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.4	176.8	0	0	0	0	0	111	L542 M544 I759	A495-L542 HydrophobicContact CB-CB 4.34Å; A495-L542 PolarHBondContact N-O 2.9Å; A495-L542 PolarHBondContact O-N 2.98Å; A495-M544 HydrophobicContact CB-CE 4.17Å; A495-M544 HydrophobicContact CB-SD 4.14Å; A495-I759 HydrophobicContact CB-CG2 4.17Å
496	G	89.4	Confident	82.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	108	178.1	0	0	0	0	0	112.2	V482 F483 L485 F498	V482-G496 CarbonylContact C-O 3.53Å; V482-G496 VanDerWaalsContact CA-O 3.27Å; V482-G496 WeakPolarHBondContact CA-O 3.4Å; F483-G496 PolarHBondContact N-O 3.41Å; F483-G496 PolarHBondContact O-N 3.24Å; L485-G496 VanDerWaalsContact CD1-CA 3.46Å; G496-F498 WeakPolarHBondContact O-CD2 3.43Å
497	K	86.7	Confident	82	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	100.6	175.7	-178.6	-172.3	179.8	-176.9	0	109.3	V482 I499 E513 V539 M540 L542 L762 M765	V482-K497 HydrophobicContact CG2-CB 4.38Å; V482-K497 HydrophobicContact CG2-CG 4.45Å; K497-I499 HydrophobicContact CD-CD1 4.09Å; K497-I499 HydrophobicContact CD-CG1 4.29Å; K497-I499 HydrophobicContact CG-CD1 4.29Å; K497-I499 HydrophobicContact CG-CG1 3.94Å; K497-I499 PolarHBondContact O-N 3.27Å; K497-E513 IonicContact NZ-OE1 3.6Å; K497-E513 PolarHBondContact NZ-OE1 2.72Å; K497-V539 WeakPolarHBondContact O-CA 3.47Å; K497-M540 HydrophobicContact CB-CB 4.31Å; K497-M540 HydrophobicContact CD-SD 4.25Å; K497-M540 PolarHBondContact N-O 3.32Å; K497-M540 PolarHBondContact O-N 3.05Å; K497-L542 HydrophobicContact CB-CD1 4.26Å; K497-L542 HydrophobicContact CD-CD1 4.13Å; K497-L762 WeakPolarHBondContact CE-O 3.4Å; K497-M765 WeakPolarHBondContact CE-O 3.33Å; K497-M765 PolarHBondContact NZ-O 2.99Å
498	F	84.9	Confident	81.4	Confident	39 Å²	39	58.7 Å²	58.7	17%	0.171	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	94	-179.4	-69.8	-110.8	0	0	0	110.1	V464 V470 G480 Q481 F483 L485 G496 V539	V464-F498 HydrophobicContact CG1-CE1 3.79Å; V464-F498 HydrophobicContact CG1-CZ 3.85Å; V470-F498 HydrophobicContact CG1-CZ 4.37Å; V470-F498 HydrophobicContact CG2-CZ 4.33Å; G480-F498 WeakPolarHBondContact CA-O 3.41Å; Q481-F498 PolarHBondContact N-O 2.95Å; Q481-F498 VanDerWaalsContact N-O 3.17Å; Q481-F498 WeakPolarHBondContact O-CB 3.38Å; Q481-F498 PolarHBondContact O-N 2.87Å; F483-F498 HydrophobicContact CB-CE2 4.18Å; F483-F498 AromaticContact CD2-CD2 3.62Å; F483-F498 HydrophobicContact CD2-CD2 3.62Å; F483-F498 AromaticContact CD2-CE2 3.75Å; F483-F498 HydrophobicContact CD2-CE2 3.75Å; F483-F498 HydrophobicContact CD2-CG 4.39Å; F483-F498 HydrophobicContact CE2-CD2 4.27Å; F483-F498 HydrophobicContact CG-CE2 4.31Å; L485-F498 HydrophobicContact CD2-CE2 4.33Å; L485-F498 HydrophobicContact CD2-CZ 4.46Å; G496-F498 WeakPolarHBondContact O-CD2 3.43Å; F498-V539 HydrophobicContact CD1-CB 4.38Å; F498-V539 HydrophobicContact CD1-CG1 4.07Å; F498-V539 HydrophobicContact CD1-CG2 3.4Å; F498-V539 VanDerWaalsContact CD1-CG2 3.4Å; F498-V539 HydrophobicContact CD2-CG1 3.92Å; F498-V539 HydrophobicContact CE1-CG1 4.02Å; F498-V539 HydrophobicContact CE1-CG2 3.64Å; F498-V539 HydrophobicContact CE2-CG1 3.86Å; F498-V539 HydrophobicContact CG-CG1 4.01Å; F498-V539 HydrophobicContact CG-CG2 3.98Å; F498-V539 HydrophobicContact CZ-CG1 3.91Å; F498-V539 HydrophobicContact CZ-CG2 4.37Å
499	I	80.3	Confident	80.6	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.7	-178.5	-52.4	172.9	0	0	0	109.5	F479 K497 V510 D537 I538 M540 A766 M768	F479-I499 WeakPolarHBondContact O-CA 3.25Å; K497-I499 HydrophobicContact CD-CD1 4.09Å; K497-I499 HydrophobicContact CD-CG1 4.29Å; K497-I499 HydrophobicContact CG-CD1 4.29Å; K497-I499 HydrophobicContact CG-CG1 3.94Å; K497-I499 PolarHBondContact O-N 3.27Å; I499-V510 HydrophobicContact CD1-CG1 3.82Å; I499-V510 HydrophobicContact CD1-CG2 4.22Å; I499-V510 HydrophobicContact CG2-CG2 4.04Å; I499-D537 CarbonylContact O-C 3.58Å; I499-D537 WeakPolarHBondContact O-CA 3.32Å; I499-D537 WeakPolarHBondContact O-CB 3.26Å; I499-I538 PolarHBondContact N-O 3.31Å; I499-I538 PolarHBondContact O-N 2.75Å; I499-M540 HydrophobicContact CD1-CG 4.46Å; I499-M540 HydrophobicContact CD1-SD 3.57Å; I499-M540 VanDerWaalsContact CD1-SD 3.57Å; I499-A766 HydrophobicContact CD1-CB 4.46Å; I499-A766 HydrophobicContact CG2-CB 4.36Å; I499-M768 HydrophobicContact CG2-CG 4.07Å
500	K	75.6	Confident	80.2	Confident	85 Å²	85	51 Å²	51	37%	0.37	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.7	171.7	-67.6	-58.5	-178.2	-179.2	0	111.2	F479 Y502 D537 M768	F479-K500 PolarHBondContact O-N 3.27Å; K500-Y502 HydrophobicContact CB-CE2 3.85Å; K500-D537 HydrophobicContact CD-CB 4.31Å; K500-D537 IonicContact NZ-OD2 3.55Å; K500-D537 PolarHBondContact NZ-OD2 2.79Å; K500-M768 WeakPolarHBondContact O-CE 3.47Å
501	A	70.6	Confident	80	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.			trans	-144.9	99.6	-174.9	0	0	0	0	0	109	D506 K507 S536	A501-D506 HydrophobicContact CB-CB 3.71Å; A501-K507 HydrophobicContact CB-CG 3.69Å; A501-S536 PolarHBondContact N-O 3.46Å; A501-S536 CarbonylContact O-C 3.6Å; A501-S536 WeakPolarHBondContact O-CA 3.24Å
502	Y	73.1	Confident	79.8	Confident	163 Å²	163	48.9 Å²	48.9	64%	0.639	24%	0.236	S	C	*	.			trans	-98.3	-35.9	-171.3	-59.7	-76.7	0	0	0	112.2	K500 D506	K500-Y502 HydrophobicContact CB-CE2 3.85Å; Y502-D506 PolarHBondContact N-OD2 3.12Å
503	S	71.1	Confident	79.8	Confident	46 Å²	46	44.5 Å²	44.5	32%	0.322	22%	0.217	S	C	.	.	S	Bend	trans	-89.2	162	176.5	101.4	0	0	0	0	112	K505 D506 K507	S503-K505 PolarHBondContact O-N 2.84Å; S503-K505 PolarHBondContact OG-N 2.71Å; S503-K505 VanDerWaalsContact OG-N 3.08Å; S503-D506 VanDerWaalsContact CB-OD1 3.25Å; S503-D506 WeakPolarHBondContact CB-OD1 3.45Å; S503-D506 VanDerWaalsContact N-CG 3.35Å; S503-D506 PolarHBondContact N-OD2 2.99Å; S503-D506 WeakPolarHBondContact O-CB 3.34Å; S503-D506 PolarHBondContact O-N 2.71Å; S503-D506 PolarHBondContact OG-N 2.71Å; S503-D506 VanDerWaalsContact OG-N 3.12Å; S503-D506 PolarHBondContact OG-OD1 2.86Å; S503-K507 PolarHBondContact O-N 2.85Å
504	A	71.7	Confident	80	Confident	83 Å²	83	42 Å²	42	69%	0.686	20%	0.202	S	C	*	.	H	α-helix	trans	-64.9	-30	173.2	0	0	0	0	0	112.5	E508	A504-E508 WeakPolarHBondContact O-CB 3.18Å; A504-E508 PolarHBondContact O-N 2.92Å; A504-E508 VanDerWaalsContact O-N 3.1Å
505	K	67.4	Low	80	Confident	114 Å²	114	42.1 Å²	42.1	50%	0.496	21%	0.214	S	C	.	.	H	α-helix	trans	-72.4	-39.7	177.5	-171.2	171.5	-177.1	172.2	0	111.2	S503 K507 E508 N509 V771	S503-K505 PolarHBondContact O-N 2.84Å; S503-K505 PolarHBondContact OG-N 2.71Å; S503-K505 VanDerWaalsContact OG-N 3.08Å; K505-K507 VanDerWaalsContact C-N 3.3Å; K505-K507 PolarHBondContact O-N 2.72Å; K505-E508 PolarHBondContact O-N 2.7Å; K505-N509 PolarHBondContact O-N 2.91Å; K505-N509 PolarHBondContact O-OD1 3Å; K505-V771 HydrophobicContact CD-CG2 4.49Å; K505-V771 HydrophobicContact CG-CG2 4.4Å
506	D	67.6	Low	80.1	Confident	13 Å²	13	42.9 Å²	42.9	7%	0.07	22%	0.218	C	C	.	.	H	α-helix	trans	-54.1	-50.2	175	-55	7.1	0	0	0	110.3	A501 Y502 S503 V510 M768 V771	A501-D506 HydrophobicContact CB-CB 3.71Å; Y502-D506 PolarHBondContact N-OD2 3.12Å; S503-D506 VanDerWaalsContact CB-OD1 3.25Å; S503-D506 WeakPolarHBondContact CB-OD1 3.45Å; S503-D506 VanDerWaalsContact N-CG 3.35Å; S503-D506 PolarHBondContact N-OD2 2.99Å; S503-D506 WeakPolarHBondContact O-CB 3.34Å; S503-D506 PolarHBondContact O-N 2.71Å; S503-D506 PolarHBondContact OG-N 2.71Å; S503-D506 VanDerWaalsContact OG-N 3.12Å; S503-D506 PolarHBondContact OG-OD1 2.86Å; D506-V510 WeakPolarHBondContact O-CG2 3.35Å; D506-V510 PolarHBondContact O-N 2.88Å; D506-M768 HydrophobicContact CB-CE 3.71Å; D506-M768 HydrophobicContact CB-SD 3.55Å; D506-M768 VanDerWaalsContact CB-SD 3.55Å; D506-V771 WeakPolarHBondContact OD1-CG1 3.31Å
507	K	77.1	Confident	80.3	Confident	25 Å²	25	43.3 Å²	43.3	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-41.9	-179.5	-63.9	-161.6	-170.7	-171.6	0	111.9	A501 S503 K505 N509 V510 R511 E533 G534 K535 I538	A501-K507 HydrophobicContact CB-CG 3.69Å; S503-K507 PolarHBondContact O-N 2.85Å; K505-K507 VanDerWaalsContact C-N 3.3Å; K505-K507 PolarHBondContact O-N 2.72Å; K507-N509 PolarHBondContact O-N 3.4Å; K507-V510 PolarHBondContact O-N 3Å; K507-R511 WeakPolarHBondContact O-CG 3.1Å; K507-R511 PolarHBondContact O-N 2.87Å; K507-E533 HydrophobicContact CD-CG 4.06Å; K507-E533 WeakPolarHBondContact CD-OE1 3.36Å; K507-E533 IonicContact NZ-OE1 2.64Å; K507-E533 PolarHBondContact NZ-OE1 2.67Å; K507-G534 PolarHBondContact NZ-O 3Å; K507-K535 PolarHBondContact NZ-O 2.9Å; K507-I538 HydrophobicContact CB-CD1 3.87Å; K507-I538 HydrophobicContact CD-CD1 4.39Å; K507-I538 HydrophobicContact CG-CD1 3.99Å
508	E	79.9	Confident	80.4	Confident	82 Å²	82	44.6 Å²	44.6	38%	0.383	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-40.7	-179.8	-170.5	53.8	-151.9	0	0	112.3	A504 K505 V510 R511 Q512	A504-E508 WeakPolarHBondContact O-CB 3.18Å; A504-E508 PolarHBondContact O-N 2.92Å; A504-E508 VanDerWaalsContact O-N 3.1Å; K505-E508 PolarHBondContact O-N 2.7Å; E508-V510 PolarHBondContact O-N 2.88Å; E508-R511 PolarHBondContact O-N 2.86Å; E508-R511 IonicContact OE2-CZ 2.84Å; E508-R511 IonicContact OE2-NH1 3.79Å; E508-R511 PolarHBondContact OE2-NH1 3.06Å; E508-Q512 WeakPolarHBondContact O-CG 3.26Å; E508-Q512 PolarHBondContact O-N 3.48Å; E508-Q512 PolarHBondContact OE1-NE2 2.6Å
509	N	76.4	Confident	80.7	Confident	20 Å²	20	43.9 Å²	43.9	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-55.8	-49.3	170.4	-74.9	20.3	0	0	0	111.5	K505 K507 R511 Q512 E513 M767	K505-N509 PolarHBondContact O-N 2.91Å; K505-N509 PolarHBondContact O-OD1 3Å; K507-N509 PolarHBondContact O-N 3.4Å; N509-R511 VanDerWaalsContact C-N 3.34Å; N509-R511 PolarHBondContact O-N 2.89Å; N509-Q512 WeakPolarHBondContact O-CB 3.46Å; N509-Q512 PolarHBondContact O-N 3.3Å; N509-Q512 VanDerWaalsContact O-N 3.11Å; N509-E513 PolarHBondContact O-N 3.12Å; N509-M767 HydrophobicContact CB-CB 4.03Å; N509-M767 HydrophobicContact CB-CG 3.83Å; N509-M767 HydrophobicContact CB-SD 3.8Å; N509-M767 PolarHBondContact ND2-O 3.16Å
510	V	82.6	Confident	81.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-32.1	179.5	178.1	0	0	0	0	112.3	I499 D506 K507 E508 Q512 E513 I514 I538 M540 M768	I499-V510 HydrophobicContact CD1-CG1 3.82Å; I499-V510 HydrophobicContact CD1-CG2 4.22Å; I499-V510 HydrophobicContact CG2-CG2 4.04Å; D506-V510 WeakPolarHBondContact O-CG2 3.35Å; D506-V510 PolarHBondContact O-N 2.88Å; K507-V510 PolarHBondContact O-N 3Å; E508-V510 PolarHBondContact O-N 2.88Å; V510-Q512 VanDerWaalsContact C-N 3.3Å; V510-Q512 PolarHBondContact O-N 3.3Å; V510-E513 WeakPolarHBondContact O-CB 3.5Å; V510-E513 PolarHBondContact O-N 2.63Å; V510-I514 HydrophobicContact CG1-CD1 4.06Å; V510-I514 WeakPolarHBondContact O-CD1 3.38Å; V510-I514 WeakPolarHBondContact O-CG1 3.49Å; V510-I514 PolarHBondContact O-N 2.85Å; V510-I538 HydrophobicContact CB-CD1 3.87Å; V510-I538 HydrophobicContact CG1-CB 3.98Å; V510-I538 HydrophobicContact CG1-CD1 3.89Å; V510-I538 HydrophobicContact CG1-CG2 3.68Å; V510-M540 HydrophobicContact CG1-SD 4.17Å; V510-M768 HydrophobicContact CG2-CG 4.3Å; V510-M768 HydrophobicContact CG2-SD 4.45Å
511	R	86.4	Confident	81.8	Confident	78 Å²	78	41.8 Å²	41.8	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-65.1	-34	171.2	-68.5	-175.4	-155.1	115.7	1.8	112	I458 K507 E508 N509 G515 E533	I458-R511 HydrophobicContact CD1-CB 4.26Å; I458-R511 HydrophobicContact CD1-CG 3.74Å; K507-R511 WeakPolarHBondContact O-CG 3.1Å; K507-R511 PolarHBondContact O-N 2.87Å; E508-R511 PolarHBondContact O-N 2.86Å; E508-R511 IonicContact OE2-CZ 2.84Å; E508-R511 IonicContact OE2-NH1 3.79Å; E508-R511 PolarHBondContact OE2-NH1 3.06Å; N509-R511 VanDerWaalsContact C-N 3.34Å; N509-R511 PolarHBondContact O-N 2.89Å; R511-G515 PolarHBondContact O-N 2.91Å; R511-E533 IonicContact CZ-OE2 3.04Å; R511-E533 VanDerWaalsContact CZ-OE2 3.28Å; R511-E533 IonicContact NE-OE2 3.16Å; R511-E533 PolarHBondContact NE-OE2 3.43Å; R511-E533 VanDerWaalsContact NH2-CD 3.3Å; R511-E533 IonicContact NH2-OE1 2.89Å; R511-E533 PolarHBondContact NH2-OE1 3Å; R511-E533 IonicContact NH2-OE2 2.66Å; R511-E533 PolarHBondContact NH2-OE2 3.38Å
512	Q	84	Confident	82.8	Confident	87 Å²	87	43 Å²	43	41%	0.407	22%	0.223	S	C	.	.	H	α-helix	trans	-71	-40.2	174.6	-68.8	171.7	21.6	0	0	111.5	E508 N509 V510 G515 I516 M767	E508-Q512 WeakPolarHBondContact O-CG 3.26Å; E508-Q512 PolarHBondContact O-N 3.48Å; E508-Q512 PolarHBondContact OE1-NE2 2.6Å; N509-Q512 WeakPolarHBondContact O-CB 3.46Å; N509-Q512 PolarHBondContact O-N 3.3Å; N509-Q512 VanDerWaalsContact O-N 3.11Å; V510-Q512 VanDerWaalsContact C-N 3.3Å; V510-Q512 PolarHBondContact O-N 3.3Å; Q512-G515 PolarHBondContact O-N 3.02Å; Q512-I516 WeakPolarHBondContact O-CB 3.3Å; Q512-I516 WeakPolarHBondContact O-CG1 3.43Å; Q512-I516 PolarHBondContact O-N 3.24Å; Q512-M767 HydrophobicContact CB-SD 4.34Å
513	E	87.1	Confident	83.6	Confident	3 Å²	3	38.6 Å²	38.6	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-55	-51.6	170.4	-167.3	179.4	131.3	0	0	110.7	K497 N509 V510 I516 M517 M540 A766 M767	K497-E513 IonicContact NZ-OE1 3.6Å; K497-E513 PolarHBondContact NZ-OE1 2.72Å; N509-E513 PolarHBondContact O-N 3.12Å; V510-E513 WeakPolarHBondContact O-CB 3.5Å; V510-E513 PolarHBondContact O-N 2.63Å; E513-I516 PolarHBondContact O-N 2.85Å; E513-M517 WeakPolarHBondContact O-CG 3.44Å; E513-M517 PolarHBondContact O-N 3.14Å; E513-M540 HydrophobicContact CG-CE 4.33Å; E513-A766 WeakPolarHBondContact OE2-CA 3.2Å; E513-M767 PolarHBondContact OE2-N 3.43Å
514	I	90	Very high	84.7	Confident	2 Å²	2	38 Å²	38	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-44.4	176.4	-65.1	161.2	0	0	0	111.9	I458 V510 I516 M517 N518 A531 I538 M540	I458-I514 HydrophobicContact CD1-CB 4.39Å; I458-I514 HydrophobicContact CD1-CD1 3.77Å; I458-I514 HydrophobicContact CD1-CG2 4.18Å; I458-I514 HydrophobicContact CG1-CD1 4.23Å; I458-I514 HydrophobicContact CG1-CG2 4.15Å; V510-I514 HydrophobicContact CG1-CD1 4.06Å; V510-I514 WeakPolarHBondContact O-CD1 3.38Å; V510-I514 WeakPolarHBondContact O-CG1 3.49Å; V510-I514 PolarHBondContact O-N 2.85Å; I514-I516 PolarHBondContact O-N 3.17Å; I514-M517 PolarHBondContact O-N 2.9Å; I514-M517 VanDerWaalsContact O-N 3.17Å; I514-N518 PolarHBondContact O-N 2.76Å; I514-A531 HydrophobicContact CD1-CB 3.96Å; I514-A531 HydrophobicContact CG2-CB 4.48Å; I514-I538 HydrophobicContact CD1-CG2 3.97Å; I514-M540 HydrophobicContact CD1-CG 3.84Å; I514-M540 HydrophobicContact CD1-SD 4.31Å; I514-M540 HydrophobicContact CG1-CE 3.83Å; I514-M540 HydrophobicContact CG1-CG 3.8Å; I514-M540 HydrophobicContact CG1-SD 3.88Å
515	G	90.4	Very high	85.8	Confident	36 Å²	36	34 Å²	34	37%	0.371	17%	0.174	S	C	.	.	H	α-helix	trans	-67.1	-21.7	179.8	0	0	0	0	0	114.1	R511 Q512	R511-G515 PolarHBondContact O-N 2.91Å; Q512-G515 PolarHBondContact O-N 3.02Å
516	I	90.4	Very high	87	Confident	17 Å²	17	28.8 Å²	28.8	9%	0.087	15%	0.152	C	C	.	.	H	α-helix	trans	-77.3	-50.4	168	-76.5	170.7	0	0	0	109.8	Q512 E513 I514 N518 S519 L520 I585 A613	Q512-I516 WeakPolarHBondContact O-CB 3.3Å; Q512-I516 WeakPolarHBondContact O-CG1 3.43Å; Q512-I516 PolarHBondContact O-N 3.24Å; E513-I516 PolarHBondContact O-N 2.85Å; I514-I516 PolarHBondContact O-N 3.17Å; I516-N518 VanDerWaalsContact C-N 3.29Å; I516-N518 PolarHBondContact O-N 2.98Å; I516-S519 WeakPolarHBondContact O-CA 3.29Å; I516-S519 PolarHBondContact O-N 3.45Å; I516-S519 PolarHBondContact O-OG 3.35Å; I516-L520 HydrophobicContact CG2-CD1 3.68Å; I516-L520 HydrophobicContact CG2-CG 4.38Å; I516-L520 WeakPolarHBondContact O-CG 3.41Å; I516-L520 PolarHBondContact O-N 3.38Å; I516-I585 HydrophobicContact CG2-CD1 4.25Å; I516-I585 HydrophobicContact CG2-CG2 4.49Å; I516-A613 WeakPolarHBondContact CD1-O 3.49Å; I516-A613 HydrophobicContact CG2-CB 4.41Å
517	M	92.4	Very high	88	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.039	15%	0.151	C	C	.	.	H	α-helix	trans	-56.4	-39.5	179	-68.8	-173.8	78.9	0	0	113	E513 I514 S519 L520 V526 C528 M540 L542 F610	E513-M517 WeakPolarHBondContact O-CG 3.44Å; E513-M517 PolarHBondContact O-N 3.14Å; I514-M517 PolarHBondContact O-N 2.9Å; I514-M517 VanDerWaalsContact O-N 3.17Å; M517-S519 PolarHBondContact O-N 3.33Å; M517-L520 PolarHBondContact O-N 3.21Å; M517-V526 HydrophobicContact CE-CG1 3.79Å; M517-V526 WeakPolarHBondContact CE-O 3.35Å; M517-C528 HydrophobicContact CB-CB 4.19Å; M517-C528 HydrophobicContact CE-CB 3.96Å; M517-C528 HydrophobicContact SD-CB 4.14Å; M517-M540 HydrophobicContact SD-CE 3.43Å; M517-M540 WeakPolarHBondContact SD-CE 3.32Å; M517-L542 HydrophobicContact CE-CD2 3.9Å; M517-L542 HydrophobicContact SD-CD2 4.5Å; M517-F610 HydrophobicContact CE-CD2 4.01Å; M517-F610 HydrophobicContact CE-CE2 4.12Å; M517-F610 HydrophobicContact CG-CD2 3.74Å; M517-F610 HydrophobicContact CG-CE2 4.46Å; M517-F610 HydrophobicContact SD-CD2 4.15Å
518	N	90.4	Very high	88.7	Confident	33 Å²	33	27.7 Å²	27.7	18%	0.176	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.3	172.9	-80.2	-11.8	0	0	0	114.8	V456 I514 I516 H521	V456-N518 WeakPolarHBondContact CB-OD1 3.46Å; V456-N518 WeakPolarHBondContact CG2-OD1 3.15Å; V456-N518 PolarHBondContact N-OD1 3.05Å; V456-N518 PolarHBondContact O-ND2 2.96Å; I514-N518 PolarHBondContact O-N 2.76Å; I516-N518 VanDerWaalsContact C-N 3.29Å; I516-N518 PolarHBondContact O-N 2.98Å; N518-H521 PolarHBondContact O-CE1 3.22Å; N518-H521 PolarHBondContact O-ND1 3.05Å
519	S	89.6	Confident	89.3	Confident	24 Å²	24	26.3 Å²	26.3	17%	0.168	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	2.8	174.3	66	0	0	0	0	113.9	I516 M517 R615	I516-S519 WeakPolarHBondContact O-CA 3.29Å; I516-S519 PolarHBondContact O-N 3.45Å; I516-S519 PolarHBondContact O-OG 3.35Å; M517-S519 PolarHBondContact O-N 3.33Å; S519-R615 VanDerWaalsContact CB-NH2 3.34Å; S519-R615 PolarHBondContact OG-NH2 2.96Å
520	L	90.8	Very high	90.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.141	C	C	.	.			trans	-112.6	36.2	-175	-67	-176.2	0	0	0	112.4	I516 M517 H522 L525 Q527 F579 I580 Q583 I585 F610	I516-L520 HydrophobicContact CG2-CD1 3.68Å; I516-L520 HydrophobicContact CG2-CG 4.38Å; I516-L520 WeakPolarHBondContact O-CG 3.41Å; I516-L520 PolarHBondContact O-N 3.38Å; M517-L520 PolarHBondContact O-N 3.21Å; L520-H522 PolarHBondContact O-N 3.34Å; L520-L525 HydrophobicContact CB-CD1 3.82Å; L520-L525 HydrophobicContact CD2-CD1 4.17Å; L520-L525 HydrophobicContact CG-CD1 4.38Å; L520-Q527 PolarHBondContact O-NE2 3.28Å; L520-F579 HydrophobicContact CD2-CD1 4.22Å; L520-F579 HydrophobicContact CD2-CE1 4.44Å; L520-I580 HydrophobicContact CD1-CG1 4.16Å; L520-I580 HydrophobicContact CD2-CB 4.27Å; L520-I580 HydrophobicContact CD2-CG1 3.8Å; L520-I580 HydrophobicContact CD2-CG2 4.49Å; L520-Q583 HydrophobicContact CD2-CB 4.49Å; L520-Q583 HydrophobicContact CD2-CG 4.3Å; L520-I585 HydrophobicContact CD2-CD1 3.93Å; L520-I585 HydrophobicContact CG-CD1 4.28Å; L520-F610 HydrophobicContact CD1-CD1 4.16Å; L520-F610 HydrophobicContact CD1-CE1 4.32Å; L520-F610 HydrophobicContact CD1-CG 4.34Å
521	H	89.7	Confident	90.7	Very high	43 Å²	43	25.8 Å²	25.8	20%	0.199	14%	0.141	C	C	.	.			trans	-62.6	94.4	171.7	-64.3	131.9	0	0	0	111.3	Y453 D455 N518 Q527 F579	Y453-H521 HydrophobicContact CD1-CB 3.67Å; Y453-H521 AromaticContact CD1-CD2 3.51Å; Y453-H521 AromaticContact CD1-CG 3.85Å; Y453-H521 HydrophobicContact CD2-CB 4.36Å; Y453-H521 HydrophobicContact CE1-CB 4.02Å; Y453-H521 HydrophobicContact CG-CB 3.84Å; Y453-H521 AromaticContact CG-CD2 3.91Å; Y453-H521 AromaticContact CG-CG 3.98Å; D455-H521 IonicContact OD1-CE1 3.25Å; N518-H521 PolarHBondContact O-CE1 3.22Å; N518-H521 PolarHBondContact O-ND1 3.05Å; H521-Q527 PolarHBondContact CD2-OE1 3.29Å; H521-Q527 VanDerWaalsContact CD2-OE1 3.3Å; H521-F579 WeakPolarHBondContact O-CZ 3.41Å
522	H	91	Very high	91.1	Very high	24 Å²	24	22.2 Å²	22.2	11%	0.111	13%	0.128	C	C	.	.			trans	-156.1	141.3	-174.6	-166	-116.8	0	0	0	112.1	L520 K524 L525 Q527 D575 F579	L520-H522 PolarHBondContact O-N 3.34Å; H522-K524 PolarHBondContact O-N 3.44Å; H522-K524 VanDerWaalsContact O-N 3.11Å; H522-L525 HydrophobicContact CB-CB 4.28Å; H522-L525 HydrophobicContact CB-CD1 3.78Å; H522-L525 HydrophobicContact CB-CG 3.91Å; H522-L525 PolarHBondContact O-N 3.13Å; H522-L525 VanDerWaalsContact O-O 3.11Å; H522-Q527 PolarHBondContact O-NE2 3.41Å; H522-D575 IonicContact CE1-OD2 2.7Å; H522-D575 PolarHBondContact CE1-OD2 2.92Å; H522-D575 VanDerWaalsContact CE1-OD2 3.29Å; H522-D575 IonicContact NE2-OD2 2.64Å; H522-F579 HydrophobicContact CB-CD1 3.9Å; H522-F579 HydrophobicContact CB-CD2 4.33Å; H522-F579 HydrophobicContact CB-CE1 4.17Å; H522-F579 HydrophobicContact CB-CG 3.98Å; H522-F579 HydrophobicContact CB-CZ 4.49Å; H522-F579 AromaticContact CD2-CD2 3.34Å; H522-F579 WeakPolarHBondContact CD2-CD2 3.45Å; H522-F579 AromaticContact CD2-CE2 3.88Å; H522-F579 AromaticContact CD2-CG 3.63Å; H522-F579 AromaticContact CG-CD2 3.92Å; H522-F579 AromaticContact CG-CG 3.73Å; H522-F579 AromaticContact NE2-CD2 3.9Å
523	P	89.9	Confident	91.5	Very high	72 Å²	72	19.7 Å²	19.7	47%	0.468	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.9	-177.5	-27.6	36.6	0	0	0	115	K606	P523-K606 VanDerWaalsContact O-CE 3.28Å; P523-K606 WeakPolarHBondContact O-CE 3.45Å; P523-K606 WeakPolarHBondContact O-CG 3.43Å; P523-K606 PolarHBondContact O-NZ 3.24Å; P523-K606 VanDerWaalsContact O-NZ 3.12Å
524	K	94.7	Very high	91.3	Very high	33 Å²	33	21 Å²	21	14%	0.143	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	6.7	-179.9	-52.9	-55.6	174.6	-173.4	0	114.8	H522 Q572 K606 L607	H522-K524 PolarHBondContact O-N 3.44Å; H522-K524 VanDerWaalsContact O-N 3.11Å; K524-Q572 HydrophobicContact CD-CB 4.19Å; K524-Q572 HydrophobicContact CD-CG 4.27Å; K524-K606 CarbonylContact O-C 3.52Å; K524-K606 VanDerWaalsContact O-CA 3.29Å; K524-K606 WeakPolarHBondContact O-CA 3.44Å; K524-L607 PolarHBondContact O-N 2.86Å
525	L	94	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-122.8	140	179.2	-54	179.1	0	0	0	108.8	L520 H522 Q527 F579 I580 K606 L607 F610	L520-L525 HydrophobicContact CB-CD1 3.82Å; L520-L525 HydrophobicContact CD2-CD1 4.17Å; L520-L525 HydrophobicContact CG-CD1 4.38Å; H522-L525 HydrophobicContact CB-CB 4.28Å; H522-L525 HydrophobicContact CB-CD1 3.78Å; H522-L525 HydrophobicContact CB-CG 3.91Å; H522-L525 PolarHBondContact O-N 3.13Å; H522-L525 VanDerWaalsContact O-O 3.11Å; L525-Q527 PolarHBondContact O-NE2 2.83Å; L525-F579 HydrophobicContact CD1-CD1 4.17Å; L525-I580 HydrophobicContact CD1-CD1 4.3Å; L525-I580 HydrophobicContact CD1-CG1 3.82Å; L525-I580 HydrophobicContact CD2-CD1 3.9Å; L525-I580 HydrophobicContact CD2-CG1 4.28Å; L525-K606 PolarHBondContact O-NZ 3.14Å; L525-L607 HydrophobicContact CD2-CB 3.87Å; L525-L607 HydrophobicContact CD2-CD1 3.83Å; L525-L607 HydrophobicContact CD2-CG 4.04Å; L525-F610 HydrophobicContact CB-CZ 3.96Å; L525-F610 HydrophobicContact CD2-CE1 4.1Å; L525-F610 HydrophobicContact CD2-CZ 3.92Å; L525-F610 HydrophobicContact CG-CZ 4.38Å
526	V	92.1	Very high	90	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.024	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-67	135.3	174.6	72.8	0	0	0	0	110.2	M517 E543 I545 L607 I608 F610	M517-V526 HydrophobicContact CE-CG1 3.79Å; M517-V526 WeakPolarHBondContact CE-O 3.35Å; V526-E543 HydrophobicContact CG2-CB 4.08Å; V526-I545 HydrophobicContact CB-CD1 4.06Å; V526-I545 HydrophobicContact CG2-CD1 3.69Å; V526-L607 PolarHBondContact N-O 3Å; V526-I608 HydrophobicContact CB-CG2 4.33Å; V526-I608 HydrophobicContact CG1-CB 4.3Å; V526-F610 HydrophobicContact CG1-CE2 3.99Å
527	Q	89.4	Confident	89.5	Confident	10 Å²	10	31.7 Å²	31.7	5%	0.047	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-95.1	135.1	-178.1	-58.4	-55.1	-48.9	0	0	111.6	Y453 L520 H521 H522 L525 V529 L542 E543	Y453-Q527 HydrophobicContact CD1-CG 4.34Å; Y453-Q527 HydrophobicContact CE1-CG 3.97Å; L520-Q527 PolarHBondContact O-NE2 3.28Å; H521-Q527 PolarHBondContact CD2-OE1 3.29Å; H521-Q527 VanDerWaalsContact CD2-OE1 3.3Å; H522-Q527 PolarHBondContact O-NE2 3.41Å; L525-Q527 PolarHBondContact O-NE2 2.83Å; Q527-V529 HydrophobicContact CB-CG1 4.39Å; Q527-L542 WeakPolarHBondContact O-CA 3.46Å; Q527-E543 HydrophobicContact CB-CB 4.43Å; Q527-E543 PolarHBondContact N-OE2 3.16Å; Q527-E543 PolarHBondContact O-N 3.43Å
528	C	91.9	Very high	89.3	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.034	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.7	160.4	-169.6	0	0	0	0	107.6	V456 M517 D530 L542	V456-C528 HydrophobicContact CG2-CB 4.34Å; V456-C528 VanDerWaalsContact CG2-O 3.23Å; V456-C528 WeakPolarHBondContact CG2-O 3.37Å; M517-C528 HydrophobicContact CB-CB 4.19Å; M517-C528 HydrophobicContact CE-CB 3.96Å; M517-C528 HydrophobicContact SD-CB 4.14Å; C528-D530 PolarHBondContact SG-O 2.64Å; C528-L542 HydrophobicContact CB-CD2 3.83Å
529	V	91.2	Very high	89.3	Confident	52 Å²	52	30.2 Å²	30.2	32%	0.315	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	-19	-174.4	-60	0	0	0	0	113.4	W494 Q527 V541	W494-V529 HydrophobicContact CD2-CG2 3.94Å; W494-V529 HydrophobicContact CE3-CG1 4.42Å; W494-V529 HydrophobicContact CE3-CG2 3.62Å; W494-V529 HydrophobicContact CH2-CB 4.25Å; W494-V529 HydrophobicContact CH2-CG1 3.93Å; W494-V529 HydrophobicContact CH2-CG2 3.99Å; W494-V529 HydrophobicContact CZ2-CG2 4.29Å; W494-V529 HydrophobicContact CZ3-CB 4.17Å; W494-V529 HydrophobicContact CZ3-CG1 3.67Å; W494-V529 HydrophobicContact CZ3-CG2 3.66Å; Q527-V529 HydrophobicContact CB-CG1 4.39Å; V529-V541 HydrophobicContact CG2-CB 4.23Å; V529-V541 HydrophobicContact CG2-CG1 3.79Å; V529-V541 PolarHBondContact N-O 3.3Å
530	D	93.4	Very high	89.5	Confident	9 Å²	9	29.1 Å²	29.1	5%	0.048	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158.5	167.8	-156.5	-2.8	0	0	0	110.8	V456 K459 Y468 C528 F532 V541	V456-D530 VanDerWaalsContact CG1-C 3.46Å; K459-D530 IonicContact NZ-OD1 2.68Å; K459-D530 PolarHBondContact NZ-OD1 2.69Å; K459-D530 IonicContact NZ-OD2 3.45Å; K459-D530 PolarHBondContact NZ-OD2 3.42Å; Y468-D530 HydrophobicContact CE2-CB 4.39Å; C528-D530 PolarHBondContact SG-O 2.64Å; D530-F532 HydrophobicContact CB-CE2 4.16Å; D530-F532 VanDerWaalsContact OD2-CE2 3.3Å; D530-F532 WeakPolarHBondContact OD2-CE2 3.34Å; D530-F532 WeakPolarHBondContact OD2-CZ 3.42Å; D530-V541 HydrophobicContact CB-CB 3.85Å; D530-V541 HydrophobicContact CB-CG2 3.91Å; D530-V541 PolarHBondContact N-O 3.44Å; D530-V541 PolarHBondContact O-N 2.75Å
531	A	95.1	Very high	89.6	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	141.8	175.3	0	0	0	0	0	111.8	V456 I458 K459 I514 V539	V456-A531 HydrophobicContact CG1-CB 3.56Å; V456-A531 VanDerWaalsContact CG1-N 3.34Å; I458-A531 HydrophobicContact CB-CB 4.41Å; I458-A531 HydrophobicContact CG1-CB 3.96Å; I458-A531 HydrophobicContact CG2-CB 4.4Å; K459-A531 PolarHBondContact N-O 3.35Å; I514-A531 HydrophobicContact CD1-CB 3.96Å; I514-A531 HydrophobicContact CG2-CB 4.48Å; A531-V539 CarbonylContact C-O 3.49Å; A531-V539 VanDerWaalsContact CA-O 3.27Å; A531-V539 WeakPolarHBondContact CA-O 3.26Å
532	F	94.7	Very high	89.7	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.9	-178.9	-62	-97.3	0	0	0	110.5	K459 V462 V464 F467 Y468 D530 I538 V539 V541	K459-F532 HydrophobicContact CB-CD1 3.89Å; K459-F532 HydrophobicContact CB-CE1 4.16Å; K459-F532 HydrophobicContact CD-CD1 4.24Å; K459-F532 HydrophobicContact CD-CE1 3.64Å; K459-F532 HydrophobicContact CD-CZ 4Å; K459-F532 HydrophobicContact CG-CE1 4.44Å; K459-F532 WeakPolarHBondContact O-CA 3.48Å; V462-F532 HydrophobicContact CG2-CD1 4.28Å; V462-F532 HydrophobicContact CG2-CE1 4.27Å; V464-F532 HydrophobicContact CB-CD1 4.32Å; V464-F532 HydrophobicContact CB-CD2 3.78Å; V464-F532 HydrophobicContact CB-CE1 4.48Å; V464-F532 HydrophobicContact CB-CE2 3.98Å; V464-F532 HydrophobicContact CB-CG 3.98Å; V464-F532 HydrophobicContact CB-CZ 4.33Å; V464-F532 HydrophobicContact CG2-CD2 3.9Å; V464-F532 HydrophobicContact CG2-CE2 3.77Å; V464-F532 HydrophobicContact CG2-CZ 4.35Å; F467-F532 HydrophobicContact CB-CZ 4.24Å; F467-F532 AromaticContact CD2-CE1 3.54Å; F467-F532 HydrophobicContact CD2-CE1 3.54Å; F467-F532 AromaticContact CD2-CZ 3.78Å; F467-F532 HydrophobicContact CD2-CZ 3.78Å; F467-F532 AromaticContact CE2-CE1 3.9Å; F467-F532 HydrophobicContact CE2-CE1 3.9Å; F467-F532 HydrophobicContact CE2-CZ 4.48Å; F467-F532 HydrophobicContact CG-CE1 4.35Å; F467-F532 HydrophobicContact CG-CZ 4.15Å; Y468-F532 HydrophobicContact CD2-CE2 4.16Å; Y468-F532 HydrophobicContact CD2-CZ 4.21Å; Y468-F532 AromaticContact CE2-CE2 3.84Å; Y468-F532 HydrophobicContact CE2-CE2 3.84Å; Y468-F532 AromaticContact CE2-CZ 3.94Å; Y468-F532 HydrophobicContact CE2-CZ 3.94Å; D530-F532 HydrophobicContact CB-CE2 4.16Å; D530-F532 VanDerWaalsContact OD2-CE2 3.3Å; D530-F532 WeakPolarHBondContact OD2-CE2 3.34Å; D530-F532 WeakPolarHBondContact OD2-CZ 3.42Å; F532-I538 CarbonylContact O-C 3.54Å; F532-I538 VanDerWaalsContact O-CA 3.32Å; F532-I538 WeakPolarHBondContact O-CA 3.39Å; F532-V539 HydrophobicContact CB-CB 4.32Å; F532-V539 PolarHBondContact N-O 2.88Å; F532-V539 PolarHBondContact O-N 3.04Å; F532-V541 HydrophobicContact CD2-CG2 4.38Å; F532-V541 HydrophobicContact CE2-CG2 4.07Å
533	E	92.4	Very high	89.5	Confident	34 Å²	34	28 Å²	28	16%	0.159	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.1	171.6	-176.1	174.2	150.8	0	0	111	I458 K459 T460 K507 R511 I538	I458-E533 HydrophobicContact CG2-CB 3.88Å; K459-E533 PolarHBondContact O-N 3.37Å; T460-E533 HydrophobicContact CG2-CB 4.41Å; K507-E533 HydrophobicContact CD-CG 4.06Å; K507-E533 WeakPolarHBondContact CD-OE1 3.36Å; K507-E533 IonicContact NZ-OE1 2.64Å; K507-E533 PolarHBondContact NZ-OE1 2.67Å; R511-E533 IonicContact CZ-OE2 3.04Å; R511-E533 VanDerWaalsContact CZ-OE2 3.28Å; R511-E533 IonicContact NE-OE2 3.16Å; R511-E533 PolarHBondContact NE-OE2 3.43Å; R511-E533 VanDerWaalsContact NH2-CD 3.3Å; R511-E533 IonicContact NH2-OE1 2.89Å; R511-E533 PolarHBondContact NH2-OE1 3Å; R511-E533 IonicContact NH2-OE2 2.66Å; R511-E533 PolarHBondContact NH2-OE2 3.38Å; E533-I538 HydrophobicContact CB-CG1 4.25Å; E533-I538 HydrophobicContact CG-CD1 4.49Å; E533-I538 HydrophobicContact CG-CG1 3.99Å
534	G	83.9	Confident	89.2	Confident	31 Å²	31	27 Å²	27	32%	0.32	14%	0.143	S	C	.	.			trans	-90	-172.5	170.9	0	0	0	0	0	112.6	K507 D537	K507-G534 PolarHBondContact NZ-O 3Å; G534-D537 CarbonylContact C-O 3.52Å; G534-D537 WeakPolarHBondContact CA-O 3.35Å; G534-D537 PolarHBondContact N-O 2.89Å
535	K	78	Confident	88.6	Confident	201 Å²	201	25.9 Å²	25.9	87%	0.874	14%	0.138	S	C	*	.	S	Bend	trans	-72.6	-32.7	179.2	-69.5	-170.2	176.6	-174	0	113.1	K507	K507-K535 PolarHBondContact NZ-O 2.9Å
536	S	74.8	Confident	87.6	Confident	40 Å²	40	28.5 Å²	28.5	28%	0.28	16%	0.156	S	C	.	.	S	Bend	trans	-135.3	11.8	-169.6	46.4	0	0	0	0	112.8	A501	A501-S536 PolarHBondContact N-O 3.46Å; A501-S536 CarbonylContact O-C 3.6Å; A501-S536 WeakPolarHBondContact O-CA 3.24Å
537	D	81.1	Confident	86.5	Confident	37 Å²	37	28.8 Å²	28.8	20%	0.198	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.7	-165.3	9.3	37.3	0	0	0	110.1	I499 K500 G534	I499-D537 CarbonylContact O-C 3.58Å; I499-D537 WeakPolarHBondContact O-CA 3.32Å; I499-D537 WeakPolarHBondContact O-CB 3.26Å; K500-D537 HydrophobicContact CD-CB 4.31Å; K500-D537 IonicContact NZ-OD2 3.55Å; K500-D537 PolarHBondContact NZ-OD2 2.79Å; G534-D537 CarbonylContact C-O 3.52Å; G534-D537 WeakPolarHBondContact CA-O 3.35Å; G534-D537 PolarHBondContact N-O 2.89Å
538	I	87.3	Confident	85.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.2	162.2	-69.6	166.2	0	0	0	107.1	I499 K507 V510 I514 F532 E533	I499-I538 PolarHBondContact N-O 3.31Å; I499-I538 PolarHBondContact O-N 2.75Å; K507-I538 HydrophobicContact CB-CD1 3.87Å; K507-I538 HydrophobicContact CD-CD1 4.39Å; K507-I538 HydrophobicContact CG-CD1 3.99Å; V510-I538 HydrophobicContact CB-CD1 3.87Å; V510-I538 HydrophobicContact CG1-CB 3.98Å; V510-I538 HydrophobicContact CG1-CD1 3.89Å; V510-I538 HydrophobicContact CG1-CG2 3.68Å; I514-I538 HydrophobicContact CD1-CG2 3.97Å; F532-I538 CarbonylContact O-C 3.54Å; F532-I538 VanDerWaalsContact O-CA 3.32Å; F532-I538 WeakPolarHBondContact O-CA 3.39Å; E533-I538 HydrophobicContact CB-CG1 4.25Å; E533-I538 HydrophobicContact CG-CD1 4.49Å; E533-I538 HydrophobicContact CG-CG1 3.99Å
539	V	91.1	Very high	85.5	Confident	11 Å²	11	29.4 Å²	29.4	7%	0.067	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.7	176	-169.2	0	0	0	0	108.3	V464 K497 F498 A531 F532	V464-V539 HydrophobicContact CG1-CG2 4.32Å; V464-V539 HydrophobicContact CG2-CG1 4.33Å; K497-V539 WeakPolarHBondContact O-CA 3.47Å; F498-V539 HydrophobicContact CD1-CB 4.38Å; F498-V539 HydrophobicContact CD1-CG1 4.07Å; F498-V539 HydrophobicContact CD1-CG2 3.4Å; F498-V539 VanDerWaalsContact CD1-CG2 3.4Å; F498-V539 HydrophobicContact CD2-CG1 3.92Å; F498-V539 HydrophobicContact CE1-CG1 4.02Å; F498-V539 HydrophobicContact CE1-CG2 3.64Å; F498-V539 HydrophobicContact CE2-CG1 3.86Å; F498-V539 HydrophobicContact CG-CG1 4.01Å; F498-V539 HydrophobicContact CG-CG2 3.98Å; F498-V539 HydrophobicContact CZ-CG1 3.91Å; F498-V539 HydrophobicContact CZ-CG2 4.37Å; A531-V539 CarbonylContact C-O 3.49Å; A531-V539 VanDerWaalsContact CA-O 3.27Å; A531-V539 WeakPolarHBondContact CA-O 3.26Å; F532-V539 HydrophobicContact CB-CB 4.32Å; F532-V539 PolarHBondContact N-O 2.88Å; F532-V539 PolarHBondContact O-N 3.04Å
540	M	92.8	Very high	85.3	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	168.8	-65.6	163.8	71.2	0	0	108.3	K497 I499 V510 E513 I514 M517 L542	K497-M540 HydrophobicContact CB-CB 4.31Å; K497-M540 HydrophobicContact CD-SD 4.25Å; K497-M540 PolarHBondContact N-O 3.32Å; K497-M540 PolarHBondContact O-N 3.05Å; I499-M540 HydrophobicContact CD1-CG 4.46Å; I499-M540 HydrophobicContact CD1-SD 3.57Å; I499-M540 VanDerWaalsContact CD1-SD 3.57Å; V510-M540 HydrophobicContact CG1-SD 4.17Å; E513-M540 HydrophobicContact CG-CE 4.33Å; I514-M540 HydrophobicContact CD1-CG 3.84Å; I514-M540 HydrophobicContact CD1-SD 4.31Å; I514-M540 HydrophobicContact CG1-CE 3.83Å; I514-M540 HydrophobicContact CG1-CG 3.8Å; I514-M540 HydrophobicContact CG1-SD 3.88Å; M517-M540 HydrophobicContact SD-CE 3.43Å; M517-M540 WeakPolarHBondContact SD-CE 3.32Å; M540-L542 HydrophobicContact CB-CD2 4.24Å; M540-L542 HydrophobicContact CB-CG 4.5Å; M540-L542 HydrophobicContact CE-CD2 4.4Å
541	V	93.2	Very high	85.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.9	171.4	-174.8	0	0	0	0	107.1	Y468 L485 W494 V529 D530 F532	Y468-V541 HydrophobicContact CE1-CG1 4.02Å; Y468-V541 HydrophobicContact CE2-CG2 4.11Å; L485-V541 HydrophobicContact CD1-CB 4.49Å; L485-V541 HydrophobicContact CD1-CG1 4.14Å; L485-V541 HydrophobicContact CD1-CG2 3.79Å; W494-V541 HydrophobicContact CB-CG1 3.61Å; W494-V541 HydrophobicContact CG-CG1 4.01Å; V529-V541 HydrophobicContact CG2-CB 4.23Å; V529-V541 HydrophobicContact CG2-CG1 3.79Å; V529-V541 PolarHBondContact N-O 3.3Å; D530-V541 HydrophobicContact CB-CB 3.85Å; D530-V541 HydrophobicContact CB-CG2 3.91Å; D530-V541 PolarHBondContact N-O 3.44Å; D530-V541 PolarHBondContact O-N 2.75Å; F532-V541 HydrophobicContact CD2-CG2 4.38Å; F532-V541 HydrophobicContact CE2-CG2 4.07Å
542	L	91.1	Very high	84.6	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	155	-173.5	-56.6	-179.9	0	0	0	110.8	A495 K497 M517 Q527 C528 M540 L762	A495-L542 HydrophobicContact CB-CB 4.34Å; A495-L542 PolarHBondContact N-O 2.9Å; A495-L542 PolarHBondContact O-N 2.98Å; K497-L542 HydrophobicContact CB-CD1 4.26Å; K497-L542 HydrophobicContact CD-CD1 4.13Å; M517-L542 HydrophobicContact CE-CD2 3.9Å; M517-L542 HydrophobicContact SD-CD2 4.5Å; Q527-L542 WeakPolarHBondContact O-CA 3.46Å; C528-L542 HydrophobicContact CB-CD2 3.83Å; M540-L542 HydrophobicContact CB-CD2 4.24Å; M540-L542 HydrophobicContact CB-CG 4.5Å; M540-L542 HydrophobicContact CE-CD2 4.4Å; L542-L762 HydrophobicContact CD1-CD1 4.16Å; L542-L762 HydrophobicContact CD1-CD2 4.36Å
543	E	87.6	Confident	84.1	Confident	42 Å²	42	29.7 Å²	29.7	20%	0.196	16%	0.163	C	C	.	.			trans	-50.4	135.9	164.6	-174.5	-179.5	-167	0	0	111.4	V526 Q527 K606	V526-E543 HydrophobicContact CG2-CB 4.08Å; Q527-E543 HydrophobicContact CB-CB 4.43Å; Q527-E543 PolarHBondContact N-OE2 3.16Å; Q527-E543 PolarHBondContact O-N 3.43Å; E543-K606 WeakPolarHBondContact OE1-CE 3.48Å; E543-K606 IonicContact OE1-NZ 2.75Å; E543-K606 PolarHBondContact OE1-NZ 3.41Å; E543-K606 WeakPolarHBondContact OE2-CE 3.35Å; E543-K606 IonicContact OE2-NZ 2.65Å; E543-K606 PolarHBondContact OE2-NZ 2.95Å
544	M	83.8	Confident	83.9	Confident	53 Å²	53	28.1 Å²	28.1	26%	0.261	16%	0.156	S	C	.	.			trans	-80.7	134.8	178.1	-172	61.2	81.6	0	0	110.6	L474 K484 V493 W494 A495 I759	L474-M544 HydrophobicContact CD1-CE 3.79Å; L474-M544 HydrophobicContact CD1-SD 4.2Å; K484-M544 HydrophobicContact CG-CE 4.25Å; V493-M544 HydrophobicContact CG1-CE 3.69Å; W494-M544 VanDerWaalsContact C-CE 3.46Å; W494-M544 VanDerWaalsContact O-CE 3.22Å; W494-M544 WeakPolarHBondContact O-CE 3.05Å; A495-M544 HydrophobicContact CB-CE 4.17Å; A495-M544 HydrophobicContact CB-SD 4.14Å; M544-I759 HydrophobicContact SD-CD1 3.6Å; M544-I759 HydrophobicContact SD-CG1 4.43Å
545	I	81.5	Confident	84.1	Confident	8 Å²	8	28 Å²	28	4%	0.041	15%	0.148	C	C	.	.			trans	-132.2	105.5	-175.4	-66.3	178.6	0	0	0	108.8	V526 M596 C597 K606 I608 I759	V526-I545 HydrophobicContact CB-CD1 4.06Å; V526-I545 HydrophobicContact CG2-CD1 3.69Å; I545-M596 HydrophobicContact CG2-CB 3.68Å; I545-M596 HydrophobicContact CG2-CE 3.98Å; I545-M596 HydrophobicContact CG2-CG 4.5Å; I545-M596 HydrophobicContact CG2-SD 4.06Å; I545-C597 WeakPolarHBondContact CG2-O 3.32Å; I545-K606 HydrophobicContact CD1-CB 4.13Å; I545-K606 HydrophobicContact CD1-CD 3.83Å; I545-K606 HydrophobicContact CG1-CD 4.37Å; I545-I608 HydrophobicContact CD1-CG2 3.83Å; I545-I759 VanDerWaalsContact O-CD1 3.26Å; I545-I759 WeakPolarHBondContact O-CD1 3.45Å; I545-I759 WeakPolarHBondContact O-CG1 3.45Å
546	S	74.1	Confident	84.5	Confident	55 Å²	55	21.7 Å²	21.7	39%	0.385	12%	0.124	S	C	.	.			trans	-91.3	-19.9	-170.2	62.5	0	0	0	0	114.7	G548 V598	S546-G548 VanDerWaalsContact C-N 3.34Å; S546-G548 PolarHBondContact O-N 3.03Å; S546-V598 PolarHBondContact N-O 2.75Å; S546-V598 VanDerWaalsContact N-O 3.13Å; S546-V598 PolarHBondContact OG-O 3.41Å
547	G	68	Low	84.9	Confident	10 Å²	10	27.3 Å²	27.3	10%	0.103	15%	0.145	C	C	.	.	S	Bend	trans	-74.5	-4.3	-165.8	0	0	0	0	0	118.4	C597 V598 N599	G547-C597 CarbonylContact C-O 3.09Å; G547-C597 WeakPolarHBondContact CA-O 3.4Å; G547-C597 PolarHBondContact N-O 3.23Å; G547-C597 VanDerWaalsContact N-O 3.15Å; G547-V598 PolarHBondContact N-O 3.48Å; G547-N599 WeakPolarHBondContact CA-O 3.23Å
548	G	75.8	Confident	85.1	Confident	17 Å²	17	31.1 Å²	31.1	18%	0.175	17%	0.166	C	C	.	.			trans	89.2	-173.7	179.5	0	0	0	0	0	114.8	S546 M596 C597	S546-G548 VanDerWaalsContact C-N 3.34Å; S546-G548 PolarHBondContact O-N 3.03Å; G548-M596 CarbonylContact O-C 3.58Å; G548-M596 VanDerWaalsContact O-CA 3.24Å; G548-M596 WeakPolarHBondContact O-CA 3.5Å; G548-M596 WeakPolarHBondContact O-CB 3.45Å; G548-C597 PolarHBondContact O-N 3.12Å
549	E	84.2	Confident	85.1	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.056	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-77.7	140.9	169.5	-71.7	-175.9	165.3	0	0	110.6	F551 E552 R553 E593 A758 R761	E549-F551 VanDerWaalsContact C-N 3.25Å; E549-F551 PolarHBondContact O-N 3.04Å; E549-E552 HydrophobicContact CB-CB 4.26Å; E549-E552 HydrophobicContact CB-CG 4.02Å; E549-E552 PolarHBondContact O-N 3.2Å; E549-E552 VanDerWaalsContact O-N 3.12Å; E549-R553 PolarHBondContact O-N 3.46Å; E549-E593 VanDerWaalsContact OE1-CB 3.3Å; E549-E593 WeakPolarHBondContact OE1-CB 3.47Å; E549-A758 HydrophobicContact CG-CB 4.36Å; E549-R761 WeakPolarHBondContact OE1-CD 3.36Å; E549-R761 IonicContact OE1-CZ 3.08Å; E549-R761 IonicContact OE1-NE 2.82Å; E549-R761 IonicContact OE1-NH1 3.33Å; E549-R761 PolarHBondContact OE1-NH1 2.93Å; E549-R761 IonicContact OE2-CZ 2.68Å; E549-R761 IonicContact OE2-NH1 2.76Å; E549-R761 PolarHBondContact OE2-NH1 3.3Å; E549-R761 IonicContact OE2-NH2 2.68Å
550	L	88.3	Confident	85	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-54.5	-43.7	178	171.9	61.4	0	0	0	112.2	E552 R553 I554 Y569 I595 I605	L550-E552 VanDerWaalsContact C-N 3.32Å; L550-E552 PolarHBondContact O-N 2.95Å; L550-R553 PolarHBondContact O-N 2.97Å; L550-I554 HydrophobicContact CD1-CG2 3.87Å; L550-I554 WeakPolarHBondContact O-CG2 3.39Å; L550-I554 PolarHBondContact O-N 2.9Å; L550-Y569 HydrophobicContact CD1-CD1 3.58Å; L550-Y569 HydrophobicContact CD1-CD2 3.96Å; L550-Y569 HydrophobicContact CD1-CE1 3.37Å; L550-Y569 HydrophobicContact CD1-CE2 3.76Å; L550-Y569 HydrophobicContact CD1-CG 3.89Å; L550-Y569 VanDerWaalsContact CD1-CZ 3.47Å; L550-Y569 HydrophobicContact CD2-CD1 4.05Å; L550-Y569 HydrophobicContact CD2-CG 4.01Å; L550-Y569 HydrophobicContact CG-CD1 4.49Å; L550-I595 HydrophobicContact CB-CB 4.38Å; L550-I595 HydrophobicContact CB-CG2 3.91Å; L550-I595 HydrophobicContact CD2-CG2 3.77Å; L550-I595 HydrophobicContact CG-CG2 4.5Å; L550-I595 PolarHBondContact N-O 2.95Å; L550-I605 HydrophobicContact CB-CG2 4.48Å; L550-I605 HydrophobicContact CD1-CG2 4.12Å; L550-I605 HydrophobicContact CD2-CG2 4.39Å
551	F	89.2	Confident	84.9	Confident	5 Å²	5	37 Å²	37	2%	0.022	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-30.4	-176.9	-78.3	-105.4	0	0	0	112.3	E549 I554 P592 I595 I654 I657 L658 M740 Y743 I744	E549-F551 VanDerWaalsContact C-N 3.25Å; E549-F551 PolarHBondContact O-N 3.04Å; F551-I554 HydrophobicContact CD1-CD1 4.25Å; F551-I554 HydrophobicContact CG-CD1 4.47Å; F551-I554 WeakPolarHBondContact O-CG1 3.4Å; F551-P592 HydrophobicContact CD1-CB 4.22Å; F551-P592 HydrophobicContact CD1-CG 4.48Å; F551-P592 HydrophobicContact CD2-CB 3.51Å; F551-P592 HydrophobicContact CD2-CG 4.25Å; F551-P592 HydrophobicContact CE1-CB 4.28Å; F551-P592 HydrophobicContact CE1-CG 4.12Å; F551-P592 HydrophobicContact CE2-CB 3.6Å; F551-P592 HydrophobicContact CE2-CG 3.87Å; F551-P592 HydrophobicContact CG-CB 3.84Å; F551-P592 HydrophobicContact CZ-CB 3.99Å; F551-P592 HydrophobicContact CZ-CG 3.79Å; F551-I595 HydrophobicContact CE2-CD1 4.48Å; F551-I654 HydrophobicContact CZ-CG2 4.3Å; F551-I657 HydrophobicContact CE1-CB 4.35Å; F551-I657 HydrophobicContact CE1-CG2 3.8Å; F551-L658 HydrophobicContact CD1-CD2 4.45Å; F551-L658 HydrophobicContact CE1-CD2 3.78Å; F551-L658 HydrophobicContact CE1-CG 4.17Å; F551-L658 HydrophobicContact CE2-CD2 3.99Å; F551-L658 HydrophobicContact CE2-CG 4.43Å; F551-L658 HydrophobicContact CZ-CD1 4.46Å; F551-L658 HydrophobicContact CZ-CD2 3.53Å; F551-L658 HydrophobicContact CZ-CG 3.71Å; F551-M740 HydrophobicContact CD1-CE 4.34Å; F551-M740 HydrophobicContact CD1-SD 3.77Å; F551-M740 HydrophobicContact CE1-CE 4.26Å; F551-M740 HydrophobicContact CE1-SD 4.17Å; F551-Y743 HydrophobicContact CD1-CE1 4.43Å; F551-I744 HydrophobicContact CB-CD1 4.14Å; F551-I744 HydrophobicContact CB-CG1 4.31Å; F551-I744 WeakPolarHBondContact O-CD1 3.39Å
552	E	84	Confident	84.9	Confident	40 Å²	40	37.6 Å²	37.6	19%	0.187	20%	0.196	C	C	.	.	H	α-helix	trans	-69.5	-45.7	170.8	-63.1	-174.3	143.9	0	0	110.3	E549 L550 I554 I555 K748 R761	E549-E552 HydrophobicContact CB-CB 4.26Å; E549-E552 HydrophobicContact CB-CG 4.02Å; E549-E552 PolarHBondContact O-N 3.2Å; E549-E552 VanDerWaalsContact O-N 3.12Å; L550-E552 VanDerWaalsContact C-N 3.32Å; L550-E552 PolarHBondContact O-N 2.95Å; E552-I554 PolarHBondContact O-N 3.43Å; E552-I555 WeakPolarHBondContact O-CG1 3.09Å; E552-I555 PolarHBondContact O-N 2.83Å; E552-K748 WeakPolarHBondContact OE1-CE 3.42Å; E552-K748 IonicContact OE1-NZ 3.95Å; E552-K748 PolarHBondContact OE1-NZ 2.98Å; E552-R761 IonicContact OE1-CZ 2.86Å; E552-R761 IonicContact OE1-NH1 2.93Å; E552-R761 IonicContact OE1-NH2 2.87Å; E552-R761 PolarHBondContact OE1-NH2 3.03Å; E552-R761 IonicContact OE2-NH2 3.68Å; E552-R761 PolarHBondContact OE2-NH2 2.89Å
553	R	84.9	Confident	85	Confident	26 Å²	26	38 Å²	38	10%	0.098	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-42.9	179.7	-179.6	66.3	-162.9	125.8	-4.6	113.7	E549 L550 I555 D556 D558 K600 T601	E549-R553 PolarHBondContact O-N 3.46Å; L550-R553 PolarHBondContact O-N 2.97Å; R553-I555 PolarHBondContact O-N 2.87Å; R553-D556 WeakPolarHBondContact CA-OD2 3.38Å; R553-D556 IonicContact CZ-OD2 2.74Å; R553-D556 IonicContact NH1-OD2 3.81Å; R553-D556 PolarHBondContact NH1-OD2 3.11Å; R553-D556 PolarHBondContact O-N 3.21Å; R553-D558 IonicContact CZ-OD1 3.02Å; R553-D558 IonicContact CZ-OD2 3.29Å; R553-D558 IonicContact NH1-OD1 3.11Å; R553-D558 PolarHBondContact NH1-OD1 3.48Å; R553-D558 IonicContact NH1-OD2 3.84Å; R553-D558 PolarHBondContact NH1-OD2 3.31Å; R553-D558 IonicContact NH2-OD1 3.21Å; R553-D558 IonicContact NH2-OD2 2.71Å; R553-D558 PolarHBondContact NH2-OD2 2.78Å; R553-K600 PolarHBondContact NE-O 3.1Å; R553-T601 PolarHBondContact NE-O 3.27Å; R553-T601 VanDerWaalsContact NE-O 3.17Å; R553-T601 PolarHBondContact NH2-O 3.22Å
554	I	88.3	Confident	85.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.4	-176.9	63.9	-177.3	0	0	0	113.9	L550 F551 E552 F559 L561 Y569 L658 K737 M740	L550-I554 HydrophobicContact CD1-CG2 3.87Å; L550-I554 WeakPolarHBondContact O-CG2 3.39Å; L550-I554 PolarHBondContact O-N 2.9Å; F551-I554 HydrophobicContact CD1-CD1 4.25Å; F551-I554 HydrophobicContact CG-CD1 4.47Å; F551-I554 WeakPolarHBondContact O-CG1 3.4Å; E552-I554 PolarHBondContact O-N 3.43Å; I554-F559 HydrophobicContact CB-CD1 4.28Å; I554-F559 HydrophobicContact CB-CE1 4.21Å; I554-F559 HydrophobicContact CG2-CD1 4.35Å; I554-F559 HydrophobicContact CG2-CE1 3.86Å; I554-F559 HydrophobicContact CG2-CZ 4.28Å; I554-L561 HydrophobicContact CB-CD1 4.22Å; I554-L561 HydrophobicContact CB-CD2 4.39Å; I554-L561 HydrophobicContact CD1-CD2 4.32Å; I554-L561 HydrophobicContact CG2-CD1 4.18Å; I554-Y569 HydrophobicContact CG2-CE2 3.96Å; I554-L658 HydrophobicContact CD1-CD2 3.52Å; I554-K737 VanDerWaalsContact O-CE 3.25Å; I554-K737 WeakPolarHBondContact O-CE 3.34Å; I554-K737 PolarHBondContact O-NZ 2.82Å; I554-M740 HydrophobicContact CD1-CE 3.75Å; I554-M740 HydrophobicContact CD1-CG 4.3Å; I554-M740 HydrophobicContact CD1-SD 4.15Å; I554-M740 HydrophobicContact CG1-CG 4.44Å
555	I	88	Confident	85.7	Confident	29 Å²	29	38.6 Å²	38.6	15%	0.149	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.1	176.7	59.1	162.6	0	0	0	115.1	E552 R553 M740 K741 I744	E552-I555 WeakPolarHBondContact O-CG1 3.09Å; E552-I555 PolarHBondContact O-N 2.83Å; R553-I555 PolarHBondContact O-N 2.87Å; I555-M740 HydrophobicContact CG2-CB 3.94Å; I555-M740 HydrophobicContact CG2-CG 3.36Å; I555-K741 HydrophobicContact CB-CG 3.79Å; I555-K741 HydrophobicContact CD1-CG 3.99Å; I555-K741 HydrophobicContact CG1-CG 4.49Å; I555-K741 HydrophobicContact CG2-CG 3.82Å; I555-K741 WeakPolarHBondContact O-CE 3.25Å; I555-I744 HydrophobicContact CB-CD1 4.45Å; I555-I744 HydrophobicContact CD1-CD1 3.8Å; I555-I744 HydrophobicContact CD1-CG2 4.35Å; I555-I744 HydrophobicContact CG1-CD1 4.04Å; I555-I744 HydrophobicContact CG2-CD1 3.59Å
556	D	85.8	Confident	86.4	Confident	69 Å²	69	38.2 Å²	38.2	37%	0.369	20%	0.195	S	C	.	.	S	Bend	trans	-58.2	148.3	178	-64.3	-34.6	0	0	0	112.2	R553 D558 F559 K737	R553-D556 WeakPolarHBondContact CA-OD2 3.38Å; R553-D556 IonicContact CZ-OD2 2.74Å; R553-D556 IonicContact NH1-OD2 3.81Å; R553-D556 PolarHBondContact NH1-OD2 3.11Å; R553-D556 PolarHBondContact O-N 3.21Å; D556-D558 VanDerWaalsContact C-N 3.28Å; D556-D558 VanDerWaalsContact CB-OD1 3.23Å; D556-D558 WeakPolarHBondContact CB-OD1 3.11Å; D556-D558 PolarHBondContact O-N 3.12Å; D556-F559 PolarHBondContact O-N 3.06Å; D556-K737 PolarHBondContact O-NZ 2.67Å
557	E	83.3	Confident	87.4	Confident	157 Å²	157	35.6 Å²	35.6	73%	0.734	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.2	-174.3	-53.3	-56.4	160.3	0	0	114	K741	E557-K741 IonicContact OE1-NZ 2.7Å; E557-K741 PolarHBondContact OE1-NZ 3.17Å; E557-K741 IonicContact OE2-NZ 2.62Å; E557-K741 PolarHBondContact OE2-NZ 2.93Å
558	D	85.2	Confident	88.7	Confident	117 Å²	117	39.3 Å²	39.3	63%	0.626	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-22.8	177.7	74.8	-54.4	0	0	0	113.3	R553 D556	R553-D558 IonicContact CZ-OD1 3.02Å; R553-D558 IonicContact CZ-OD2 3.29Å; R553-D558 IonicContact NH1-OD1 3.11Å; R553-D558 PolarHBondContact NH1-OD1 3.48Å; R553-D558 IonicContact NH1-OD2 3.84Å; R553-D558 PolarHBondContact NH1-OD2 3.31Å; R553-D558 IonicContact NH2-OD1 3.21Å; R553-D558 IonicContact NH2-OD2 2.71Å; R553-D558 PolarHBondContact NH2-OD2 2.78Å; D556-D558 VanDerWaalsContact C-N 3.28Å; D556-D558 VanDerWaalsContact CB-OD1 3.23Å; D556-D558 WeakPolarHBondContact CB-OD1 3.11Å; D556-D558 PolarHBondContact O-N 3.12Å
559	F	87.3	Confident	89.7	Confident	22 Å²	22	38.7 Å²	38.7	10%	0.096	18%	0.182	C	C	.	.			trans	-82.6	140.3	-178.8	-169.1	-92.7	0	0	0	111.3	I554 D556 L561 E565 Y569 K737	I554-F559 HydrophobicContact CB-CD1 4.28Å; I554-F559 HydrophobicContact CB-CE1 4.21Å; I554-F559 HydrophobicContact CG2-CD1 4.35Å; I554-F559 HydrophobicContact CG2-CE1 3.86Å; I554-F559 HydrophobicContact CG2-CZ 4.28Å; D556-F559 PolarHBondContact O-N 3.06Å; F559-L561 HydrophobicContact CD1-CB 4.28Å; F559-L561 HydrophobicContact CE1-CB 4.18Å; F559-L561 HydrophobicContact CE1-CD1 4.17Å; F559-E565 HydrophobicContact CZ-CB 4.27Å; F559-E565 HydrophobicContact CZ-CG 4.29Å; F559-Y569 WeakPolarHBondContact CE2-OH 3.25Å; F559-Y569 AromaticContact CZ-CE2 3.97Å; F559-Y569 HydrophobicContact CZ-CE2 3.97Å; F559-Y569 VanDerWaalsContact CZ-OH 3.32Å; F559-Y569 WeakPolarHBondContact CZ-OH 3.47Å; F559-K737 WeakPolarHBondContact O-CE 3.16Å; F559-K737 PolarHBondContact O-NZ 3.47Å
560	E	88.9	Confident	90.3	Very high	109 Å²	109	38.1 Å²	38.1	51%	0.509	18%	0.18	S	C	.	.			trans	-110.1	100.4	172.6	-172	147.1	97.1	0	0	111.6	T562 K734	E560-T562 HydrophobicContact CG-CG2 4.09Å; E560-T562 PolarHBondContact O-N 2.87Å; E560-K734 HydrophobicContact CG-CD 4.27Å; E560-K734 HydrophobicContact CG-CG 4.24Å; E560-K734 WeakPolarHBondContact OE2-CD 3.34Å; E560-K734 VanDerWaalsContact OE2-CE 3.26Å; E560-K734 WeakPolarHBondContact OE2-CE 3.35Å; E560-K734 IonicContact OE2-NZ 3.67Å; E560-K734 PolarHBondContact OE2-NZ 3.18Å
561	L	91.3	Very high	90.8	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	19%	0.193	C	C	.	.			trans	-75.8	123.5	177.2	-174.7	63.2	0	0	0	110.3	I554 F559 V566 L735	I554-L561 HydrophobicContact CB-CD1 4.22Å; I554-L561 HydrophobicContact CB-CD2 4.39Å; I554-L561 HydrophobicContact CD1-CD2 4.32Å; I554-L561 HydrophobicContact CG2-CD1 4.18Å; F559-L561 HydrophobicContact CD1-CB 4.28Å; F559-L561 HydrophobicContact CE1-CB 4.18Å; F559-L561 HydrophobicContact CE1-CD1 4.17Å; L561-V566 HydrophobicContact CD1-CG2 3.84Å; L561-L735 HydrophobicContact CD2-CB 4.35Å; L561-L735 HydrophobicContact CG-CB 4.21Å; L561-L735 HydrophobicContact CG-CD1 4.27Å; L561-L735 PolarHBondContact O-N 2.91Å
562	T	92.9	Very high	91.1	Very high	13 Å²	13	41.6 Å²	41.6	8%	0.08	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-140.1	162.1	177.8	63	0	0	0	0	109	E560 R564 E565 V566 T733	E560-T562 HydrophobicContact CG-CG2 4.09Å; E560-T562 PolarHBondContact O-N 2.87Å; T562-R564 PolarHBondContact O-N 2.84Å; T562-R564 VanDerWaalsContact O-N 3.11Å; T562-E565 PolarHBondContact O-N 3.15Å; T562-E565 PolarHBondContact OG1-N 3.18Å; T562-V566 PolarHBondContact O-N 3.31Å; T562-V566 VanDerWaalsContact O-N 3.1Å; T562-T733 WeakPolarHBondContact CG2-O 3.26Å
563	E	93.3	Very high	91.8	Very high	10 Å²	10	39.7 Å²	39.7	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-54.4	-31.7	174.7	-166.7	-179.6	144.4	0	0	112.2	V566 I567 L659 S693 W722 M730 T732	E563-V566 PolarHBondContact O-N 2.81Å; E563-I567 HydrophobicContact CG-CD1 4.49Å; E563-I567 WeakPolarHBondContact O-CG1 3.29Å; E563-I567 PolarHBondContact O-N 2.76Å; E563-L659 HydrophobicContact CB-CD2 4.49Å; E563-L659 HydrophobicContact CG-CD2 3.98Å; E563-S693 VanDerWaalsContact OE1-CB 3.31Å; E563-S693 WeakPolarHBondContact OE1-CB 3.41Å; E563-S693 PolarHBondContact OE1-OG 2.82Å; E563-S693 WeakPolarHBondContact OE2-CB 3.03Å; E563-S693 PolarHBondContact OE2-N 2.75Å; E563-W722 HydrophobicContact CG-CZ2 4.19Å; E563-W722 PolarHBondContact OE1-NE1 3.02Å; E563-M730 HydrophobicContact CB-CE 4.46Å; E563-M730 HydrophobicContact CG-CE 4.05Å; E563-M730 WeakPolarHBondContact OE1-CE 3.08Å; E563-T732 HydrophobicContact CB-CG2 4.11Å
564	R	92.9	Very high	92.5	Very high	71 Å²	71	38.4 Å²	38.4	27%	0.268	18%	0.184	S	C	.	.	H	α-helix	trans	-61.4	-43.6	174.6	176.7	-172.9	-63.3	-159.4	-5.1	112.6	T562 K568 T727 N728 M730 T732	T562-R564 PolarHBondContact O-N 2.84Å; T562-R564 VanDerWaalsContact O-N 3.11Å; R564-K568 WeakPolarHBondContact O-CG 3.26Å; R564-K568 PolarHBondContact O-N 3.18Å; R564-T727 PolarHBondContact NE-O 3.06Å; R564-T727 PolarHBondContact NH2-O 2.83Å; R564-N728 PolarHBondContact NH2-O 2.81Å; R564-M730 PolarHBondContact NH2-O 2.96Å; R564-T732 HydrophobicContact CB-CG2 3.93Å
565	E	92.8	Very high	92.9	Very high	37 Å²	37	41 Å²	41	17%	0.173	20%	0.198	C	C	.	.	H	α-helix	trans	-72.6	-35.7	177.2	-57	-45	111	0	0	110.9	F559 T562 I567 K568 Y569	F559-E565 HydrophobicContact CZ-CB 4.27Å; F559-E565 HydrophobicContact CZ-CG 4.29Å; T562-E565 PolarHBondContact O-N 3.15Å; T562-E565 PolarHBondContact OG1-N 3.18Å; E565-I567 PolarHBondContact O-N 2.79Å; E565-K568 WeakPolarHBondContact O-CB 3.45Å; E565-K568 PolarHBondContact O-N 2.86Å; E565-K568 WeakPolarHBondContact OE1-CE 3.32Å; E565-K568 IonicContact OE1-NZ 2.67Å; E565-K568 PolarHBondContact OE1-NZ 3.33Å; E565-K568 VanDerWaalsContact OE2-CD 3.27Å; E565-K568 WeakPolarHBondContact OE2-CD 3.33Å; E565-K568 IonicContact OE2-NZ 2.72Å; E565-K568 PolarHBondContact OE2-NZ 2.71Å; E565-Y569 HydrophobicContact CB-CE2 4.23Å; E565-Y569 WeakPolarHBondContact O-CD2 3.3Å; E565-Y569 PolarHBondContact O-N 2.82Å
566	V	95.4	Very high	93.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-43.8	173	-178.7	0	0	0	0	111.3	L561 T562 E563 K568 Y569 M570 L658 L659 W722 L735	L561-V566 HydrophobicContact CD1-CG2 3.84Å; T562-V566 PolarHBondContact O-N 3.31Å; T562-V566 VanDerWaalsContact O-N 3.1Å; E563-V566 PolarHBondContact O-N 2.81Å; V566-K568 VanDerWaalsContact C-N 3.32Å; V566-K568 PolarHBondContact O-N 2.89Å; V566-Y569 PolarHBondContact O-N 3.47Å; V566-Y569 VanDerWaalsContact O-N 3.11Å; V566-M570 HydrophobicContact CG1-CG 4.05Å; V566-M570 WeakPolarHBondContact O-CG 3.39Å; V566-M570 PolarHBondContact O-N 3.22Å; V566-L658 HydrophobicContact CG1-CB 3.68Å; V566-L658 HydrophobicContact CG1-CD1 4.22Å; V566-L658 HydrophobicContact CG2-CB 4.11Å; V566-L659 HydrophobicContact CB-CD2 3.93Å; V566-L659 HydrophobicContact CG1-CD2 3.81Å; V566-L659 HydrophobicContact CG1-CG 4.14Å; V566-L659 HydrophobicContact CG2-CD2 4.02Å; V566-W722 HydrophobicContact CG1-CH2 4.02Å; V566-W722 HydrophobicContact CG1-CZ2 4.4Å; V566-L735 HydrophobicContact CG2-CD1 4.15Å
567	I	96.1	Very high	93.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.9	-44.9	173.5	-71.2	162.9	0	0	0	111.3	E563 E565 Y569 M570 L571 W722 L723 T727 M730	E563-I567 HydrophobicContact CG-CD1 4.49Å; E563-I567 WeakPolarHBondContact O-CG1 3.29Å; E563-I567 PolarHBondContact O-N 2.76Å; E565-I567 PolarHBondContact O-N 2.79Å; I567-Y569 VanDerWaalsContact C-N 3.33Å; I567-Y569 PolarHBondContact O-N 3.13Å; I567-M570 PolarHBondContact O-N 3.17Å; I567-L571 HydrophobicContact CG2-CD1 3.94Å; I567-L571 HydrophobicContact CG2-CG 4.45Å; I567-L571 WeakPolarHBondContact O-CB 3.31Å; I567-L571 VanDerWaalsContact O-CG 3.31Å; I567-L571 WeakPolarHBondContact O-CG 3.26Å; I567-L571 PolarHBondContact O-N 2.7Å; I567-W722 HydrophobicContact CD1-CZ2 4.41Å; I567-W722 HydrophobicContact CG1-CD2 4.13Å; I567-W722 HydrophobicContact CG1-CH2 4.17Å; I567-W722 HydrophobicContact CG1-CZ2 3.59Å; I567-L723 HydrophobicContact CB-CD2 4.39Å; I567-L723 HydrophobicContact CG1-CD2 4.3Å; I567-L723 HydrophobicContact CG2-CD2 3.98Å; I567-T727 HydrophobicContact CB-CG2 4.45Å; I567-T727 HydrophobicContact CD1-CG2 4.44Å; I567-T727 HydrophobicContact CG2-CG2 3.84Å; I567-M730 HydrophobicContact CD1-CE 3.95Å; I567-M730 HydrophobicContact CD1-SD 3.7Å
568	K	94.7	Very high	94.4	Very high	88 Å²	88	29.6 Å²	29.6	38%	0.383	14%	0.142	S	C	.	.	H	α-helix	trans	-63.1	-34.9	176.8	-68.6	169.8	-179.1	168.7	0	113.2	R564 E565 V566 Q572	R564-K568 WeakPolarHBondContact O-CG 3.26Å; R564-K568 PolarHBondContact O-N 3.18Å; E565-K568 WeakPolarHBondContact O-CB 3.45Å; E565-K568 PolarHBondContact O-N 2.86Å; E565-K568 WeakPolarHBondContact OE1-CE 3.32Å; E565-K568 IonicContact OE1-NZ 2.67Å; E565-K568 PolarHBondContact OE1-NZ 3.33Å; E565-K568 VanDerWaalsContact OE2-CD 3.27Å; E565-K568 WeakPolarHBondContact OE2-CD 3.33Å; E565-K568 IonicContact OE2-NZ 2.72Å; E565-K568 PolarHBondContact OE2-NZ 2.71Å; V566-K568 VanDerWaalsContact C-N 3.32Å; V566-K568 PolarHBondContact O-N 2.89Å; K568-Q572 WeakPolarHBondContact O-CG 3.34Å; K568-Q572 PolarHBondContact O-N 2.87Å; K568-Q572 PolarHBondContact O-NE2 2.88Å
569	Y	96.6	Very high	94.8	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-74.1	-46.2	175.6	-68.1	-53.5	0	0	0	111.8	L550 I554 F559 E565 V566 I567 L571 Q572 I573 G602 I605	L550-Y569 HydrophobicContact CD1-CD1 3.58Å; L550-Y569 HydrophobicContact CD1-CD2 3.96Å; L550-Y569 HydrophobicContact CD1-CE1 3.37Å; L550-Y569 HydrophobicContact CD1-CE2 3.76Å; L550-Y569 HydrophobicContact CD1-CG 3.89Å; L550-Y569 VanDerWaalsContact CD1-CZ 3.47Å; L550-Y569 HydrophobicContact CD2-CD1 4.05Å; L550-Y569 HydrophobicContact CD2-CG 4.01Å; L550-Y569 HydrophobicContact CG-CD1 4.49Å; I554-Y569 HydrophobicContact CG2-CE2 3.96Å; F559-Y569 WeakPolarHBondContact CE2-OH 3.25Å; F559-Y569 AromaticContact CZ-CE2 3.97Å; F559-Y569 HydrophobicContact CZ-CE2 3.97Å; F559-Y569 VanDerWaalsContact CZ-OH 3.32Å; F559-Y569 WeakPolarHBondContact CZ-OH 3.47Å; E565-Y569 HydrophobicContact CB-CE2 4.23Å; E565-Y569 WeakPolarHBondContact O-CD2 3.3Å; E565-Y569 PolarHBondContact O-N 2.82Å; V566-Y569 PolarHBondContact O-N 3.47Å; V566-Y569 VanDerWaalsContact O-N 3.11Å; I567-Y569 VanDerWaalsContact C-N 3.33Å; I567-Y569 PolarHBondContact O-N 3.13Å; Y569-L571 VanDerWaalsContact C-N 3.34Å; Y569-L571 PolarHBondContact O-N 2.93Å; Y569-Q572 PolarHBondContact O-N 3.45Å; Y569-Q572 VanDerWaalsContact O-N 3.08Å; Y569-I573 WeakPolarHBondContact O-CD1 3.28Å; Y569-I573 VanDerWaalsContact O-CG1 3.32Å; Y569-I573 WeakPolarHBondContact O-CG1 3.28Å; Y569-I573 PolarHBondContact O-N 3Å; Y569-G602 WeakPolarHBondContact CE1-O 3.28Å; Y569-G602 PolarHBondContact OH-O 2.96Å; Y569-I605 HydrophobicContact CD1-CG2 3.83Å; Y569-I605 HydrophobicContact CE1-CG2 3.89Å
570	M	98.1	Very high	95.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.5	-43.1	177.6	-67.1	-50.9	-59.4	0	0	111.6	V566 I567 Q572 I573 I574 I651 I654 C655 L658 F699 W722 L723	V566-M570 HydrophobicContact CG1-CG 4.05Å; V566-M570 WeakPolarHBondContact O-CG 3.39Å; V566-M570 PolarHBondContact O-N 3.22Å; I567-M570 PolarHBondContact O-N 3.17Å; M570-Q572 VanDerWaalsContact C-N 3.31Å; M570-Q572 PolarHBondContact O-N 3.05Å; M570-I573 PolarHBondContact O-N 3.41Å; M570-I573 HydrophobicContact SD-CD1 4.18Å; M570-I574 HydrophobicContact CB-CD1 4.24Å; M570-I574 HydrophobicContact CE-CD1 4.3Å; M570-I574 VanDerWaalsContact O-CB 3.3Å; M570-I574 WeakPolarHBondContact O-CB 3.43Å; M570-I574 VanDerWaalsContact O-CD1 3.29Å; M570-I574 WeakPolarHBondContact O-CD1 3.4Å; M570-I574 WeakPolarHBondContact O-CG1 3.49Å; M570-I574 PolarHBondContact O-N 3.45Å; M570-I651 HydrophobicContact CE-CG2 3.5Å; M570-I651 VanDerWaalsContact CE-CG2 3.5Å; M570-I651 WeakPolarHBondContact CE-O 3.49Å; M570-I654 HydrophobicContact SD-CG2 4.19Å; M570-C655 HydrophobicContact CE-CB 3.74Å; M570-C655 HydrophobicContact SD-CB 3.99Å; M570-L658 HydrophobicContact SD-CD1 3.8Å; M570-F699 HydrophobicContact CE-CE1 4.43Å; M570-W722 HydrophobicContact CB-CZ3 4.27Å; M570-W722 HydrophobicContact CG-CH2 3.97Å; M570-W722 HydrophobicContact CG-CZ3 4.02Å; M570-L723 HydrophobicContact CB-CD2 4.22Å
571	L	97.1	Very high	95.2	Very high	54 Å²	54	21 Å²	21	28%	0.283	10%	0.098	S	C	.	.	H	α-helix	trans	-55.4	-43.5	173.4	-78.4	169	0	0	0	112.5	I567 Y569 D575 F718 L723	I567-L571 HydrophobicContact CG2-CD1 3.94Å; I567-L571 HydrophobicContact CG2-CG 4.45Å; I567-L571 WeakPolarHBondContact O-CB 3.31Å; I567-L571 VanDerWaalsContact O-CG 3.31Å; I567-L571 WeakPolarHBondContact O-CG 3.26Å; I567-L571 PolarHBondContact O-N 2.7Å; Y569-L571 VanDerWaalsContact C-N 3.34Å; Y569-L571 PolarHBondContact O-N 2.93Å; L571-D575 WeakPolarHBondContact O-CB 3.49Å; L571-D575 PolarHBondContact O-N 2.84Å; L571-F718 HydrophobicContact CD2-CD1 3.85Å; L571-F718 HydrophobicContact CD2-CE1 3.94Å; L571-L723 HydrophobicContact CD2-CB 4.1Å; L571-L723 HydrophobicContact CD2-CD1 4.4Å; L571-L723 HydrophobicContact CG-CD2 4.38Å
572	Q	97.4	Very high	94.8	Very high	24 Å²	24	27.7 Å²	27.7	11%	0.112	13%	0.126	C	C	.	.	H	α-helix	trans	-72	-36.8	180	-69.4	-178.6	83.8	0	0	113.2	K524 K568 Y569 M570 G576 S603 I605	K524-Q572 HydrophobicContact CD-CB 4.19Å; K524-Q572 HydrophobicContact CD-CG 4.27Å; K568-Q572 WeakPolarHBondContact O-CG 3.34Å; K568-Q572 PolarHBondContact O-N 2.87Å; K568-Q572 PolarHBondContact O-NE2 2.88Å; Y569-Q572 PolarHBondContact O-N 3.45Å; Y569-Q572 VanDerWaalsContact O-N 3.08Å; M570-Q572 VanDerWaalsContact C-N 3.31Å; M570-Q572 PolarHBondContact O-N 3.05Å; Q572-G576 PolarHBondContact O-N 2.99Å; Q572-G576 VanDerWaalsContact O-N 3.14Å; Q572-S603 PolarHBondContact NE2-O 3.4Å; Q572-S603 VanDerWaalsContact NE2-O 3.15Å; Q572-I605 HydrophobicContact CB-CD1 3.68Å; Q572-I605 HydrophobicContact CB-CG1 3.7Å
573	I	98.3	Very high	94.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-49.4	175.8	-65.9	160	0	0	0	109.8	Y569 M570 D575 G576 V577 L590 I595 I605 I654	Y569-I573 WeakPolarHBondContact O-CD1 3.28Å; Y569-I573 VanDerWaalsContact O-CG1 3.32Å; Y569-I573 WeakPolarHBondContact O-CG1 3.28Å; Y569-I573 PolarHBondContact O-N 3Å; M570-I573 PolarHBondContact O-N 3.41Å; M570-I573 HydrophobicContact SD-CD1 4.18Å; I573-D575 VanDerWaalsContact C-N 3.3Å; I573-D575 PolarHBondContact O-N 2.89Å; I573-G576 PolarHBondContact O-N 2.99Å; I573-V577 WeakPolarHBondContact O-CG2 3.38Å; I573-V577 PolarHBondContact O-N 3.12Å; I573-L590 HydrophobicContact CG2-CD2 4.2Å; I573-I595 HydrophobicContact CD1-CD1 3.88Å; I573-I595 HydrophobicContact CG1-CD1 4.24Å; I573-I605 HydrophobicContact CG1-CD1 4.08Å; I573-I654 HydrophobicContact CD1-CG2 4.12Å
574	I	98.1	Very high	94	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.6	-34.6	-179.3	-63.8	161.7	0	0	0	110.6	M570 V577 N578 I651 F699 C714 C717 F718 L723	M570-I574 HydrophobicContact CB-CD1 4.24Å; M570-I574 HydrophobicContact CE-CD1 4.3Å; M570-I574 VanDerWaalsContact O-CB 3.3Å; M570-I574 WeakPolarHBondContact O-CB 3.43Å; M570-I574 VanDerWaalsContact O-CD1 3.29Å; M570-I574 WeakPolarHBondContact O-CD1 3.4Å; M570-I574 WeakPolarHBondContact O-CG1 3.49Å; M570-I574 PolarHBondContact O-N 3.45Å; I574-V577 PolarHBondContact O-N 2.56Å; I574-N578 WeakPolarHBondContact O-CB 3.34Å; I574-N578 PolarHBondContact O-N 3.33Å; I574-I651 HydrophobicContact CD1-CG2 4.28Å; I574-I651 HydrophobicContact CG1-CD1 4.27Å; I574-I651 HydrophobicContact CG1-CG2 3.97Å; I574-F699 HydrophobicContact CD1-CZ 3.83Å; I574-C714 HydrophobicContact CG2-CB 3.74Å; I574-C717 HydrophobicContact CD1-CB 4.11Å; I574-C717 HydrophobicContact CG2-CB 4.08Å; I574-F718 HydrophobicContact CB-CZ 4.26Å; I574-F718 HydrophobicContact CG2-CD2 4.38Å; I574-F718 HydrophobicContact CG2-CE1 4.27Å; I574-F718 HydrophobicContact CG2-CE2 3.75Å; I574-F718 HydrophobicContact CG2-CZ 3.7Å; I574-L723 HydrophobicContact CD1-CD1 3.52Å
575	D	97.3	Very high	93.8	Very high	55 Å²	55	28.1 Å²	28.1	29%	0.294	14%	0.137	S	C	.	.	H	α-helix	trans	-65.1	-43.3	173.8	-173.9	49.7	0	0	0	112.6	H522 L571 I573 F579 F718	H522-D575 IonicContact CE1-OD2 2.7Å; H522-D575 PolarHBondContact CE1-OD2 2.92Å; H522-D575 VanDerWaalsContact CE1-OD2 3.29Å; H522-D575 IonicContact NE2-OD2 2.64Å; L571-D575 WeakPolarHBondContact O-CB 3.49Å; L571-D575 PolarHBondContact O-N 2.84Å; I573-D575 VanDerWaalsContact C-N 3.3Å; I573-D575 PolarHBondContact O-N 2.89Å; D575-F579 PolarHBondContact O-N 2.72Å; D575-F579 VanDerWaalsContact O-N 3.14Å; D575-F718 HydrophobicContact CB-CZ 4.08Å
576	G	96.4	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-51.3	170.6	0	0	0	0	0	112.8	Q572 I573 F579 I580	Q572-G576 PolarHBondContact O-N 2.99Å; Q572-G576 VanDerWaalsContact O-N 3.14Å; I573-G576 PolarHBondContact O-N 2.99Å; G576-F579 WeakPolarHBondContact O-CB 3.48Å; G576-F579 PolarHBondContact O-N 2.95Å; G576-I580 WeakPolarHBondContact O-CG1 3.49Å; G576-I580 PolarHBondContact O-N 2.89Å
577	V	97.1	Very high	93.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68	-38.4	-178.4	178.3	0	0	0	0	112.2	I573 I574 F579 I580 H581 L590 L607 D647 I651	I573-V577 WeakPolarHBondContact O-CG2 3.38Å; I573-V577 PolarHBondContact O-N 3.12Å; I574-V577 PolarHBondContact O-N 2.56Å; V577-F579 VanDerWaalsContact C-N 3.26Å; V577-F579 PolarHBondContact O-N 3.37Å; V577-I580 WeakPolarHBondContact O-CB 3.44Å; V577-I580 PolarHBondContact O-N 2.66Å; V577-I580 VanDerWaalsContact O-N 3.1Å; V577-H581 VanDerWaalsContact CG1-CE1 3.42Å; V577-H581 WeakPolarHBondContact CG1-CE1 3.46Å; V577-H581 VanDerWaalsContact CG1-NE2 3.33Å; V577-H581 WeakPolarHBondContact CG1-NE2 3.37Å; V577-H581 PolarHBondContact O-CD2 3.48Å; V577-H581 PolarHBondContact O-N 2.94Å; V577-L590 HydrophobicContact CG2-CD1 4.22Å; V577-L590 HydrophobicContact CG2-CD2 4.1Å; V577-L607 HydrophobicContact CG2-CD1 3.94Å; V577-D647 HydrophobicContact CG1-CB 4.13Å; V577-I651 HydrophobicContact CB-CD1 4.19Å; V577-I651 HydrophobicContact CG1-CD1 4.11Å; V577-I651 HydrophobicContact CG2-CD1 4.2Å
578	N	94.6	Very high	92.9	Very high	14 Å²	14	27.9 Å²	27.9	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-57.4	-37.5	173	-179.1	40.5	0	0	0	112.3	I574 K582 C714 F718	I574-N578 WeakPolarHBondContact O-CB 3.34Å; I574-N578 PolarHBondContact O-N 3.33Å; N578-K582 PolarHBondContact ND2-NZ 2.81Å; N578-K582 WeakPolarHBondContact O-CB 3.35Å; N578-K582 WeakPolarHBondContact O-CD 3.49Å; N578-K582 VanDerWaalsContact O-CG 3.22Å; N578-K582 WeakPolarHBondContact O-CG 3.38Å; N578-K582 PolarHBondContact O-N 2.89Å; N578-K582 VanDerWaalsContact O-N 3.17Å; N578-K582 WeakPolarHBondContact OD1-CE 3.33Å; N578-K582 PolarHBondContact OD1-NZ 3.22Å; N578-C714 HydrophobicContact CB-CB 3.66Å; N578-F718 HydrophobicContact CB-CE2 4.08Å; N578-F718 WeakPolarHBondContact ND2-CE2 3.41Å
579	F	94.9	Very high	92.5	Very high	46 Å²	46	24.9 Å²	24.9	20%	0.202	13%	0.125	C	C	.	.	H	α-helix	trans	-67.4	-46.7	173.5	-169.2	-87.7	0	0	0	111.4	L520 H521 H522 L525 D575 G576 V577 H581 K582 Q583	L520-F579 HydrophobicContact CD2-CD1 4.22Å; L520-F579 HydrophobicContact CD2-CE1 4.44Å; H521-F579 WeakPolarHBondContact O-CZ 3.41Å; H522-F579 HydrophobicContact CB-CD1 3.9Å; H522-F579 HydrophobicContact CB-CD2 4.33Å; H522-F579 HydrophobicContact CB-CE1 4.17Å; H522-F579 HydrophobicContact CB-CG 3.98Å; H522-F579 HydrophobicContact CB-CZ 4.49Å; H522-F579 AromaticContact CD2-CD2 3.34Å; H522-F579 WeakPolarHBondContact CD2-CD2 3.45Å; H522-F579 AromaticContact CD2-CE2 3.88Å; H522-F579 AromaticContact CD2-CG 3.63Å; H522-F579 AromaticContact CG-CD2 3.92Å; H522-F579 AromaticContact CG-CG 3.73Å; H522-F579 AromaticContact NE2-CD2 3.9Å; L525-F579 HydrophobicContact CD1-CD1 4.17Å; D575-F579 PolarHBondContact O-N 2.72Å; D575-F579 VanDerWaalsContact O-N 3.14Å; G576-F579 WeakPolarHBondContact O-CB 3.48Å; G576-F579 PolarHBondContact O-N 2.95Å; V577-F579 VanDerWaalsContact C-N 3.26Å; V577-F579 PolarHBondContact O-N 3.37Å; F579-H581 VanDerWaalsContact C-N 3.35Å; F579-H581 PolarHBondContact O-N 3.04Å; F579-K582 PolarHBondContact O-N 2.68Å; F579-Q583 HydrophobicContact CD1-CG 4.18Å; F579-Q583 HydrophobicContact CE1-CG 3.86Å; F579-Q583 HydrophobicContact CZ-CG 4.47Å; F579-Q583 WeakPolarHBondContact O-CG 3.45Å; F579-Q583 PolarHBondContact O-N 2.76Å
580	I	94.2	Very high	92.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-55.9	-48.8	177	-63	169.9	0	0	0	110.7	L520 L525 G576 V577 K582 Q583 I585 L607 F610	L520-I580 HydrophobicContact CD1-CG1 4.16Å; L520-I580 HydrophobicContact CD2-CB 4.27Å; L520-I580 HydrophobicContact CD2-CG1 3.8Å; L520-I580 HydrophobicContact CD2-CG2 4.49Å; L525-I580 HydrophobicContact CD1-CD1 4.3Å; L525-I580 HydrophobicContact CD1-CG1 3.82Å; L525-I580 HydrophobicContact CD2-CD1 3.9Å; L525-I580 HydrophobicContact CD2-CG1 4.28Å; G576-I580 WeakPolarHBondContact O-CG1 3.49Å; G576-I580 PolarHBondContact O-N 2.89Å; V577-I580 WeakPolarHBondContact O-CB 3.44Å; V577-I580 PolarHBondContact O-N 2.66Å; V577-I580 VanDerWaalsContact O-N 3.1Å; I580-K582 PolarHBondContact O-N 3.45Å; I580-Q583 PolarHBondContact O-N 3.01Å; I580-Q583 VanDerWaalsContact O-N 3.07Å; I580-I585 CarbonylContact C-O 3.57Å; I580-I585 HydrophobicContact CG2-CB 3.64Å; I580-I585 HydrophobicContact CG2-CG2 3.47Å; I580-I585 VanDerWaalsContact CG2-CG2 3.47Å; I580-I585 PolarHBondContact O-N 3.48Å; I580-L607 HydrophobicContact CD1-CD1 4.44Å; I580-F610 HydrophobicContact CD1-CD1 4.49Å; I580-F610 HydrophobicContact CD1-CE1 3.98Å
581	H	89.8	Confident	91.7	Very high	22 Å²	22	26.4 Å²	26.4	10%	0.102	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-40.9	179.1	-68.2	-177.7	0	0	0	112.5	V577 F579 Q583 G584 I585 Y644 D647	V577-H581 VanDerWaalsContact CG1-CE1 3.42Å; V577-H581 WeakPolarHBondContact CG1-CE1 3.46Å; V577-H581 VanDerWaalsContact CG1-NE2 3.33Å; V577-H581 WeakPolarHBondContact CG1-NE2 3.37Å; V577-H581 PolarHBondContact O-CD2 3.48Å; V577-H581 PolarHBondContact O-N 2.94Å; F579-H581 VanDerWaalsContact C-N 3.35Å; F579-H581 PolarHBondContact O-N 3.04Å; H581-Q583 PolarHBondContact O-N 2.84Å; H581-G584 PolarHBondContact O-N 3.18Å; H581-I585 WeakPolarHBondContact CA-O 3.45Å; H581-I585 PolarHBondContact CD2-O 3.4Å; H581-Y644 HydrophobicContact CB-CD1 3.75Å; H581-Y644 HydrophobicContact CB-CE1 4.09Å; H581-Y644 HydrophobicContact CB-CG 4.37Å; H581-Y644 AromaticContact CD2-CD1 3.58Å; H581-Y644 PolarHBondContact CE1-O 3.17Å; H581-Y644 VanDerWaalsContact CE1-O 3.23Å; H581-Y644 AromaticContact CG-CD1 3.56Å; H581-D647 IonicContact CD2-OD2 3.75Å; H581-D647 IonicContact CE1-OD2 3.18Å; H581-D647 IonicContact NE2-OD2 2.71Å; H581-D647 PolarHBondContact NE2-OD2 2.64Å
582	K	83.8	Confident	91.2	Very high	142 Å²	142	24 Å²	24	62%	0.617	12%	0.119	S	C	*	.	H	α-helix	trans	-63.5	-23.5	175.5	-75.7	165.2	-179.3	164.8	0	113.9	N578 F579 I580 G584	N578-K582 PolarHBondContact ND2-NZ 2.81Å; N578-K582 WeakPolarHBondContact O-CB 3.35Å; N578-K582 WeakPolarHBondContact O-CD 3.49Å; N578-K582 VanDerWaalsContact O-CG 3.22Å; N578-K582 WeakPolarHBondContact O-CG 3.38Å; N578-K582 PolarHBondContact O-N 2.89Å; N578-K582 VanDerWaalsContact O-N 3.17Å; N578-K582 WeakPolarHBondContact OD1-CE 3.33Å; N578-K582 PolarHBondContact OD1-NZ 3.22Å; F579-K582 PolarHBondContact O-N 2.68Å; I580-K582 PolarHBondContact O-N 3.45Å; K582-G584 VanDerWaalsContact C-N 3.27Å
583	Q	86.6	Confident	90.4	Very high	79 Å²	79	23.9 Å²	23.9	37%	0.369	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7.8	174.3	-59	-60.4	-15.9	0	0	113.3	L520 F579 I580 H581 I585 R615	L520-Q583 HydrophobicContact CD2-CB 4.49Å; L520-Q583 HydrophobicContact CD2-CG 4.3Å; F579-Q583 HydrophobicContact CD1-CG 4.18Å; F579-Q583 HydrophobicContact CE1-CG 3.86Å; F579-Q583 HydrophobicContact CZ-CG 4.47Å; F579-Q583 WeakPolarHBondContact O-CG 3.45Å; F579-Q583 PolarHBondContact O-N 2.76Å; I580-Q583 PolarHBondContact O-N 3.01Å; I580-Q583 VanDerWaalsContact O-N 3.07Å; H581-Q583 PolarHBondContact O-N 2.84Å; Q583-I585 VanDerWaalsContact C-N 3.32Å; Q583-I585 HydrophobicContact CB-CD1 3.92Å; Q583-I585 HydrophobicContact CB-CG1 4.41Å; Q583-R615 PolarHBondContact O-NH1 3.5Å
584	G	81.8	Confident	89.9	Confident	24 Å²	24	23.9 Å²	23.9	25%	0.247	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	20.6	-178.2	0	0	0	0	0	113.9	H581 K582 R615 L616 Y644	H581-G584 PolarHBondContact O-N 3.18Å; K582-G584 VanDerWaalsContact C-N 3.27Å; G584-R615 VanDerWaalsContact O-CA 3.28Å; G584-R615 WeakPolarHBondContact O-CA 3.47Å; G584-L616 PolarHBondContact O-N 3.29Å; G584-Y644 WeakPolarHBondContact CA-OH 3.38Å
585	I	88.1	Confident	89.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.3	-175.4	-62	160.3	0	0	0	109.6	I516 L520 I580 H581 Q583 A613 R614 R615	I516-I585 HydrophobicContact CG2-CD1 4.25Å; I516-I585 HydrophobicContact CG2-CG2 4.49Å; L520-I585 HydrophobicContact CD2-CD1 3.93Å; L520-I585 HydrophobicContact CG-CD1 4.28Å; I580-I585 CarbonylContact C-O 3.57Å; I580-I585 HydrophobicContact CG2-CB 3.64Å; I580-I585 HydrophobicContact CG2-CG2 3.47Å; I580-I585 VanDerWaalsContact CG2-CG2 3.47Å; I580-I585 PolarHBondContact O-N 3.48Å; H581-I585 WeakPolarHBondContact CA-O 3.45Å; H581-I585 PolarHBondContact CD2-O 3.4Å; Q583-I585 VanDerWaalsContact C-N 3.32Å; Q583-I585 HydrophobicContact CB-CD1 3.92Å; Q583-I585 HydrophobicContact CB-CG1 4.41Å; I585-A613 HydrophobicContact CG2-CB 4.2Å; I585-R614 CarbonylContact C-O 3.57Å; I585-R614 VanDerWaalsContact CA-O 3.28Å; I585-R614 WeakPolarHBondContact CA-O 3.34Å; I585-R614 WeakPolarHBondContact CG2-O 3.44Å; I585-R615 HydrophobicContact CG1-CG 3.75Å
586	V	88.1	Confident	89.2	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.7	168.9	62.4	0	0	0	0	108.8	L588 A613 R614 L616 I642 D647	V586-L588 HydrophobicContact CB-CD2 4.47Å; V586-L588 HydrophobicContact CB-CG 4.45Å; V586-L588 HydrophobicContact CG1-CD1 3.94Å; V586-L588 HydrophobicContact CG1-CD2 4.11Å; V586-L588 HydrophobicContact CG1-CG 3.9Å; V586-L588 HydrophobicContact CG2-CD2 3.59Å; V586-L588 HydrophobicContact CG2-CG 3.97Å; V586-A613 WeakPolarHBondContact O-CA 3.38Å; V586-A613 WeakPolarHBondContact O-CB 3.27Å; V586-R614 HydrophobicContact CG1-CG 3.84Å; V586-R614 PolarHBondContact N-O 2.98Å; V586-R614 PolarHBondContact O-N 3.24Å; V586-L616 HydrophobicContact CB-CD2 4.25Å; V586-L616 HydrophobicContact CB-CG 4.4Å; V586-L616 HydrophobicContact CG1-CD2 3.67Å; V586-L616 HydrophobicContact CG1-CG 4.13Å; V586-I642 HydrophobicContact CG1-CD1 4.12Å; V586-D647 WeakPolarHBondContact CG2-OD1 3.42Å; V586-D647 WeakPolarHBondContact CG2-OD2 3.19Å
587	H	91.6	Very high	88.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.			trans	-88.5	-41.6	-168.1	-170	-39.7	0	0	0	113.4	D589 D609 F610 D647	H587-D589 PolarHBondContact CE1-O 3Å; H587-D589 VanDerWaalsContact CE1-O 3.31Å; H587-D589 PolarHBondContact O-N 2.85Å; H587-D609 PolarHBondContact CE1-O 2.77Å; H587-F610 AromaticContact NE2-CE1 3.99Å; H587-D647 WeakPolarHBondContact CB-OD1 3.21Å; H587-D647 PolarHBondContact N-OD1 2.74Å; H587-D647 VanDerWaalsContact N-OD1 3.11Å; H587-D647 PolarHBondContact N-OD2 3.21Å
588	L	85.9	Confident	88	Confident	32 Å²	32	22 Å²	22	17%	0.168	11%	0.109	C	C	.	.	S	Bend	trans	61	-8.7	173.2	-54.5	175	0	0	0	118.1	V586 L612 R614 L622 I642 T646 D647	V586-L588 HydrophobicContact CB-CD2 4.47Å; V586-L588 HydrophobicContact CB-CG 4.45Å; V586-L588 HydrophobicContact CG1-CD1 3.94Å; V586-L588 HydrophobicContact CG1-CD2 4.11Å; V586-L588 HydrophobicContact CG1-CG 3.9Å; V586-L588 HydrophobicContact CG2-CD2 3.59Å; V586-L588 HydrophobicContact CG2-CG 3.97Å; L588-L612 HydrophobicContact CB-CB 4.26Å; L588-R614 HydrophobicContact CD1-CG 3.91Å; L588-L622 HydrophobicContact CD1-CD1 3.77Å; L588-I642 HydrophobicContact CD1-CD1 3.5Å; L588-I642 VanDerWaalsContact CD1-CD1 3.5Å; L588-I642 HydrophobicContact CD2-CB 4.49Å; L588-I642 HydrophobicContact CD2-CD1 3.58Å; L588-I642 HydrophobicContact CG-CD1 4.14Å; L588-T646 HydrophobicContact CD2-CG2 3.85Å; L588-D647 PolarHBondContact N-OD1 2.92Å
589	D	86.6	Confident	87.1	Confident	26 Å²	26	22.5 Å²	22.5	14%	0.139	11%	0.112	C	C	.	.			trans	-133.7	50.6	178	-165.8	47.8	0	0	0	110.3	H587 K591 N594 L612	H587-D589 PolarHBondContact CE1-O 3Å; H587-D589 VanDerWaalsContact CE1-O 3.31Å; H587-D589 PolarHBondContact O-N 2.85Å; D589-K591 PolarHBondContact O-N 2.94Å; D589-K591 WeakPolarHBondContact OD1-CD 3.31Å; D589-K591 WeakPolarHBondContact OD1-CE 3.38Å; D589-K591 IonicContact OD1-NZ 3.7Å; D589-K591 PolarHBondContact OD1-NZ 2.84Å; D589-K591 WeakPolarHBondContact OD2-CE 3.35Å; D589-K591 IonicContact OD2-NZ 3.59Å; D589-K591 PolarHBondContact OD2-NZ 2.95Å; D589-N594 PolarHBondContact O-ND2 3.22Å; D589-N594 PolarHBondContact OD2-ND2 3.01Å; D589-L612 HydrophobicContact CB-CB 4.16Å; D589-L612 HydrophobicContact CB-CD1 4.06Å; D589-L612 HydrophobicContact CB-CG 4.17Å
590	L	90.4	Very high	86.1	Confident	1 Å²	1	26 Å²	26	1%	0.005	13%	0.127	C	C	.	.			trans	-88.9	108.6	178.9	-168.8	76.1	0	0	0	110.1	I573 V577 L607 S650 I651 I654	I573-L590 HydrophobicContact CG2-CD2 4.2Å; V577-L590 HydrophobicContact CG2-CD1 4.22Å; V577-L590 HydrophobicContact CG2-CD2 4.1Å; L590-L607 HydrophobicContact CD1-CD1 3.94Å; L590-L607 HydrophobicContact CD1-CD2 4Å; L590-S650 WeakPolarHBondContact O-CB 3.21Å; L590-I651 HydrophobicContact CD2-CD1 4.2Å; L590-I651 HydrophobicContact CD2-CG1 3.36Å; L590-I654 HydrophobicContact CD2-CD1 3.88Å; L590-I654 HydrophobicContact CG-CD1 3.71Å
591	K	87.3	Confident	85.3	Confident	34 Å²	34	29.9 Å²	29.9	15%	0.148	15%	0.151	C	C	.	.			trans	-151.5	158.4	-172.3	58.2	-176.4	-175.5	-147.1	0	112.3	D589 E593 N594 F631	D589-K591 PolarHBondContact O-N 2.94Å; D589-K591 WeakPolarHBondContact OD1-CD 3.31Å; D589-K591 WeakPolarHBondContact OD1-CE 3.38Å; D589-K591 IonicContact OD1-NZ 3.7Å; D589-K591 PolarHBondContact OD1-NZ 2.84Å; D589-K591 WeakPolarHBondContact OD2-CE 3.35Å; D589-K591 IonicContact OD2-NZ 3.59Å; D589-K591 PolarHBondContact OD2-NZ 2.95Å; K591-E593 VanDerWaalsContact C-N 3.32Å; K591-E593 VanDerWaalsContact CD-CD 3.47Å; K591-E593 HydrophobicContact CD-CG 4.37Å; K591-E593 WeakPolarHBondContact CD-OE2 3.32Å; K591-E593 VanDerWaalsContact CE-CD 3.48Å; K591-E593 HydrophobicContact CG-CG 4.34Å; K591-E593 VanDerWaalsContact CG-OE2 3.23Å; K591-E593 WeakPolarHBondContact CG-OE2 3.5Å; K591-E593 PolarHBondContact O-N 2.98Å; K591-E593 VanDerWaalsContact O-N 3.12Å; K591-N594 WeakPolarHBondContact CE-OD1 3.35Å; K591-N594 HydrophobicContact CG-CB 4.23Å; K591-N594 WeakPolarHBondContact O-CB 3.29Å; K591-N594 PolarHBondContact O-N 3.12Å; K591-F631 HydrophobicContact CB-CD1 4.42Å; K591-F631 HydrophobicContact CB-CD2 4.19Å; K591-F631 HydrophobicContact CB-CG 4.15Å
592	P	87.9	Confident	84.6	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.019	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-48.1	-36.5	-174.2	-37.3	38.6	0	0	0	118.3	F551 N594 F631	F551-P592 HydrophobicContact CD1-CB 4.22Å; F551-P592 HydrophobicContact CD1-CG 4.48Å; F551-P592 HydrophobicContact CD2-CB 3.51Å; F551-P592 HydrophobicContact CD2-CG 4.25Å; F551-P592 HydrophobicContact CE1-CB 4.28Å; F551-P592 HydrophobicContact CE1-CG 4.12Å; F551-P592 HydrophobicContact CE2-CB 3.6Å; F551-P592 HydrophobicContact CE2-CG 3.87Å; F551-P592 HydrophobicContact CG-CB 3.84Å; F551-P592 HydrophobicContact CZ-CB 3.99Å; F551-P592 HydrophobicContact CZ-CG 3.79Å; P592-N594 VanDerWaalsContact C-N 3.31Å; P592-F631 VanDerWaalsContact CD-CE1 3.45Å; P592-F631 HydrophobicContact CG-CE1 4.07Å; P592-F631 HydrophobicContact CG-CE2 4.25Å; P592-F631 HydrophobicContact CG-CZ 3.52Å
593	E	80.4	Confident	84.5	Confident	22 Å²	22	25.3 Å²	25.3	10%	0.103	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-78.9	-15.9	179.1	68.3	-89	-121.3	0	0	113.1	E549 K591 I595 R747 K751 M765	E549-E593 VanDerWaalsContact OE1-CB 3.3Å; E549-E593 WeakPolarHBondContact OE1-CB 3.47Å; K591-E593 VanDerWaalsContact C-N 3.32Å; K591-E593 VanDerWaalsContact CD-CD 3.47Å; K591-E593 HydrophobicContact CD-CG 4.37Å; K591-E593 WeakPolarHBondContact CD-OE2 3.32Å; K591-E593 VanDerWaalsContact CE-CD 3.48Å; K591-E593 HydrophobicContact CG-CG 4.34Å; K591-E593 VanDerWaalsContact CG-OE2 3.23Å; K591-E593 WeakPolarHBondContact CG-OE2 3.5Å; K591-E593 PolarHBondContact O-N 2.98Å; K591-E593 VanDerWaalsContact O-N 3.12Å; E593-I595 PolarHBondContact O-N 3.11Å; E593-R747 IonicContact OE1-CZ 2.72Å; E593-R747 IonicContact OE1-NH1 3.08Å; E593-R747 PolarHBondContact OE1-NH1 2.88Å; E593-R747 IonicContact OE1-NH2 3.14Å; E593-R747 IonicContact OE2-CZ 3.76Å; E593-R747 IonicContact OE2-NH1 3.39Å; E593-R747 PolarHBondContact OE2-NH1 3.29Å; E593-R747 IonicContact OE2-NH2 2.74Å; E593-R747 PolarHBondContact OE2-NH2 3.13Å; E593-K751 IonicContact OE1-NZ 2.76Å; E593-K751 PolarHBondContact OE1-NZ 3.21Å; E593-M765 HydrophobicContact CG-CE 4.3Å
594	N	88.3	Confident	84.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-84.9	6	176.2	-64.2	15.3	0	0	0	111.4	D589 K591 P592 L607 I608 M765	D589-N594 PolarHBondContact O-ND2 3.22Å; D589-N594 PolarHBondContact OD2-ND2 3.01Å; K591-N594 WeakPolarHBondContact CE-OD1 3.35Å; K591-N594 HydrophobicContact CG-CB 4.23Å; K591-N594 WeakPolarHBondContact O-CB 3.29Å; K591-N594 PolarHBondContact O-N 3.12Å; P592-N594 VanDerWaalsContact C-N 3.31Å; N594-L607 CarbonylContact O-C 3.59Å; N594-L607 VanDerWaalsContact O-CA 3.31Å; N594-L607 WeakPolarHBondContact O-CA 3.13Å; N594-I608 WeakPolarHBondContact O-CG1 3.3Å; N594-I608 PolarHBondContact O-N 3.06Å; N594-M765 WeakPolarHBondContact OD1-CE 3.41Å
595	I	91.9	Very high	85.2	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105.9	-177.8	-49.6	170.8	0	0	0	109.4	L550 F551 I573 E593 I605 L607 I654	L550-I595 HydrophobicContact CB-CB 4.38Å; L550-I595 HydrophobicContact CB-CG2 3.91Å; L550-I595 HydrophobicContact CD2-CG2 3.77Å; L550-I595 HydrophobicContact CG-CG2 4.5Å; L550-I595 PolarHBondContact N-O 2.95Å; F551-I595 HydrophobicContact CE2-CD1 4.48Å; I573-I595 HydrophobicContact CD1-CD1 3.88Å; I573-I595 HydrophobicContact CG1-CD1 4.24Å; E593-I595 PolarHBondContact O-N 3.11Å; I595-I605 HydrophobicContact CG2-CB 4.1Å; I595-I605 HydrophobicContact CG2-CD1 4.24Å; I595-I605 HydrophobicContact CG2-CG1 4.26Å; I595-I605 HydrophobicContact CG2-CG2 4.4Å; I595-L607 HydrophobicContact CG1-CD2 3.87Å; I595-I654 HydrophobicContact CD1-CD1 4.11Å; I595-I654 HydrophobicContact CD1-CG2 4.33Å
596	M	87.4	Confident	85.5	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.015	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	145.7	178.2	-66.9	-167.3	75.6	0	0	112.2	I545 G548 I605 K606 I608 A758 I759	I545-M596 HydrophobicContact CG2-CB 3.68Å; I545-M596 HydrophobicContact CG2-CE 3.98Å; I545-M596 HydrophobicContact CG2-CG 4.5Å; I545-M596 HydrophobicContact CG2-SD 4.06Å; G548-M596 CarbonylContact O-C 3.58Å; G548-M596 VanDerWaalsContact O-CA 3.24Å; G548-M596 WeakPolarHBondContact O-CA 3.5Å; G548-M596 WeakPolarHBondContact O-CB 3.45Å; M596-I605 CarbonylContact O-C 3.56Å; M596-I605 WeakPolarHBondContact O-CA 3.22Å; M596-I605 WeakPolarHBondContact O-CB 3.26Å; M596-K606 PolarHBondContact N-O 3.46Å; M596-K606 PolarHBondContact O-N 2.99Å; M596-I608 HydrophobicContact CB-CG2 3.81Å; M596-I608 HydrophobicContact CG-CB 4.43Å; M596-I608 HydrophobicContact CG-CD1 3.86Å; M596-I608 HydrophobicContact CG-CG1 4.01Å; M596-I608 HydrophobicContact CG-CG2 3.69Å; M596-I608 HydrophobicContact SD-CD1 3.76Å; M596-I608 HydrophobicContact SD-CG1 4.37Å; M596-I608 HydrophobicContact SD-CG2 3.94Å; M596-A758 HydrophobicContact CE-CB 3.56Å; M596-I759 HydrophobicContact CE-CG1 4.32Å
597	C	86.2	Confident	85.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.5	165.4	-70.2	0	0	0	0	109.9	I545 G547 G548 Q604	I545-C597 WeakPolarHBondContact CG2-O 3.32Å; G547-C597 CarbonylContact C-O 3.09Å; G547-C597 WeakPolarHBondContact CA-O 3.4Å; G547-C597 PolarHBondContact N-O 3.23Å; G547-C597 VanDerWaalsContact N-O 3.15Å; G548-C597 PolarHBondContact O-N 3.12Å; C597-Q604 CarbonylContact C-O 3.55Å; C597-Q604 WeakPolarHBondContact CA-O 3.5Å
598	V	82.9	Confident	85.7	Confident	14 Å²	14	25 Å²	25	9%	0.085	13%	0.131	C	C	.	.	S	Bend	trans	-64.5	-49	-179.4	179	0	0	0	0	110.7	L447 S546 G547 Q604 K606	L447-V598 HydrophobicContact CD1-CG1 4.09Å; S546-V598 PolarHBondContact N-O 2.75Å; S546-V598 VanDerWaalsContact N-O 3.13Å; S546-V598 PolarHBondContact OG-O 3.41Å; G547-V598 PolarHBondContact N-O 3.48Å; V598-Q604 HydrophobicContact CB-CB 4.14Å; V598-Q604 HydrophobicContact CG2-CB 3.87Å; V598-Q604 PolarHBondContact N-O 3.07Å; V598-K606 HydrophobicContact CG2-CD 4.06Å; V598-K606 HydrophobicContact CG2-CG 3.98Å
599	N	76.3	Confident	85.7	Confident	23 Å²	23	23.9 Å²	23.9	12%	0.123	13%	0.125	C	C	.	.	S	Bend	trans	-129.6	166.7	-177.4	63.4	33.6	0	0	0	111.3	L447 G547 T601 G602	L447-N599 HydrophobicContact CD1-CB 4.41Å; G547-N599 WeakPolarHBondContact CA-O 3.23Å; N599-T601 PolarHBondContact O-N 2.85Å; N599-T601 VanDerWaalsContact O-N 3.08Å; N599-T601 WeakPolarHBondContact OD1-CB 3.45Å; N599-T601 PolarHBondContact OD1-N 3.41Å; N599-T601 PolarHBondContact OD1-OG1 3.19Å; N599-G602 PolarHBondContact O-N 3.11Å
600	K	73.6	Confident	85.7	Confident	121 Å²	121	22.8 Å²	22.8	53%	0.526	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.4	-175.5	-70.9	165	177.2	158.1	0	114.4	E442 R553 G602	E442-K600 IonicContact OE1-NZ 2.84Å; E442-K600 PolarHBondContact OE1-NZ 3.29Å; E442-K600 IonicContact OE2-NZ 3.85Å; E442-K600 PolarHBondContact OE2-NZ 3.37Å; R553-K600 PolarHBondContact NE-O 3.1Å; K600-G602 PolarHBondContact O-N 3.26Å
601	T	75.7	Confident	85.2	Confident	82 Å²	82	23 Å²	23	50%	0.503	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-32.9	175.7	76.6	0	0	0	0	111.9	R553 N599 S603	R553-T601 PolarHBondContact NE-O 3.27Å; R553-T601 VanDerWaalsContact NE-O 3.17Å; R553-T601 PolarHBondContact NH2-O 3.22Å; N599-T601 PolarHBondContact O-N 2.85Å; N599-T601 VanDerWaalsContact O-N 3.08Å; N599-T601 WeakPolarHBondContact OD1-CB 3.45Å; N599-T601 PolarHBondContact OD1-N 3.41Å; N599-T601 PolarHBondContact OD1-OG1 3.19Å; T601-S603 WeakPolarHBondContact OG1-CB 3.43Å; T601-S603 PolarHBondContact OG1-N 3.24Å; T601-S603 VanDerWaalsContact OG1-N 3.14Å; T601-S603 PolarHBondContact OG1-OG 3.4Å
602	G	77.1	Confident	84.7	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.			trans	83.5	2.1	-173.1	0	0	0	0	0	115.2	Y569 N599 K600	Y569-G602 WeakPolarHBondContact CE1-O 3.28Å; Y569-G602 PolarHBondContact OH-O 2.96Å; N599-G602 PolarHBondContact O-N 3.11Å; K600-G602 PolarHBondContact O-N 3.26Å
603	S	81	Confident	84.6	Confident	68 Å²	68	22.5 Å²	22.5	48%	0.476	12%	0.12	S	C	.	.			trans	-70.3	-32.6	-173	55.8	0	0	0	0	114.9	Q572 T601	Q572-S603 PolarHBondContact NE2-O 3.4Å; Q572-S603 VanDerWaalsContact NE2-O 3.15Å; T601-S603 WeakPolarHBondContact OG1-CB 3.43Å; T601-S603 PolarHBondContact OG1-N 3.24Å; T601-S603 VanDerWaalsContact OG1-N 3.14Å; T601-S603 PolarHBondContact OG1-OG 3.4Å
604	Q	88.6	Confident	84.8	Confident	77 Å²	77	22.8 Å²	22.8	36%	0.36	12%	0.121	S	C	.	.			trans	-114.9	142.7	178.4	-59.7	-169.4	14.3	0	0	111.1	C597 V598	C597-Q604 CarbonylContact C-O 3.55Å; C597-Q604 WeakPolarHBondContact CA-O 3.5Å; V598-Q604 HydrophobicContact CB-CB 4.14Å; V598-Q604 HydrophobicContact CG2-CB 3.87Å; V598-Q604 PolarHBondContact N-O 3.07Å
605	I	93.6	Very high	84.5	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	159.5	174.6	64.9	77.4	0	0	0	113.1	L550 Y569 Q572 I573 I595 M596	L550-I605 HydrophobicContact CB-CG2 4.48Å; L550-I605 HydrophobicContact CD1-CG2 4.12Å; L550-I605 HydrophobicContact CD2-CG2 4.39Å; Y569-I605 HydrophobicContact CD1-CG2 3.83Å; Y569-I605 HydrophobicContact CE1-CG2 3.89Å; Q572-I605 HydrophobicContact CB-CD1 3.68Å; Q572-I605 HydrophobicContact CB-CG1 3.7Å; I573-I605 HydrophobicContact CG1-CD1 4.08Å; I595-I605 HydrophobicContact CG2-CB 4.1Å; I595-I605 HydrophobicContact CG2-CD1 4.24Å; I595-I605 HydrophobicContact CG2-CG1 4.26Å; I595-I605 HydrophobicContact CG2-CG2 4.4Å; M596-I605 CarbonylContact O-C 3.56Å; M596-I605 WeakPolarHBondContact O-CA 3.22Å; M596-I605 WeakPolarHBondContact O-CB 3.26Å
606	K	94.3	Very high	83.5	Confident	12 Å²	12	28.9 Å²	28.9	5%	0.052	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.4	167.3	-77	172.2	-179.6	-98.3	0	110.7	P523 K524 L525 E543 I545 M596 V598	P523-K606 VanDerWaalsContact O-CE 3.28Å; P523-K606 WeakPolarHBondContact O-CE 3.45Å; P523-K606 WeakPolarHBondContact O-CG 3.43Å; P523-K606 PolarHBondContact O-NZ 3.24Å; P523-K606 VanDerWaalsContact O-NZ 3.12Å; K524-K606 CarbonylContact O-C 3.52Å; K524-K606 VanDerWaalsContact O-CA 3.29Å; K524-K606 WeakPolarHBondContact O-CA 3.44Å; L525-K606 PolarHBondContact O-NZ 3.14Å; E543-K606 WeakPolarHBondContact OE1-CE 3.48Å; E543-K606 IonicContact OE1-NZ 2.75Å; E543-K606 PolarHBondContact OE1-NZ 3.41Å; E543-K606 WeakPolarHBondContact OE2-CE 3.35Å; E543-K606 IonicContact OE2-NZ 2.65Å; E543-K606 PolarHBondContact OE2-NZ 2.95Å; I545-K606 HydrophobicContact CD1-CB 4.13Å; I545-K606 HydrophobicContact CD1-CD 3.83Å; I545-K606 HydrophobicContact CG1-CD 4.37Å; M596-K606 PolarHBondContact N-O 3.46Å; M596-K606 PolarHBondContact O-N 2.99Å; V598-K606 HydrophobicContact CG2-CD 4.06Å; V598-K606 HydrophobicContact CG2-CG 3.98Å
607	L	94.9	Very high	82.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.5	164.8	-52	-176.6	0	0	0	109.3	K524 L525 V526 V577 I580 L590 N594 I595 F610	K524-L607 PolarHBondContact O-N 2.86Å; L525-L607 HydrophobicContact CD2-CB 3.87Å; L525-L607 HydrophobicContact CD2-CD1 3.83Å; L525-L607 HydrophobicContact CD2-CG 4.04Å; V526-L607 PolarHBondContact N-O 3Å; V577-L607 HydrophobicContact CG2-CD1 3.94Å; I580-L607 HydrophobicContact CD1-CD1 4.44Å; L590-L607 HydrophobicContact CD1-CD1 3.94Å; L590-L607 HydrophobicContact CD1-CD2 4Å; N594-L607 CarbonylContact O-C 3.59Å; N594-L607 VanDerWaalsContact O-CA 3.31Å; N594-L607 WeakPolarHBondContact O-CA 3.13Å; I595-L607 HydrophobicContact CG1-CD2 3.87Å; L607-F610 HydrophobicContact CB-CE1 4.3Å; L607-F610 HydrophobicContact CB-CZ 4.29Å
608	I	89.1	Confident	81	Confident	7 Å²	7	40 Å²	40	4%	0.036	22%	0.219	C	C	.	.			trans	-119.3	-9.7	-163.5	64.6	137.4	0	0	0	117.4	V526 I545 N594 M596 L762 M765	V526-I608 HydrophobicContact CB-CG2 4.33Å; V526-I608 HydrophobicContact CG1-CB 4.3Å; I545-I608 HydrophobicContact CD1-CG2 3.83Å; N594-I608 WeakPolarHBondContact O-CG1 3.3Å; N594-I608 PolarHBondContact O-N 3.06Å; M596-I608 HydrophobicContact CB-CG2 3.81Å; M596-I608 HydrophobicContact CG-CB 4.43Å; M596-I608 HydrophobicContact CG-CD1 3.86Å; M596-I608 HydrophobicContact CG-CG1 4.01Å; M596-I608 HydrophobicContact CG-CG2 3.69Å; M596-I608 HydrophobicContact SD-CD1 3.76Å; M596-I608 HydrophobicContact SD-CG1 4.37Å; M596-I608 HydrophobicContact SD-CG2 3.94Å; I608-L762 HydrophobicContact CB-CD2 4.46Å; I608-L762 HydrophobicContact CD1-CD2 3.89Å; I608-L762 HydrophobicContact CD1-CG 4.2Å; I608-L762 WeakPolarHBondContact O-CD2 3.44Å; I608-M765 HydrophobicContact CD1-CE 3.81Å; I608-M765 HydrophobicContact CD1-SD 3.88Å; I608-M765 HydrophobicContact CG1-CE 4.41Å
609	D	85.5	Confident	79.7	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.043	22%	0.222	C	C	.	.			trans	-133.8	133.9	179.6	-173	10.5	0	0	0	110.8	H587 G611 M765	H587-D609 PolarHBondContact CE1-O 2.77Å; D609-G611 PolarHBondContact OD1-N 3.37Å; D609-M765 HydrophobicContact CB-CB 4.41Å; D609-M765 HydrophobicContact CB-CE 3.78Å; D609-M765 HydrophobicContact CB-CG 4.35Å; D609-M765 HydrophobicContact CB-SD 4.1Å; D609-M765 VanDerWaalsContact OD2-CB 3.25Å; D609-M765 WeakPolarHBondContact OD2-CB 3.28Å; D609-M765 VanDerWaalsContact OD2-CG 3.29Å; D609-M765 WeakPolarHBondContact OD2-CG 3.39Å
610	F	87.9	Confident	78.7	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.018	24%	0.239	C	C	.	.			trans	-128.1	15.2	-179	-53.9	-64.7	0	0	0	111.7	M517 L520 L525 V526 I580 H587 L607 L612 A613	M517-F610 HydrophobicContact CE-CD2 4.01Å; M517-F610 HydrophobicContact CE-CE2 4.12Å; M517-F610 HydrophobicContact CG-CD2 3.74Å; M517-F610 HydrophobicContact CG-CE2 4.46Å; M517-F610 HydrophobicContact SD-CD2 4.15Å; L520-F610 HydrophobicContact CD1-CD1 4.16Å; L520-F610 HydrophobicContact CD1-CE1 4.32Å; L520-F610 HydrophobicContact CD1-CG 4.34Å; L525-F610 HydrophobicContact CB-CZ 3.96Å; L525-F610 HydrophobicContact CD2-CE1 4.1Å; L525-F610 HydrophobicContact CD2-CZ 3.92Å; L525-F610 HydrophobicContact CG-CZ 4.38Å; V526-F610 HydrophobicContact CG1-CE2 3.99Å; I580-F610 HydrophobicContact CD1-CD1 4.49Å; I580-F610 HydrophobicContact CD1-CE1 3.98Å; H587-F610 AromaticContact NE2-CE1 3.99Å; L607-F610 HydrophobicContact CB-CE1 4.3Å; L607-F610 HydrophobicContact CB-CZ 4.29Å; F610-L612 PolarHBondContact O-N 3.15Å; F610-L612 VanDerWaalsContact O-N 3.1Å; F610-A613 HydrophobicContact CB-CB 4.12Å; F610-A613 VanDerWaalsContact O-CB 3.27Å; F610-A613 WeakPolarHBondContact O-CB 3.36Å; F610-A613 PolarHBondContact O-N 2.95Å
611	G	78.5	Confident	77.7	Confident	4 Å²	4	37.9 Å²	37.9	4%	0.041	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.9	-172.7	0	0	0	0	0	116.7	D609 M767	D609-G611 PolarHBondContact OD1-N 3.37Å; G611-M767 WeakPolarHBondContact O-CA 3.49Å; G611-M767 WeakPolarHBondContact O-CB 3.33Å; G611-M767 VanDerWaalsContact O-CG 3.22Å; G611-M767 WeakPolarHBondContact O-CG 3.4Å
612	L	78.6	Confident	76.6	Confident	24 Å²	24	34.3 Å²	34.3	13%	0.126	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-11.1	169.7	-62.2	-168.4	0	0	0	114.1	L588 D589 F610 R614 L625	L588-L612 HydrophobicContact CB-CB 4.26Å; D589-L612 HydrophobicContact CB-CB 4.16Å; D589-L612 HydrophobicContact CB-CD1 4.06Å; D589-L612 HydrophobicContact CB-CG 4.17Å; F610-L612 PolarHBondContact O-N 3.15Å; F610-L612 VanDerWaalsContact O-N 3.1Å; L612-R614 PolarHBondContact O-NE 2.84Å; L612-R614 VanDerWaalsContact O-NE 3.12Å; L612-R614 PolarHBondContact O-NH2 3.07Å; L612-L625 HydrophobicContact CD1-CD1 4.43Å; L612-L625 HydrophobicContact CD2-CD1 4.07Å
613	A	85.9	Confident	75.3	Confident	3 Å²	3	35.7 Å²	35.7	3%	0.025	21%	0.213	C	C	.	.			trans	-63	149.8	-173.2	0	0	0	0	0	111.6	I516 I585 V586 F610	I516-A613 WeakPolarHBondContact CD1-O 3.49Å; I516-A613 HydrophobicContact CG2-CB 4.41Å; I585-A613 HydrophobicContact CG2-CB 4.2Å; V586-A613 WeakPolarHBondContact O-CA 3.38Å; V586-A613 WeakPolarHBondContact O-CB 3.27Å; F610-A613 HydrophobicContact CB-CB 4.12Å; F610-A613 VanDerWaalsContact O-CB 3.27Å; F610-A613 WeakPolarHBondContact O-CB 3.36Å; F610-A613 PolarHBondContact O-N 2.95Å
614	R	82.6	Confident	73.8	Confident	28 Å²	28	33 Å²	33	11%	0.106	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	153.6	-175.1	59.3	-165.6	64.6	-139.7	-7.4	113.3	I585 V586 L588 L612 G620 T621	I585-R614 CarbonylContact C-O 3.57Å; I585-R614 VanDerWaalsContact CA-O 3.28Å; I585-R614 WeakPolarHBondContact CA-O 3.34Å; I585-R614 WeakPolarHBondContact CG2-O 3.44Å; V586-R614 HydrophobicContact CG1-CG 3.84Å; V586-R614 PolarHBondContact N-O 2.98Å; V586-R614 PolarHBondContact O-N 3.24Å; L588-R614 HydrophobicContact CD1-CG 3.91Å; L612-R614 PolarHBondContact O-NE 2.84Å; L612-R614 VanDerWaalsContact O-NE 3.12Å; L612-R614 PolarHBondContact O-NH2 3.07Å; R614-G620 PolarHBondContact NH1-O 3.08Å; R614-T621 PolarHBondContact NH1-O 3.47Å
615	R	83.1	Confident	71.8	Confident	86 Å²	86	31.2 Å²	31.2	33%	0.325	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.8	170.2	-65.2	-173.5	-167.3	-69.8	-9.7	110	S519 Q583 G584 I585 A617 N618 A619	S519-R615 VanDerWaalsContact CB-NH2 3.34Å; S519-R615 PolarHBondContact OG-NH2 2.96Å; Q583-R615 PolarHBondContact O-NH1 3.5Å; G584-R615 VanDerWaalsContact O-CA 3.28Å; G584-R615 WeakPolarHBondContact O-CA 3.47Å; I585-R615 HydrophobicContact CG1-CG 3.75Å; R615-A617 VanDerWaalsContact C-N 3.28Å; R615-A617 PolarHBondContact O-N 3.2Å; R615-N618 CarbonylContact O-C 3.55Å; R615-N618 PolarHBondContact O-N 3.39Å; R615-N618 VanDerWaalsContact O-N 3.12Å; R615-A619 PolarHBondContact O-N 3.3Å
616	L	71.7	Confident	69.8	Low	43 Å²	43	33.5 Å²	33.5	23%	0.225	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-59.9	-37.5	-178.5	-72.6	175	0	0	0	112.5	G584 V586 N618 A619 Y644	G584-L616 PolarHBondContact O-N 3.29Å; V586-L616 HydrophobicContact CB-CD2 4.25Å; V586-L616 HydrophobicContact CB-CG 4.4Å; V586-L616 HydrophobicContact CG1-CD2 3.67Å; V586-L616 HydrophobicContact CG1-CG 4.13Å; L616-N618 PolarHBondContact O-N 2.87Å; L616-N618 VanDerWaalsContact O-N 3.13Å; L616-A619 WeakPolarHBondContact O-CB 3.27Å; L616-A619 PolarHBondContact O-N 2.95Å; L616-Y644 HydrophobicContact CD1-CD1 3.92Å; L616-Y644 HydrophobicContact CD1-CD2 4.23Å; L616-Y644 HydrophobicContact CD1-CE1 3.57Å; L616-Y644 HydrophobicContact CD1-CE2 3.91Å; L616-Y644 HydrophobicContact CD1-CG 4.24Å
617	A	63.2	Low	67.6	Low	97 Å²	97	35.1 Å²	35.1	80%	0.802	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-62.9	-19.3	179.1	0	0	0	0	0	114.7	R615	R615-A617 VanDerWaalsContact C-N 3.28Å; R615-A617 PolarHBondContact O-N 3.2Å
618	N	56.8	Low	66.3	Low	138 Å²	138	36.2 Å²	36.2	74%	0.738	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-124.4	29.6	179	-66.3	-5.8	0	0	0	111	R615 L616 G620	R615-N618 CarbonylContact O-C 3.55Å; R615-N618 PolarHBondContact O-N 3.39Å; R615-N618 VanDerWaalsContact O-N 3.12Å; L616-N618 PolarHBondContact O-N 2.87Å; L616-N618 VanDerWaalsContact O-N 3.13Å; N618-G620 VanDerWaalsContact C-N 3.32Å; N618-G620 PolarHBondContact O-N 3.35Å
619	A	55.9	Low	65.3	Low	18 Å²	18	36.4 Å²	36.4	15%	0.149	22%	0.224	C	C	.	.			trans	-75.5	79.2	-174.3	0	0	0	0	0	112.7	R615 L616 Q793	R615-A619 PolarHBondContact O-N 3.3Å; L616-A619 WeakPolarHBondContact O-CB 3.27Å; L616-A619 PolarHBondContact O-N 2.95Å; A619-Q793 VanDerWaalsContact CB-OE1 3.3Å
620	G	56	Low	64.9	Low	46 Å²	46	36.6 Å²	36.6	47%	0.474	23%	0.225	S	C	.	.			trans	-69.3	-170.7	163	0	0	0	0	0	112.4	R614 N618 L622	R614-G620 PolarHBondContact NH1-O 3.08Å; N618-G620 VanDerWaalsContact C-N 3.32Å; N618-G620 PolarHBondContact O-N 3.35Å; G620-L622 PolarHBondContact O-N 3.4Å; G620-L622 VanDerWaalsContact O-N 3.16Å
621	T	51.9	Low	64.9	Low	50 Å²	50	36.9 Å²	36.9	31%	0.307	23%	0.226	S	C	.	.			trans	-36.3	115.5	-173.5	-33.3	0	0	0	0	113.5	R614 E790 Y791 E792	R614-T621 PolarHBondContact NH1-O 3.47Å; T621-E790 HydrophobicContact CG2-CB 4.09Å; T621-Y791 CarbonylContact C-O 3.46Å; T621-Y791 WeakPolarHBondContact CA-O 3.49Å; T621-Y791 WeakPolarHBondContact CG2-O 3.35Å; T621-E792 HydrophobicContact CG2-CG 3.87Å; T621-E792 PolarHBondContact OG1-OE1 3.13Å
622	L	51.8	Low	65	Low	7 Å²	7	37.6 Å²	37.6	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.4	169.4	-176.8	57.7	0	0	0	108.5	L588 G620 V624 V636 I642 Y791 Q793	L588-L622 HydrophobicContact CD1-CD1 3.77Å; G620-L622 PolarHBondContact O-N 3.4Å; G620-L622 VanDerWaalsContact O-N 3.16Å; L622-V624 HydrophobicContact CD2-CG2 3.88Å; L622-V624 HydrophobicContact CG-CG2 3.86Å; L622-V636 HydrophobicContact CD2-CG1 4.48Å; L622-I642 HydrophobicContact CD2-CD1 4.3Å; L622-I642 HydrophobicContact CD2-CG2 4.16Å; L622-Y791 HydrophobicContact CB-CD1 4.33Å; L622-Y791 PolarHBondContact N-O 2.93Å; L622-Y791 PolarHBondContact O-N 2.94Å; L622-Q793 HydrophobicContact CB-CG 4.36Å
623	K	50.6	Low	65.4	Low	30 Å²	30	36.6 Å²	36.6	13%	0.13	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	106	169.3	-62.7	-155	177.9	-149.9	0	107.5	G770 L789 E790	K623-G770 PolarHBondContact NZ-O 3.34Å; K623-L789 WeakPolarHBondContact CA-O 3.34Å; K623-E790 HydrophobicContact CD-CG 4.08Å; K623-E790 WeakPolarHBondContact CE-OE2 3.47Å; K623-E790 HydrophobicContact CG-CG 4.23Å; K623-E790 IonicContact NZ-OE1 2.77Å; K623-E790 PolarHBondContact NZ-OE1 2.89Å; K623-E790 IonicContact NZ-OE2 2.67Å; K623-E790 PolarHBondContact NZ-OE2 2.81Å
624	V	48.7	Very low	65.4	Low	10 Å²	10	36.5 Å²	36.5	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.2	178.6	-168.5	0	0	0	0	108.8	L622 F626 V636 C788 L789	L622-V624 HydrophobicContact CD2-CG2 3.88Å; L622-V624 HydrophobicContact CG-CG2 3.86Å; V624-F626 HydrophobicContact CB-CD2 4.41Å; V624-F626 HydrophobicContact CB-CE2 3.69Å; V624-F626 HydrophobicContact CB-CZ 3.99Å; V624-F626 HydrophobicContact CG1-CD1 4.34Å; V624-F626 HydrophobicContact CG1-CD2 3.96Å; V624-F626 HydrophobicContact CG1-CE1 3.84Å; V624-F626 HydrophobicContact CG1-CE2 3.39Å; V624-F626 HydrophobicContact CG1-CG 4.41Å; V624-F626 HydrophobicContact CG1-CZ 3.35Å; V624-V636 HydrophobicContact CB-CG1 4.28Å; V624-V636 HydrophobicContact CG1-CG1 3.61Å; V624-V636 HydrophobicContact CG2-CG1 3.57Å; V624-C788 WeakPolarHBondContact O-CA 3.46Å; V624-L789 PolarHBondContact N-O 3.43Å; V624-L789 PolarHBondContact O-N 3.37Å; V624-L789 VanDerWaalsContact O-N 3.12Å
625	L	46.9	Very low	65.2	Low	40 Å²	40	35.2 Å²	35.2	21%	0.209	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	105.6	177.1	-67.1	162.6	0	0	0	107.8	L612 G627 A769 L786 C788	L612-L625 HydrophobicContact CD1-CD1 4.43Å; L612-L625 HydrophobicContact CD2-CD1 4.07Å; L625-G627 PolarHBondContact O-N 2.82Å; L625-A769 HydrophobicContact CD1-CB 3.45Å; L625-A769 VanDerWaalsContact CD1-CB 3.45Å; L625-A769 HydrophobicContact CD2-CB 3.8Å; L625-A769 HydrophobicContact CG-CB 4.26Å; L625-L786 HydrophobicContact CB-CD2 4.47Å; L625-L786 HydrophobicContact CD2-CB 4.43Å; L625-C788 HydrophobicContact CD2-CB 4.02Å
626	F	50.9	Low	64.9	Low	48 Å²	48	31.9 Å²	31.9	21%	0.211	21%	0.208	C	C	.	.			trans	-79.5	48.6	-178.7	-65.6	-83.8	0	0	0	112.3	V624 V632 I637 L674 L789	V624-F626 HydrophobicContact CB-CD2 4.41Å; V624-F626 HydrophobicContact CB-CE2 3.69Å; V624-F626 HydrophobicContact CB-CZ 3.99Å; V624-F626 HydrophobicContact CG1-CD1 4.34Å; V624-F626 HydrophobicContact CG1-CD2 3.96Å; V624-F626 HydrophobicContact CG1-CE1 3.84Å; V624-F626 HydrophobicContact CG1-CE2 3.39Å; V624-F626 HydrophobicContact CG1-CG 4.41Å; V624-F626 HydrophobicContact CG1-CZ 3.35Å; F626-V632 HydrophobicContact CD1-CG2 4.29Å; F626-V632 HydrophobicContact CE1-CG1 3.98Å; F626-I637 HydrophobicContact CE1-CG1 4.05Å; F626-L674 HydrophobicContact CD1-CD2 3.94Å; F626-L674 HydrophobicContact CE1-CD2 4.23Å; F626-L789 HydrophobicContact CD2-CD1 3.92Å; F626-L789 HydrophobicContact CE2-CB 4.26Å; F626-L789 HydrophobicContact CE2-CD1 3.45Å; F626-L789 VanDerWaalsContact CE2-CD1 3.45Å; F626-L789 HydrophobicContact CE2-CG 4.41Å; F626-L789 HydrophobicContact CZ-CD1 4.41Å
627	G	49.8	Very low	64.9	Low	46 Å²	46	31.1 Å²	31.1	47%	0.474	20%	0.204	S	C	.	.	S	Bend	trans	-81.6	-16	-178.6	0	0	0	0	0	115	L625	L625-G627 PolarHBondContact O-N 2.82Å
628	T	66.3	Low	65.1	Low	23 Å²	23	29 Å²	29	14%	0.141	18%	0.179	C	C	.	.	S	Bend	trans	-151.1	85.2	171	52.1	0	0	0	0	108.7	E630 F631	T628-E630 PolarHBondContact O-N 2.99Å; T628-E630 VanDerWaalsContact O-N 3.17Å; T628-F631 PolarHBondContact O-N 3.49Å
629	P	68.4	Low	65.4	Low	11 Å²	11	27.1 Å²	27.1	7%	0.071	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-59.4	-32.4	-168	21.4	-33.2	0	0	0	113.6	F631 V632 D670 T673 L674	P629-F631 PolarHBondContact O-N 2.88Å; P629-F631 VanDerWaalsContact O-N 3.13Å; P629-V632 WeakPolarHBondContact O-CB 3.48Å; P629-V632 PolarHBondContact O-N 3.05Å; P629-D670 HydrophobicContact CG-CB 4.2Å; P629-T673 HydrophobicContact CB-CG2 4.24Å; P629-T673 HydrophobicContact CG-CG2 3.94Å; P629-L674 HydrophobicContact CB-CD2 3.56Å; P629-L674 HydrophobicContact CB-CG 3.73Å
630	E	77.7	Confident	65.9	Low	12 Å²	12	29.9 Å²	29.9	6%	0.056	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-56.8	-24.3	178.9	67.8	-167.8	177.1	0	0	115.5	T628 V653 S663 M666 T673 Y743	T628-E630 PolarHBondContact O-N 2.99Å; T628-E630 VanDerWaalsContact O-N 3.17Å; E630-V653 WeakPolarHBondContact O-CG2 3.16Å; E630-S663 WeakPolarHBondContact OE2-CB 3.35Å; E630-S663 PolarHBondContact OE2-OG 2.99Å; E630-M666 WeakPolarHBondContact OE2-CE 3.31Å; E630-T673 HydrophobicContact CB-CG2 4.13Å; E630-Y743 PolarHBondContact OE1-OH 2.68Å
631	F	86.8	Confident	66.5	Low	10 Å²	10	28.7 Å²	28.7	4%	0.044	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-95.3	-12.4	178.1	-67.5	-76.5	0	0	0	114	K591 P592 T628 P629 S650 V653 I654 I657 Y743	K591-F631 HydrophobicContact CB-CD1 4.42Å; K591-F631 HydrophobicContact CB-CD2 4.19Å; K591-F631 HydrophobicContact CB-CG 4.15Å; P592-F631 VanDerWaalsContact CD-CE1 3.45Å; P592-F631 HydrophobicContact CG-CE1 4.07Å; P592-F631 HydrophobicContact CG-CE2 4.25Å; P592-F631 HydrophobicContact CG-CZ 3.52Å; T628-F631 PolarHBondContact O-N 3.49Å; P629-F631 PolarHBondContact O-N 2.88Å; P629-F631 VanDerWaalsContact O-N 3.13Å; F631-S650 PolarHBondContact O-OG 3.09Å; F631-V653 HydrophobicContact CD1-CB 3.97Å; F631-V653 HydrophobicContact CD1-CG1 3.62Å; F631-V653 HydrophobicContact CE1-CB 4.04Å; F631-V653 HydrophobicContact CE1-CG1 3.42Å; F631-V653 VanDerWaalsContact CE1-CG1 3.42Å; F631-V653 HydrophobicContact CG-CG1 4.4Å; F631-V653 HydrophobicContact CZ-CG1 4.08Å; F631-I654 HydrophobicContact CD1-CG1 4.34Å; F631-I654 HydrophobicContact CE1-CG1 3.83Å; F631-I657 HydrophobicContact CE1-CD1 3.76Å; F631-I657 HydrophobicContact CZ-CD1 3.42Å; F631-I657 VanDerWaalsContact CZ-CD1 3.42Å; F631-Y743 WeakPolarHBondContact CZ-OH 3.49Å
632	V	81.8	Confident	67.8	Low	20 Å²	20	26.8 Å²	26.8	12%	0.121	15%	0.146	C	C	.	.	S	Bend	trans	-74.9	137.9	179.8	-174.9	0	0	0	0	108.5	F626 P629 V636 I637 W649 V677	F626-V632 HydrophobicContact CD1-CG2 4.29Å; F626-V632 HydrophobicContact CE1-CG1 3.98Å; P629-V632 WeakPolarHBondContact O-CB 3.48Å; P629-V632 PolarHBondContact O-N 3.05Å; V632-V636 HydrophobicContact CG1-CB 3.64Å; V632-V636 HydrophobicContact CG1-CG1 3.72Å; V632-V636 HydrophobicContact CG1-CG2 4.47Å; V632-I637 HydrophobicContact CG1-CG1 4.01Å; V632-W649 PolarHBondContact O-NE1 3.29Å; V632-V677 WeakPolarHBondContact O-CG1 3.37Å
633	A	87	Confident	69.2	Low	2 Å²	2	28.2 Å²	28.2	2%	0.017	16%	0.156	C	C	.	.			trans	-83.5	154	179.5	0	0	0	0	0	111.8	E635 V636 I637 T646 W649	A633-E635 VanDerWaalsContact C-N 3.29Å; A633-E635 HydrophobicContact CB-CG 4.41Å; A633-E635 WeakPolarHBondContact CB-OE2 3.49Å; A633-E635 PolarHBondContact O-N 3.42Å; A633-V636 HydrophobicContact CB-CG2 4.22Å; A633-V636 WeakPolarHBondContact O-CB 3.44Å; A633-V636 PolarHBondContact O-N 3.04Å; A633-I637 PolarHBondContact O-N 2.91Å; A633-T646 HydrophobicContact CB-CG2 3.88Å; A633-W649 HydrophobicContact CB-CB 3.77Å; A633-W649 HydrophobicContact CB-CD2 4.39Å; A633-W649 HydrophobicContact CB-CG 3.74Å
634	P	85	Confident	71	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-55	-41.4	-176.9	-24.3	32.3	0	0	0	113.4	V636 I637 N638 W649 V677	P634-V636 PolarHBondContact O-N 2.91Å; P634-I637 PolarHBondContact O-N 3.27Å; P634-I637 VanDerWaalsContact O-N 3.15Å; P634-N638 WeakPolarHBondContact O-CB 3.34Å; P634-N638 PolarHBondContact O-N 2.97Å; P634-N638 PolarHBondContact O-ND2 3.47Å; P634-W649 HydrophobicContact CG-CD2 4.44Å; P634-W649 HydrophobicContact CG-CE3 4.11Å; P634-W649 HydrophobicContact CG-CH2 3.59Å; P634-W649 HydrophobicContact CG-CZ2 3.97Å; P634-W649 HydrophobicContact CG-CZ3 3.68Å; P634-V677 HydrophobicContact CG-CG1 4.18Å; P634-V677 WeakPolarHBondContact CG-O 3.24Å
635	E	78.6	Confident	72.9	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-29.3	178.1	63.2	-89.4	-152.7	0	0	112.8	A633 Y639 E640 I642 T646 M708 R711	A633-E635 VanDerWaalsContact C-N 3.29Å; A633-E635 HydrophobicContact CB-CG 4.41Å; A633-E635 WeakPolarHBondContact CB-OE2 3.49Å; A633-E635 PolarHBondContact O-N 3.42Å; E635-Y639 PolarHBondContact O-N 2.94Å; E635-E640 HydrophobicContact CB-CB 3.82Å; E635-E640 PolarHBondContact O-N 2.95Å; E635-I642 HydrophobicContact CG-CG2 4.35Å; E635-T646 HydrophobicContact CG-CG2 4.42Å; E635-T646 WeakPolarHBondContact OE1-CA 3.5Å; E635-T646 VanDerWaalsContact OE1-CB 3.26Å; E635-T646 WeakPolarHBondContact OE1-CB 3.16Å; E635-T646 PolarHBondContact OE1-OG1 3.06Å; E635-M708 HydrophobicContact CG-SD 4.29Å; E635-R711 VanDerWaalsContact CD-NH1 3.34Å; E635-R711 IonicContact OE1-CZ 2.59Å; E635-R711 IonicContact OE1-NH1 3.39Å; E635-R711 PolarHBondContact OE1-NH1 3.32Å; E635-R711 IonicContact OE1-NH2 2.84Å; E635-R711 IonicContact OE2-CZ 2.65Å; E635-R711 IonicContact OE2-NH1 2.99Å; E635-R711 PolarHBondContact OE2-NH1 3.31Å; E635-R711 VanDerWaalsContact OE2-NH1 3.14Å; E635-R711 IonicContact OE2-NH2 2.78Å; E635-R711 PolarHBondContact OE2-NH2 3.43Å
636	V	76.9	Confident	75	Confident	16 Å²	16	29.7 Å²	29.7	10%	0.097	16%	0.162	C	C	.	.	H	α-helix	trans	-78.3	-32.1	179.6	-173.8	0	0	0	0	111.4	L622 V624 V632 A633 P634 I642 T646	L622-V636 HydrophobicContact CD2-CG1 4.48Å; V624-V636 HydrophobicContact CB-CG1 4.28Å; V624-V636 HydrophobicContact CG1-CG1 3.61Å; V624-V636 HydrophobicContact CG2-CG1 3.57Å; V632-V636 HydrophobicContact CG1-CB 3.64Å; V632-V636 HydrophobicContact CG1-CG1 3.72Å; V632-V636 HydrophobicContact CG1-CG2 4.47Å; A633-V636 HydrophobicContact CB-CG2 4.22Å; A633-V636 WeakPolarHBondContact O-CB 3.44Å; A633-V636 PolarHBondContact O-N 3.04Å; P634-V636 PolarHBondContact O-N 2.91Å; V636-I642 HydrophobicContact CG2-CG2 3.73Å; V636-T646 HydrophobicContact CG2-CG2 3.62Å
637	I	71.3	Confident	77.1	Confident	28 Å²	28	27.5 Å²	27.5	14%	0.144	15%	0.152	C	C	.	.	H	α-helix	trans	-73.2	-39.9	172.5	-58.2	171.7	0	0	0	110.4	F626 V632 A633 P634 Y639 L674 V677	F626-I637 HydrophobicContact CE1-CG1 4.05Å; V632-I637 HydrophobicContact CG1-CG1 4.01Å; A633-I637 PolarHBondContact O-N 2.91Å; P634-I637 PolarHBondContact O-N 3.27Å; P634-I637 VanDerWaalsContact O-N 3.15Å; I637-Y639 VanDerWaalsContact C-N 3.27Å; I637-Y639 WeakPolarHBondContact O-CD2 3.13Å; I637-Y639 WeakPolarHBondContact O-CE2 3.02Å; I637-Y639 PolarHBondContact O-N 3.5Å; I637-L674 HydrophobicContact CD1-CD2 3.56Å; I637-L674 HydrophobicContact CG1-CD2 3.96Å; I637-V677 HydrophobicContact CD1-CB 3.77Å; I637-V677 HydrophobicContact CD1-CG1 3.38Å
638	N	67.1	Low	79.4	Confident	51 Å²	51	25.3 Å²	25.3	27%	0.273	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.6	-175.5	-65.6	-11.1	0	0	0	114.3	P634 E640 T678	P634-N638 WeakPolarHBondContact O-CB 3.34Å; P634-N638 PolarHBondContact O-N 2.97Å; P634-N638 PolarHBondContact O-ND2 3.47Å; N638-E640 VanDerWaalsContact C-N 3.31Å; N638-E640 HydrophobicContact CB-CG 3.83Å; N638-E640 WeakPolarHBondContact CB-OE1 3.46Å; N638-E640 PolarHBondContact ND2-OE1 2.84Å; N638-T678 WeakPolarHBondContact OD1-CG2 3.47Å
639	Y	63.5	Low	80.8	Confident	99 Å²	99	24.2 Å²	24.2	39%	0.388	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	39.1	-172.9	-50.6	-88.7	0	0	0	112.9	E635 I637 L789 Y791	E635-Y639 PolarHBondContact O-N 2.94Å; I637-Y639 VanDerWaalsContact C-N 3.27Å; I637-Y639 WeakPolarHBondContact O-CD2 3.13Å; I637-Y639 WeakPolarHBondContact O-CE2 3.02Å; I637-Y639 PolarHBondContact O-N 3.5Å; Y639-L789 WeakPolarHBondContact OH-CD1 3.33Å; Y639-Y791 AromaticContact CD1-CD2 3.72Å; Y639-Y791 HydrophobicContact CD1-CD2 3.72Å; Y639-Y791 HydrophobicContact CD1-CE2 4.45Å; Y639-Y791 AromaticContact CD1-CG 3.91Å; Y639-Y791 HydrophobicContact CD1-CG 3.91Å; Y639-Y791 HydrophobicContact CG-CD2 4.25Å; Y639-Y791 WeakPolarHBondContact O-CE2 3.41Å; Y639-Y791 PolarHBondContact O-OH 3.34Å
640	E	66.6	Low	82.1	Confident	77 Å²	77	24 Å²	24	36%	0.36	12%	0.122	S	C	.	.	P	Polyproline II helix	trans	-91.4	170.1	173.3	-67.4	170.1	-139.4	0	0	111.3	E635 N638 I642 Y825	E635-E640 HydrophobicContact CB-CB 3.82Å; E635-E640 PolarHBondContact O-N 2.95Å; N638-E640 VanDerWaalsContact C-N 3.31Å; N638-E640 HydrophobicContact CB-CG 3.83Å; N638-E640 WeakPolarHBondContact CB-OE1 3.46Å; N638-E640 PolarHBondContact ND2-OE1 2.84Å; E640-I642 PolarHBondContact O-N 3.11Å; E640-Y825 WeakPolarHBondContact CA-OH 3.23Å
641	A	68.5	Low	83.1	Confident	20 Å²	20	23.5 Å²	23.5	17%	0.165	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-72.7	121.3	177.8	0	0	0	0	0	112.5	M708 Y825	A641-M708 WeakPolarHBondContact O-CE 3.4Å; A641-Y825 HydrophobicContact CB-CD1 4.35Å; A641-Y825 HydrophobicContact CB-CE1 3.6Å; A641-Y825 PolarHBondContact N-OH 3.42Å
642	I	79.4	Confident	83.7	Confident	11 Å²	11	23 Å²	23	6%	0.056	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-76.4	155.5	175.9	58.4	150.4	0	0	0	112.9	V586 L588 L622 E635 V636 E640 T646 Q793	V586-I642 HydrophobicContact CG1-CD1 4.12Å; L588-I642 HydrophobicContact CD1-CD1 3.5Å; L588-I642 VanDerWaalsContact CD1-CD1 3.5Å; L588-I642 HydrophobicContact CD2-CB 4.49Å; L588-I642 HydrophobicContact CD2-CD1 3.58Å; L588-I642 HydrophobicContact CG-CD1 4.14Å; L622-I642 HydrophobicContact CD2-CD1 4.3Å; L622-I642 HydrophobicContact CD2-CG2 4.16Å; E635-I642 HydrophobicContact CG-CG2 4.35Å; V636-I642 HydrophobicContact CG2-CG2 3.73Å; E640-I642 PolarHBondContact O-N 3.11Å; I642-T646 HydrophobicContact CB-CG2 4.4Å; I642-T646 HydrophobicContact CG2-CG2 4.15Å; I642-Q793 VanDerWaalsContact CD1-NE2 3.33Å
643	S	82.1	Confident	84.4	Confident	36 Å²	36	22 Å²	22	25%	0.252	11%	0.111	S	C	.	.			trans	-156.3	-173.5	176	-170.1	0	0	0	0	111.1	P645 T646	S643-P645 VanDerWaalsContact C-N 3.29Å; S643-T646 PolarHBondContact N-OG1 3.01Å; S643-T646 VanDerWaalsContact N-OG1 3.09Å; S643-T646 WeakPolarHBondContact O-CB 3.34Å; S643-T646 PolarHBondContact O-N 3.42Å; S643-T646 PolarHBondContact O-OG1 3.37Å; S643-T646 VanDerWaalsContact O-OG1 3.05Å
644	Y	86.9	Confident	84.9	Confident	82 Å²	82	22 Å²	22	32%	0.322	11%	0.11	S	C	.	.	H	α-helix	trans	-50.8	-38	176.8	-53.6	-61.8	0	0	0	114.5	H581 G584 L616 T646 D647	H581-Y644 HydrophobicContact CB-CD1 3.75Å; H581-Y644 HydrophobicContact CB-CE1 4.09Å; H581-Y644 HydrophobicContact CB-CG 4.37Å; H581-Y644 AromaticContact CD2-CD1 3.58Å; H581-Y644 PolarHBondContact CE1-O 3.17Å; H581-Y644 VanDerWaalsContact CE1-O 3.23Å; H581-Y644 AromaticContact CG-CD1 3.56Å; G584-Y644 WeakPolarHBondContact CA-OH 3.38Å; L616-Y644 HydrophobicContact CD1-CD1 3.92Å; L616-Y644 HydrophobicContact CD1-CD2 4.23Å; L616-Y644 HydrophobicContact CD1-CE1 3.57Å; L616-Y644 HydrophobicContact CD1-CE2 3.91Å; L616-Y644 HydrophobicContact CD1-CG 4.24Å; Y644-T646 PolarHBondContact O-N 2.9Å; Y644-D647 PolarHBondContact O-N 3.45Å
645	P	89.8	Confident	85.5	Confident	24 Å²	24	21.9 Å²	21.9	16%	0.156	11%	0.11	C	C	.	.	H	α-helix	trans	-74.6	-3.1	178.7	-7.5	25.3	0	0	0	114.5	S643 M648 W649 M708 R711	S643-P645 VanDerWaalsContact C-N 3.29Å; P645-M648 HydrophobicContact CB-CB 4.44Å; P645-M648 HydrophobicContact CB-CG 4.38Å; P645-M648 PolarHBondContact O-N 3.36Å; P645-W649 PolarHBondContact O-N 3.25Å; P645-M708 HydrophobicContact CB-CG 3.6Å; P645-M708 VanDerWaalsContact CB-O 3.31Å; P645-M708 WeakPolarHBondContact CB-O 3.5Å; P645-M708 HydrophobicContact CG-CG 3.85Å; P645-R711 HydrophobicContact CB-CB 4.19Å; P645-R711 WeakPolarHBondContact O-CD 3.48Å; P645-R711 PolarHBondContact O-NH1 3.46Å
646	T	90.8	Very high	86.4	Confident	6 Å²	6	22.3 Å²	22.3	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-43.1	166.1	-54.1	0	0	0	0	111	L588 A633 E635 V636 I642 S643 Y644 M648 W649	L588-T646 HydrophobicContact CD2-CG2 3.85Å; A633-T646 HydrophobicContact CB-CG2 3.88Å; E635-T646 HydrophobicContact CG-CG2 4.42Å; E635-T646 WeakPolarHBondContact OE1-CA 3.5Å; E635-T646 VanDerWaalsContact OE1-CB 3.26Å; E635-T646 WeakPolarHBondContact OE1-CB 3.16Å; E635-T646 PolarHBondContact OE1-OG1 3.06Å; V636-T646 HydrophobicContact CG2-CG2 3.62Å; I642-T646 HydrophobicContact CB-CG2 4.4Å; I642-T646 HydrophobicContact CG2-CG2 4.15Å; S643-T646 PolarHBondContact N-OG1 3.01Å; S643-T646 VanDerWaalsContact N-OG1 3.09Å; S643-T646 WeakPolarHBondContact O-CB 3.34Å; S643-T646 PolarHBondContact O-N 3.42Å; S643-T646 PolarHBondContact O-OG1 3.37Å; S643-T646 VanDerWaalsContact O-OG1 3.05Å; Y644-T646 PolarHBondContact O-N 2.9Å; T646-M648 VanDerWaalsContact C-N 3.26Å; T646-M648 PolarHBondContact O-N 2.78Å; T646-W649 WeakPolarHBondContact O-CB 3.22Å; T646-W649 PolarHBondContact O-N 3.07Å
647	D	95.1	Very high	87.3	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-66.5	-31.6	173	-64.8	-26.6	0	0	0	111.8	V577 H581 V586 H587 L588 Y644 W649 S650 I651	V577-D647 HydrophobicContact CG1-CB 4.13Å; H581-D647 IonicContact CD2-OD2 3.75Å; H581-D647 IonicContact CE1-OD2 3.18Å; H581-D647 IonicContact NE2-OD2 2.71Å; H581-D647 PolarHBondContact NE2-OD2 2.64Å; V586-D647 WeakPolarHBondContact CG2-OD1 3.42Å; V586-D647 WeakPolarHBondContact CG2-OD2 3.19Å; H587-D647 WeakPolarHBondContact CB-OD1 3.21Å; H587-D647 PolarHBondContact N-OD1 2.74Å; H587-D647 VanDerWaalsContact N-OD1 3.11Å; H587-D647 PolarHBondContact N-OD2 3.21Å; L588-D647 PolarHBondContact N-OD1 2.92Å; Y644-D647 PolarHBondContact O-N 3.45Å; D647-W649 VanDerWaalsContact C-N 3.28Å; D647-W649 PolarHBondContact O-N 3.24Å; D647-S650 PolarHBondContact O-N 3.42Å; D647-I651 WeakPolarHBondContact O-CG1 3.3Å; D647-I651 PolarHBondContact O-N 2.73Å
648	M	97.2	Very high	88.4	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-68	-26.8	-178.4	-56.9	-59	-48.3	0	0	112.6	P645 T646 I651 G652 L703 L712 C714 C717	P645-M648 HydrophobicContact CB-CB 4.44Å; P645-M648 HydrophobicContact CB-CG 4.38Å; P645-M648 PolarHBondContact O-N 3.36Å; T646-M648 VanDerWaalsContact C-N 3.26Å; T646-M648 PolarHBondContact O-N 2.78Å; M648-I651 HydrophobicContact CE-CD1 3.84Å; M648-I651 HydrophobicContact CE-CG2 4.48Å; M648-I651 PolarHBondContact O-N 3.16Å; M648-I651 HydrophobicContact SD-CD1 3.74Å; M648-G652 PolarHBondContact O-N 2.89Å; M648-G652 VanDerWaalsContact O-N 3.14Å; M648-L703 HydrophobicContact CB-CD2 4.05Å; M648-L703 HydrophobicContact CE-CD2 3.68Å; M648-L712 WeakPolarHBondContact CB-O 3.47Å; M648-L712 WeakPolarHBondContact CE-O 3.44Å; M648-L712 VanDerWaalsContact CG-O 3.25Å; M648-L712 WeakPolarHBondContact CG-O 3.48Å; M648-C714 HydrophobicContact SD-CB 4.49Å; M648-C714 PolarHBondContact SD-SG 2.89Å; M648-C717 WeakPolarHBondContact CE-SG 3.04Å
649	W	96.7	Very high	89.8	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.2	-54.3	168.6	176.2	-93	0	0	0	110.8	V632 A633 P634 P645 T646 D647 I651 G652 V653 F665 V677 A680 L704	V632-W649 PolarHBondContact O-NE1 3.29Å; A633-W649 HydrophobicContact CB-CB 3.77Å; A633-W649 HydrophobicContact CB-CD2 4.39Å; A633-W649 HydrophobicContact CB-CG 3.74Å; P634-W649 HydrophobicContact CG-CD2 4.44Å; P634-W649 HydrophobicContact CG-CE3 4.11Å; P634-W649 HydrophobicContact CG-CH2 3.59Å; P634-W649 HydrophobicContact CG-CZ2 3.97Å; P634-W649 HydrophobicContact CG-CZ3 3.68Å; P645-W649 PolarHBondContact O-N 3.25Å; T646-W649 WeakPolarHBondContact O-CB 3.22Å; T646-W649 PolarHBondContact O-N 3.07Å; D647-W649 VanDerWaalsContact C-N 3.28Å; D647-W649 PolarHBondContact O-N 3.24Å; W649-I651 VanDerWaalsContact C-N 3.27Å; W649-I651 PolarHBondContact O-N 3.42Å; W649-G652 WeakPolarHBondContact O-CA 3.42Å; W649-G652 PolarHBondContact O-N 3.03Å; W649-V653 PolarHBondContact O-N 2.91Å; W649-F665 AromaticContact CE2-CE2 3.78Å; W649-F665 AromaticContact CH2-CE1 3.86Å; W649-F665 HydrophobicContact CH2-CE1 3.86Å; W649-F665 AromaticContact CH2-CE2 3.88Å; W649-F665 HydrophobicContact CH2-CE2 3.88Å; W649-F665 AromaticContact CH2-CZ 3.28Å; W649-F665 HydrophobicContact CH2-CZ 3.28Å; W649-F665 HydrophobicContact CZ2-CD2 4.03Å; W649-F665 AromaticContact CZ2-CE1 3.85Å; W649-F665 HydrophobicContact CZ2-CE1 3.85Å; W649-F665 AromaticContact CZ2-CE2 3.21Å; W649-F665 HydrophobicContact CZ2-CE2 3.21Å; W649-F665 AromaticContact CZ2-CZ 3.13Å; W649-F665 HydrophobicContact CZ2-CZ 3.13Å; W649-F665 HydrophobicContact CZ3-CZ 4.29Å; W649-V677 HydrophobicContact CZ2-CB 4.34Å; W649-V677 HydrophobicContact CZ2-CG1 3.74Å; W649-V677 HydrophobicContact CZ2-CG2 4.38Å; W649-A680 HydrophobicContact CH2-CB 3.94Å; W649-A680 HydrophobicContact CZ3-CB 4.23Å; W649-L704 HydrophobicContact CD2-CD2 4.08Å; W649-L704 HydrophobicContact CE3-CD2 4.17Å; W649-L704 WeakPolarHBondContact O-CD2 3.4Å
650	S	96.4	Very high	91.2	Very high	7 Å²	7	13.6 Å²	13.6	5%	0.049	7%	0.072	C	C	.	.	H	α-helix	trans	-63.3	-31.8	-179	-42.9	0	0	0	0	112.3	L590 F631 D647 G652 V653 I654	L590-S650 WeakPolarHBondContact O-CB 3.21Å; F631-S650 PolarHBondContact O-OG 3.09Å; D647-S650 PolarHBondContact O-N 3.42Å; S650-G652 VanDerWaalsContact C-N 3.34Å; S650-V653 PolarHBondContact O-N 3.1Å; S650-I654 WeakPolarHBondContact O-CB 3.48Å; S650-I654 WeakPolarHBondContact O-CD1 3.33Å; S650-I654 VanDerWaalsContact O-CG1 3.26Å; S650-I654 WeakPolarHBondContact O-CG1 3.33Å; S650-I654 PolarHBondContact O-N 3.33Å
651	I	98	Very high	92.3	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.4	-42.1	169	-68.8	176.1	0	0	0	111.2	M570 I574 V577 L590 D647 M648 W649 I654 C655 L703	M570-I651 HydrophobicContact CE-CG2 3.5Å; M570-I651 VanDerWaalsContact CE-CG2 3.5Å; M570-I651 WeakPolarHBondContact CE-O 3.49Å; I574-I651 HydrophobicContact CD1-CG2 4.28Å; I574-I651 HydrophobicContact CG1-CD1 4.27Å; I574-I651 HydrophobicContact CG1-CG2 3.97Å; V577-I651 HydrophobicContact CB-CD1 4.19Å; V577-I651 HydrophobicContact CG1-CD1 4.11Å; V577-I651 HydrophobicContact CG2-CD1 4.2Å; L590-I651 HydrophobicContact CD2-CD1 4.2Å; L590-I651 HydrophobicContact CD2-CG1 3.36Å; D647-I651 WeakPolarHBondContact O-CG1 3.3Å; D647-I651 PolarHBondContact O-N 2.73Å; M648-I651 HydrophobicContact CE-CD1 3.84Å; M648-I651 HydrophobicContact CE-CG2 4.48Å; M648-I651 PolarHBondContact O-N 3.16Å; M648-I651 HydrophobicContact SD-CD1 3.74Å; W649-I651 VanDerWaalsContact C-N 3.27Å; W649-I651 PolarHBondContact O-N 3.42Å; I651-I654 PolarHBondContact O-N 3.11Å; I651-C655 WeakPolarHBondContact O-CB 3.22Å; I651-C655 PolarHBondContact O-N 3.14Å; I651-L703 HydrophobicContact CG2-CD1 4.02Å
652	G	98.2	Very high	93.4	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.5	-44.6	174	0	0	0	0	0	112.6	M648 W649 S650 C655 Y656	M648-G652 PolarHBondContact O-N 2.89Å; M648-G652 VanDerWaalsContact O-N 3.14Å; W649-G652 WeakPolarHBondContact O-CA 3.42Å; W649-G652 PolarHBondContact O-N 3.03Å; S650-G652 VanDerWaalsContact C-N 3.34Å; G652-C655 WeakPolarHBondContact O-CB 3.47Å; G652-C655 PolarHBondContact O-N 3.14Å; G652-Y656 PolarHBondContact O-N 3.2Å
653	V	97.5	Very high	93.9	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.6	-46.7	177.6	-177.7	0	0	0	0	111	E630 F631 W649 S650 C655 Y656 I657 P664 F665 L704	E630-V653 WeakPolarHBondContact O-CG2 3.16Å; F631-V653 HydrophobicContact CD1-CB 3.97Å; F631-V653 HydrophobicContact CD1-CG1 3.62Å; F631-V653 HydrophobicContact CE1-CB 4.04Å; F631-V653 HydrophobicContact CE1-CG1 3.42Å; F631-V653 VanDerWaalsContact CE1-CG1 3.42Å; F631-V653 HydrophobicContact CG-CG1 4.4Å; F631-V653 HydrophobicContact CZ-CG1 4.08Å; W649-V653 PolarHBondContact O-N 2.91Å; S650-V653 PolarHBondContact O-N 3.1Å; V653-C655 VanDerWaalsContact C-N 3.31Å; V653-C655 PolarHBondContact O-N 3.31Å; V653-Y656 PolarHBondContact O-N 2.99Å; V653-I657 HydrophobicContact CG1-CD1 3.85Å; V653-I657 WeakPolarHBondContact O-CD1 3.49Å; V653-I657 VanDerWaalsContact O-CG1 3.28Å; V653-I657 WeakPolarHBondContact O-CG1 3.22Å; V653-I657 PolarHBondContact O-N 3.45Å; V653-P664 HydrophobicContact CB-CG 4.48Å; V653-P664 HydrophobicContact CG1-CG 4.06Å; V653-P664 HydrophobicContact CG2-CG 4.34Å; V653-F665 HydrophobicContact CG2-CD2 4.37Å; V653-F665 HydrophobicContact CG2-CE2 3.96Å; V653-L704 HydrophobicContact CG2-CD2 3.78Å
654	I	97.3	Very high	94.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.7	-42.6	176.2	-71.2	161.6	0	0	0	110.9	F551 M570 I573 L590 I595 F631 S650 I651 I657 L658	F551-I654 HydrophobicContact CZ-CG2 4.3Å; M570-I654 HydrophobicContact SD-CG2 4.19Å; I573-I654 HydrophobicContact CD1-CG2 4.12Å; L590-I654 HydrophobicContact CD2-CD1 3.88Å; L590-I654 HydrophobicContact CG-CD1 3.71Å; I595-I654 HydrophobicContact CD1-CD1 4.11Å; I595-I654 HydrophobicContact CD1-CG2 4.33Å; F631-I654 HydrophobicContact CD1-CG1 4.34Å; F631-I654 HydrophobicContact CE1-CG1 3.83Å; S650-I654 WeakPolarHBondContact O-CB 3.48Å; S650-I654 WeakPolarHBondContact O-CD1 3.33Å; S650-I654 VanDerWaalsContact O-CG1 3.26Å; S650-I654 WeakPolarHBondContact O-CG1 3.33Å; S650-I654 PolarHBondContact O-N 3.33Å; I651-I654 PolarHBondContact O-N 3.11Å; I654-I657 PolarHBondContact O-N 2.71Å; I654-L658 HydrophobicContact CG2-CD1 3.8Å; I654-L658 HydrophobicContact CG2-CG 4.31Å; I654-L658 WeakPolarHBondContact O-CB 3.4Å; I654-L658 VanDerWaalsContact O-CG 3.27Å; I654-L658 WeakPolarHBondContact O-CG 3.12Å; I654-L658 PolarHBondContact O-N 3.19Å
655	C	98.1	Very high	94.5	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.5	-45.2	177.3	-166.5	0	0	0	0	112.3	M570 I651 G652 V653 L658 L659 I700 W722	M570-C655 HydrophobicContact CE-CB 3.74Å; M570-C655 HydrophobicContact SD-CB 3.99Å; I651-C655 WeakPolarHBondContact O-CB 3.22Å; I651-C655 PolarHBondContact O-N 3.14Å; G652-C655 WeakPolarHBondContact O-CB 3.47Å; G652-C655 PolarHBondContact O-N 3.14Å; V653-C655 VanDerWaalsContact C-N 3.31Å; V653-C655 PolarHBondContact O-N 3.31Å; C655-L658 PolarHBondContact O-N 2.95Å; C655-L659 WeakPolarHBondContact O-CG 3.26Å; C655-L659 PolarHBondContact O-N 3.02Å; C655-I700 HydrophobicContact CB-CD1 4.34Å; C655-I700 HydrophobicContact CB-CG1 4Å; C655-W722 WeakPolarHBondContact SG-CH2 3.15Å; C655-W722 VanDerWaalsContact SG-CZ3 3.52Å
656	Y	97.7	Very high	94	Very high	10 Å²	10	8.2 Å²	8.2	4%	0.039	5%	0.046	C	C	.	.	H	α-helix	trans	-59.3	-47.3	177.7	-173.4	-80	0	0	0	111.6	G652 V653 L659 S660 L662 P664 W682 D683 F684 F689 I700	G652-Y656 PolarHBondContact O-N 3.2Å; V653-Y656 PolarHBondContact O-N 2.99Å; Y656-L659 PolarHBondContact O-N 3.11Å; Y656-S660 PolarHBondContact O-N 2.82Å; Y656-S660 VanDerWaalsContact O-N 3.16Å; Y656-S660 PolarHBondContact O-OG 2.91Å; Y656-L662 WeakPolarHBondContact CD1-O 3.13Å; Y656-L662 HydrophobicContact CE1-CB 3.94Å; Y656-P664 HydrophobicContact CD1-CB 3.73Å; Y656-P664 VanDerWaalsContact CD1-CD 3.5Å; Y656-P664 HydrophobicContact CD1-CG 3.94Å; Y656-P664 HydrophobicContact CD2-CB 3.87Å; Y656-P664 HydrophobicContact CD2-CG 4.49Å; Y656-P664 HydrophobicContact CE1-CB 3.77Å; Y656-P664 HydrophobicContact CE1-CG 4.4Å; Y656-P664 HydrophobicContact CE2-CB 3.92Å; Y656-P664 HydrophobicContact CG-CB 3.77Å; Y656-P664 HydrophobicContact CG-CG 3.97Å; Y656-W682 HydrophobicContact CD2-CE3 4.45Å; Y656-W682 HydrophobicContact CE2-CE3 4.12Å; Y656-D683 WeakPolarHBondContact CE2-O 3.25Å; Y656-D683 PolarHBondContact OH-O 3.11Å; Y656-F684 HydrophobicContact CD2-CD1 4.48Å; Y656-F684 HydrophobicContact CD2-CE1 4.03Å; Y656-F684 AromaticContact CE2-CD1 3.98Å; Y656-F684 HydrophobicContact CE2-CD1 3.98Å; Y656-F684 AromaticContact CE2-CE1 3.97Å; Y656-F684 HydrophobicContact CE2-CE1 3.97Å; Y656-F689 HydrophobicContact CD1-CZ 4.13Å; Y656-F689 HydrophobicContact CD2-CE1 4.38Å; Y656-F689 AromaticContact CD2-CZ 3.74Å; Y656-F689 HydrophobicContact CD2-CZ 3.74Å; Y656-F689 HydrophobicContact CE1-CE2 4.1Å; Y656-F689 AromaticContact CE1-CZ 3.84Å; Y656-F689 HydrophobicContact CE1-CZ 3.84Å; Y656-F689 HydrophobicContact CE2-CE1 4.29Å; Y656-F689 AromaticContact CE2-CE2 3.82Å; Y656-F689 HydrophobicContact CE2-CE2 3.82Å; Y656-F689 AromaticContact CE2-CZ 3.39Å; Y656-F689 HydrophobicContact CE2-CZ 3.39Å; Y656-F689 HydrophobicContact CG-CZ 4.1Å; Y656-F689 AromaticContact CZ-CE2 3.55Å; Y656-F689 AromaticContact CZ-CZ 3.46Å; Y656-F689 VanDerWaalsContact CZ-CZ 3.46Å; Y656-I700 HydrophobicContact CD2-CD1 4.42Å; Y656-I700 HydrophobicContact CD2-CG2 4.16Å
657	I	95.3	Very high	92.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-65.7	-44.4	178.5	-56.5	156.3	0	0	0	110.7	F551 F631 V653 I654 L659 S660 G661 L662 M740 Y743	F551-I657 HydrophobicContact CE1-CB 4.35Å; F551-I657 HydrophobicContact CE1-CG2 3.8Å; F631-I657 HydrophobicContact CE1-CD1 3.76Å; F631-I657 HydrophobicContact CZ-CD1 3.42Å; F631-I657 VanDerWaalsContact CZ-CD1 3.42Å; V653-I657 HydrophobicContact CG1-CD1 3.85Å; V653-I657 WeakPolarHBondContact O-CD1 3.49Å; V653-I657 VanDerWaalsContact O-CG1 3.28Å; V653-I657 WeakPolarHBondContact O-CG1 3.22Å; V653-I657 PolarHBondContact O-N 3.45Å; I654-I657 PolarHBondContact O-N 2.71Å; I657-L659 PolarHBondContact O-N 2.9Å; I657-S660 PolarHBondContact O-N 2.65Å; I657-G661 WeakPolarHBondContact O-CA 3.41Å; I657-G661 PolarHBondContact O-N 2.87Å; I657-L662 VanDerWaalsContact CA-O 3.26Å; I657-L662 WeakPolarHBondContact CA-O 3.47Å; I657-L662 WeakPolarHBondContact CG1-O 3.43Å; I657-M740 HydrophobicContact CG2-CE 4.18Å; I657-M740 HydrophobicContact CG2-SD 4.25Å; I657-M740 WeakPolarHBondContact O-CE 3.02Å; I657-Y743 HydrophobicContact CD1-CE1 4.47Å; I657-Y743 HydrophobicContact CD1-CE2 4.45Å; I657-Y743 HydrophobicContact CG2-CD1 3.72Å; I657-Y743 HydrophobicContact CG2-CE1 3.63Å; I657-Y743 HydrophobicContact CG2-CG 4.25Å
658	L	95.2	Very high	91.4	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-60.2	-29.2	-179.4	-77.3	174.3	0	0	0	113.7	F551 I554 V566 M570 I654 C655	F551-L658 HydrophobicContact CD1-CD2 4.45Å; F551-L658 HydrophobicContact CE1-CD2 3.78Å; F551-L658 HydrophobicContact CE1-CG 4.17Å; F551-L658 HydrophobicContact CE2-CD2 3.99Å; F551-L658 HydrophobicContact CE2-CG 4.43Å; F551-L658 HydrophobicContact CZ-CD1 4.46Å; F551-L658 HydrophobicContact CZ-CD2 3.53Å; F551-L658 HydrophobicContact CZ-CG 3.71Å; I554-L658 HydrophobicContact CD1-CD2 3.52Å; V566-L658 HydrophobicContact CG1-CB 3.68Å; V566-L658 HydrophobicContact CG1-CD1 4.22Å; V566-L658 HydrophobicContact CG2-CB 4.11Å; M570-L658 HydrophobicContact SD-CD1 3.8Å; I654-L658 HydrophobicContact CG2-CD1 3.8Å; I654-L658 HydrophobicContact CG2-CG 4.31Å; I654-L658 WeakPolarHBondContact O-CB 3.4Å; I654-L658 VanDerWaalsContact O-CG 3.27Å; I654-L658 WeakPolarHBondContact O-CG 3.12Å; I654-L658 PolarHBondContact O-N 3.19Å; C655-L658 PolarHBondContact O-N 2.95Å
659	L	95.4	Very high	89.6	Confident	6 Å²	6	17.9 Å²	17.9	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-85.5	-37	178.1	-66.2	172.7	0	0	0	113.5	E563 V566 C655 Y656 I657 I692 A696 I700 W722 L735	E563-L659 HydrophobicContact CB-CD2 4.49Å; E563-L659 HydrophobicContact CG-CD2 3.98Å; V566-L659 HydrophobicContact CB-CD2 3.93Å; V566-L659 HydrophobicContact CG1-CD2 3.81Å; V566-L659 HydrophobicContact CG1-CG 4.14Å; V566-L659 HydrophobicContact CG2-CD2 4.02Å; C655-L659 WeakPolarHBondContact O-CG 3.26Å; C655-L659 PolarHBondContact O-N 3.02Å; Y656-L659 PolarHBondContact O-N 3.11Å; I657-L659 PolarHBondContact O-N 2.9Å; L659-I692 HydrophobicContact CB-CD1 4.01Å; L659-I692 HydrophobicContact CD1-CG2 4.08Å; L659-I692 HydrophobicContact CD2-CD1 4.21Å; L659-A696 HydrophobicContact CD1-CB 3.8Å; L659-I700 HydrophobicContact CD1-CD1 3.9Å; L659-W722 HydrophobicContact CD1-CZ2 4.27Å; L659-W722 HydrophobicContact CD2-CZ2 4.25Å; L659-L735 HydrophobicContact CD2-CD1 4.16Å
660	S	93.5	Very high	87.9	Confident	4 Å²	4	22.1 Å²	22.1	3%	0.028	12%	0.122	C	C	.	.	H	α-helix	trans	-111.5	-23.9	-168.4	64	0	0	0	0	115.6	Y656 I657 L662 F689 R739	Y656-S660 PolarHBondContact O-N 2.82Å; Y656-S660 VanDerWaalsContact O-N 3.16Å; Y656-S660 PolarHBondContact O-OG 2.91Å; I657-S660 PolarHBondContact O-N 2.65Å; S660-L662 PolarHBondContact O-N 2.88Å; S660-L662 WeakPolarHBondContact OG-CB 3.4Å; S660-L662 PolarHBondContact OG-N 2.84Å; S660-F689 VanDerWaalsContact CB-CZ 3.41Å; S660-R739 VanDerWaalsContact O-CB 3.29Å; S660-R739 WeakPolarHBondContact O-CB 3.21Å
661	G	90.1	Very high	86.1	Confident	4 Å²	4	26.4 Å²	26.4	4%	0.041	15%	0.145	C	C	.	.	S	Bend	trans	68.8	15.2	-164.7	0	0	0	0	0	114.4	I657 R739 Y743	I657-G661 WeakPolarHBondContact O-CA 3.41Å; I657-G661 PolarHBondContact O-N 2.87Å; G661-R739 CarbonylContact O-C 3.53Å; G661-Y743 WeakPolarHBondContact O-CB 3.39Å
662	L	90	Very high	84.5	Confident	48 Å²	48	28.6 Å²	28.6	25%	0.251	16%	0.155	S	C	.	.	S	Bend	trans	-111.2	158.1	175.8	-60.4	177.2	0	0	0	110.6	Y656 I657 S660 D686	Y656-L662 WeakPolarHBondContact CD1-O 3.13Å; Y656-L662 HydrophobicContact CE1-CB 3.94Å; I657-L662 VanDerWaalsContact CA-O 3.26Å; I657-L662 WeakPolarHBondContact CA-O 3.47Å; I657-L662 WeakPolarHBondContact CG1-O 3.43Å; S660-L662 PolarHBondContact O-N 2.88Å; S660-L662 WeakPolarHBondContact OG-CB 3.4Å; S660-L662 PolarHBondContact OG-N 2.84Å; L662-D686 HydrophobicContact CD1-CB 3.97Å
663	S	90.1	Very high	83.3	Confident	16 Å²	16	28.7 Å²	28.7	11%	0.112	16%	0.156	C	C	.	.			trans	-100.4	132.7	168.8	165.7	0	0	0	0	109.8	E630 F665	E630-S663 WeakPolarHBondContact OE2-CB 3.35Å; E630-S663 PolarHBondContact OE2-OG 2.99Å; S663-F665 VanDerWaalsContact C-N 3.3Å; S663-F665 PolarHBondContact O-N 3.39Å
664	P	92.1	Very high	81.8	Confident	12 Å²	12	30.5 Å²	30.5	8%	0.078	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.4	-169.8	23.5	-29.9	0	0	0	114.6	V653 Y656 W682 L704	V653-P664 HydrophobicContact CB-CG 4.48Å; V653-P664 HydrophobicContact CG1-CG 4.06Å; V653-P664 HydrophobicContact CG2-CG 4.34Å; Y656-P664 HydrophobicContact CD1-CB 3.73Å; Y656-P664 VanDerWaalsContact CD1-CD 3.5Å; Y656-P664 HydrophobicContact CD1-CG 3.94Å; Y656-P664 HydrophobicContact CD2-CB 3.87Å; Y656-P664 HydrophobicContact CD2-CG 4.49Å; Y656-P664 HydrophobicContact CE1-CB 3.77Å; Y656-P664 HydrophobicContact CE1-CG 4.4Å; Y656-P664 HydrophobicContact CE2-CB 3.92Å; Y656-P664 HydrophobicContact CG-CB 3.77Å; Y656-P664 HydrophobicContact CG-CG 3.97Å; P664-W682 HydrophobicContact CB-CB 4.02Å; P664-W682 VanDerWaalsContact O-CB 3.24Å; P664-W682 WeakPolarHBondContact O-CB 3.42Å; P664-L704 HydrophobicContact CB-CD1 4.14Å; P664-L704 HydrophobicContact CG-CD1 4.13Å
665	F	89.1	Confident	80.5	Confident	2 Å²	2	33 Å²	33	1%	0.009	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-0.9	-174.1	-60.8	-67	0	0	0	113.9	W649 V653 S663 G667 T673 N676 V677 T681 W682 L704	W649-F665 AromaticContact CE2-CE2 3.78Å; W649-F665 AromaticContact CH2-CE1 3.86Å; W649-F665 HydrophobicContact CH2-CE1 3.86Å; W649-F665 AromaticContact CH2-CE2 3.88Å; W649-F665 HydrophobicContact CH2-CE2 3.88Å; W649-F665 AromaticContact CH2-CZ 3.28Å; W649-F665 HydrophobicContact CH2-CZ 3.28Å; W649-F665 HydrophobicContact CZ2-CD2 4.03Å; W649-F665 AromaticContact CZ2-CE1 3.85Å; W649-F665 HydrophobicContact CZ2-CE1 3.85Å; W649-F665 AromaticContact CZ2-CE2 3.21Å; W649-F665 HydrophobicContact CZ2-CE2 3.21Å; W649-F665 AromaticContact CZ2-CZ 3.13Å; W649-F665 HydrophobicContact CZ2-CZ 3.13Å; W649-F665 HydrophobicContact CZ3-CZ 4.29Å; V653-F665 HydrophobicContact CG2-CD2 4.37Å; V653-F665 HydrophobicContact CG2-CE2 3.96Å; S663-F665 VanDerWaalsContact C-N 3.3Å; S663-F665 PolarHBondContact O-N 3.39Å; F665-G667 PolarHBondContact O-N 3.19Å; F665-G667 VanDerWaalsContact O-N 3.12Å; F665-T673 HydrophobicContact CB-CG2 4.37Å; F665-T673 WeakPolarHBondContact O-CA 3.5Å; F665-N676 HydrophobicContact CB-CB 4.1Å; F665-N676 HydrophobicContact CD1-CB 4.12Å; F665-N676 WeakPolarHBondContact CD1-O 3.4Å; F665-N676 WeakPolarHBondContact O-CB 3.47Å; F665-N676 PolarHBondContact O-ND2 2.99Å; F665-V677 HydrophobicContact CB-CG2 3.71Å; F665-V677 HydrophobicContact CD1-CG2 4.14Å; F665-V677 HydrophobicContact CD2-CG2 3.79Å; F665-V677 HydrophobicContact CG-CG2 3.59Å; F665-T681 WeakPolarHBondContact CD1-O 3.37Å; F665-W682 HydrophobicContact CD1-CB 4.2Å; F665-W682 HydrophobicContact CE1-CB 3.77Å; F665-W682 AromaticContact CE1-CD1 3.51Å; F665-W682 AromaticContact CE1-CG 3.89Å; F665-W682 HydrophobicContact CE1-CG 3.89Å; F665-W682 HydrophobicContact CZ-CB 4.24Å; F665-W682 AromaticContact CZ-CD1 3.67Å; F665-W682 HydrophobicContact CZ-CG 4.05Å; F665-L704 HydrophobicContact CE2-CD1 4.32Å; F665-L704 HydrophobicContact CE2-CD2 4.12Å; F665-L704 HydrophobicContact CZ-CD1 4.25Å; F665-L704 HydrophobicContact CZ-CD2 4.28Å
666	M	80.9	Confident	79.6	Confident	54 Å²	54	34.8 Å²	34.8	27%	0.266	20%	0.195	S	C	.	.			trans	-61.1	112.1	-168.1	-174.3	66.8	73.4	0	0	112.9	E630 R746	E630-M666 WeakPolarHBondContact OE2-CE 3.31Å; M666-R746 PolarHBondContact SD-NH1 2.89Å; M666-R746 PolarHBondContact SD-NH2 2.78Å
667	G	66.6	Low	78.9	Confident	10 Å²	10	34.3 Å²	34.3	10%	0.103	19%	0.193	C	C	.	.			trans	-89.7	-174.4	170.3	0	0	0	0	0	113.6	F665 N669 T673	F665-G667 PolarHBondContact O-N 3.19Å; F665-G667 VanDerWaalsContact O-N 3.12Å; G667-N669 PolarHBondContact O-N 2.81Å; G667-T673 PolarHBondContact N-OG1 3.17Å
668	D	63.8	Low	78	Confident	125 Å²	125	36.1 Å²	36.1	67%	0.668	20%	0.204	S	C	*	.	S	Bend	trans	-65.1	-21.3	170.8	-64.9	-38.2	0	0	0	111.6	K154 E672	K154-D668 IonicContact NZ-OD2 3.06Å; K154-D668 PolarHBondContact NZ-OD2 3.43Å; D668-E672 WeakPolarHBondContact CB-OE2 3.4Å; D668-E672 PolarHBondContact N-OE2 3.26Å
669	N	59.3	Low	77.3	Confident	77 Å²	77	38.9 Å²	38.9	41%	0.412	22%	0.224	S	C	.	.	S	Bend	trans	-154.8	172.8	-176.5	61.3	82.3	0	0	0	111.4	G667 N671 E672 T673	G667-N669 PolarHBondContact O-N 2.81Å; N669-N671 PolarHBondContact O-N 3.22Å; N669-N671 WeakPolarHBondContact OD1-CA 3.49Å; N669-N671 WeakPolarHBondContact OD1-CB 3.5Å; N669-N671 PolarHBondContact OD1-N 2.6Å; N669-E672 PolarHBondContact O-N 2.72Å; N669-E672 PolarHBondContact OD1-N 3.3Å; N669-T673 PolarHBondContact O-N 3.25Å; N669-T673 PolarHBondContact O-OG1 3.23Å
670	D	61.2	Low	77	Confident	89 Å²	89	39.5 Å²	39.5	48%	0.476	23%	0.23	S	C	.	.	H	α-helix	trans	-68.1	-30.9	-177	-65.2	-39.3	0	0	0	113.4	P629 T673 L674	P629-D670 HydrophobicContact CG-CB 4.2Å; D670-T673 PolarHBondContact O-N 2.75Å; D670-L674 WeakPolarHBondContact O-CB 3.41Å; D670-L674 VanDerWaalsContact O-CG 3.26Å; D670-L674 WeakPolarHBondContact O-CG 3.33Å; D670-L674 PolarHBondContact O-N 3.47Å
671	N	59.7	Low	76.8	Confident	97 Å²	97	43.2 Å²	43.2	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-68.4	-40.8	176.5	-69.4	-23	0	0	0	111.6	N669 L674 A675	N669-N671 PolarHBondContact O-N 3.22Å; N669-N671 WeakPolarHBondContact OD1-CA 3.49Å; N669-N671 WeakPolarHBondContact OD1-CB 3.5Å; N669-N671 PolarHBondContact OD1-N 2.6Å; N671-L674 PolarHBondContact O-N 3.42Å; N671-A675 WeakPolarHBondContact O-CB 3.44Å; N671-A675 PolarHBondContact O-N 2.79Å
672	E	63.8	Low	77	Confident	46 Å²	46	45.3 Å²	45.3	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-67.7	-37.3	173	-175.2	167.9	-143.1	0	0	111.5	K154 D668 N669 A675 N676	K154-E672 IonicContact NZ-OE1 3.72Å; K154-E672 PolarHBondContact NZ-OE1 3.31Å; K154-E672 IonicContact NZ-OE2 3.7Å; K154-E672 PolarHBondContact NZ-OE2 3.02Å; D668-E672 WeakPolarHBondContact CB-OE2 3.4Å; D668-E672 PolarHBondContact N-OE2 3.26Å; N669-E672 PolarHBondContact O-N 2.72Å; N669-E672 PolarHBondContact OD1-N 3.3Å; E672-A675 WeakPolarHBondContact O-CB 3.49Å; E672-A675 PolarHBondContact O-N 3.21Å; E672-N676 WeakPolarHBondContact O-CB 3.22Å; E672-N676 VanDerWaalsContact O-CG 3.22Å; E672-N676 PolarHBondContact O-N 3.01Å; E672-N676 PolarHBondContact O-ND2 3.47Å
673	T	72.1	Confident	77.2	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-44.1	174.1	-54.3	0	0	0	0	111.6	P629 E630 F665 G667 N669 D670 N676 V677	P629-T673 HydrophobicContact CB-CG2 4.24Å; P629-T673 HydrophobicContact CG-CG2 3.94Å; E630-T673 HydrophobicContact CB-CG2 4.13Å; F665-T673 HydrophobicContact CB-CG2 4.37Å; F665-T673 WeakPolarHBondContact O-CA 3.5Å; G667-T673 PolarHBondContact N-OG1 3.17Å; N669-T673 PolarHBondContact O-N 3.25Å; N669-T673 PolarHBondContact O-OG1 3.23Å; D670-T673 PolarHBondContact O-N 2.75Å; T673-N676 PolarHBondContact O-N 3.38Å; T673-V677 WeakPolarHBondContact O-CG2 3.45Å; T673-V677 PolarHBondContact O-N 3.35Å
674	L	67.4	Low	77.4	Confident	37 Å²	37	48.5 Å²	48.5	19%	0.194	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-38.1	173.2	-74.1	168	0	0	0	112.1	F626 P629 I637 D670 N671 V677 T678	F626-L674 HydrophobicContact CD1-CD2 3.94Å; F626-L674 HydrophobicContact CE1-CD2 4.23Å; P629-L674 HydrophobicContact CB-CD2 3.56Å; P629-L674 HydrophobicContact CB-CG 3.73Å; I637-L674 HydrophobicContact CD1-CD2 3.56Å; I637-L674 HydrophobicContact CG1-CD2 3.96Å; D670-L674 WeakPolarHBondContact O-CB 3.41Å; D670-L674 VanDerWaalsContact O-CG 3.26Å; D670-L674 WeakPolarHBondContact O-CG 3.33Å; D670-L674 PolarHBondContact O-N 3.47Å; N671-L674 PolarHBondContact O-N 3.42Å; L674-V677 PolarHBondContact O-N 3.02Å; L674-T678 VanDerWaalsContact O-CB 3.26Å; L674-T678 WeakPolarHBondContact O-CB 3.32Å; L674-T678 PolarHBondContact O-N 3.21Å; L674-T678 PolarHBondContact O-OG1 2.97Å
675	A	69.4	Low	77.3	Confident	53 Å²	53	56.2 Å²	56.2	44%	0.438	31%	0.308	S	S	.	.	H	α-helix	trans	-63.1	-47.8	175.4	0	0	0	0	0	111.3	N671 E672 V677 T678 S679	N671-A675 WeakPolarHBondContact O-CB 3.44Å; N671-A675 PolarHBondContact O-N 2.79Å; E672-A675 WeakPolarHBondContact O-CB 3.49Å; E672-A675 PolarHBondContact O-N 3.21Å; A675-V677 PolarHBondContact O-N 2.67Å; A675-T678 WeakPolarHBondContact O-CB 3Å; A675-T678 PolarHBondContact O-N 3.05Å; A675-T678 VanDerWaalsContact O-N 3.09Å; A675-S679 PolarHBondContact O-N 3.09Å; A675-S679 PolarHBondContact O-OG 2.76Å; A675-S679 VanDerWaalsContact O-OG 3.06Å
676	N	78.4	Confident	77.4	Confident	37 Å²	37	58.4 Å²	58.4	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-41.5	177.1	-69.3	-20.9	0	0	0	112.3	F665 E672 T673 S679 A680 T681	F665-N676 HydrophobicContact CB-CB 4.1Å; F665-N676 HydrophobicContact CD1-CB 4.12Å; F665-N676 WeakPolarHBondContact CD1-O 3.4Å; F665-N676 WeakPolarHBondContact O-CB 3.47Å; F665-N676 PolarHBondContact O-ND2 2.99Å; E672-N676 WeakPolarHBondContact O-CB 3.22Å; E672-N676 VanDerWaalsContact O-CG 3.22Å; E672-N676 PolarHBondContact O-N 3.01Å; E672-N676 PolarHBondContact O-ND2 3.47Å; T673-N676 PolarHBondContact O-N 3.38Å; N676-S679 PolarHBondContact O-OG 3.49Å; N676-A680 CarbonylContact O-C 3.52Å; N676-A680 VanDerWaalsContact O-CA 3.3Å; N676-A680 WeakPolarHBondContact O-CA 3.3Å; N676-A680 PolarHBondContact O-N 2.88Å; N676-T681 PolarHBondContact O-N 3.14Å
677	V	82.5	Confident	77.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-49.9	170.6	171.5	0	0	0	0	110.3	V632 P634 I637 W649 F665 T673 L674 A675 S679 A680	V632-V677 WeakPolarHBondContact O-CG1 3.37Å; P634-V677 HydrophobicContact CG-CG1 4.18Å; P634-V677 WeakPolarHBondContact CG-O 3.24Å; I637-V677 HydrophobicContact CD1-CB 3.77Å; I637-V677 HydrophobicContact CD1-CG1 3.38Å; W649-V677 HydrophobicContact CZ2-CB 4.34Å; W649-V677 HydrophobicContact CZ2-CG1 3.74Å; W649-V677 HydrophobicContact CZ2-CG2 4.38Å; F665-V677 HydrophobicContact CB-CG2 3.71Å; F665-V677 HydrophobicContact CD1-CG2 4.14Å; F665-V677 HydrophobicContact CD2-CG2 3.79Å; F665-V677 HydrophobicContact CG-CG2 3.59Å; T673-V677 WeakPolarHBondContact O-CG2 3.45Å; T673-V677 PolarHBondContact O-N 3.35Å; L674-V677 PolarHBondContact O-N 3.02Å; A675-V677 PolarHBondContact O-N 2.67Å; V677-S679 VanDerWaalsContact C-N 3.32Å; V677-S679 PolarHBondContact O-N 2.77Å; V677-A680 PolarHBondContact O-N 3.31Å
678	T	77.9	Confident	78.8	Confident	38 Å²	38	62.8 Å²	62.8	23%	0.233	34%	0.341	C	S	.	.	H	α-helix	trans	-62.6	-34.4	-175.4	-59.9	0	0	0	0	113.1	N638 L674 A675 K706	N638-T678 WeakPolarHBondContact OD1-CG2 3.47Å; L674-T678 VanDerWaalsContact O-CB 3.26Å; L674-T678 WeakPolarHBondContact O-CB 3.32Å; L674-T678 PolarHBondContact O-N 3.21Å; L674-T678 PolarHBondContact O-OG1 2.97Å; A675-T678 WeakPolarHBondContact O-CB 3Å; A675-T678 PolarHBondContact O-N 3.05Å; A675-T678 VanDerWaalsContact O-N 3.09Å; T678-K706 WeakPolarHBondContact O-CE 3.39Å; T678-K706 PolarHBondContact O-NZ 2.59Å
679	S	79.6	Confident	80.2	Confident	59 Å²	59	56.9 Å²	56.9	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-83.5	-15.2	171.9	58	0	0	0	0	113.6	A675 N676 V677 T681	A675-S679 PolarHBondContact O-N 3.09Å; A675-S679 PolarHBondContact O-OG 2.76Å; A675-S679 VanDerWaalsContact O-OG 3.06Å; N676-S679 PolarHBondContact O-OG 3.49Å; V677-S679 VanDerWaalsContact C-N 3.32Å; V677-S679 PolarHBondContact O-N 2.77Å; S679-T681 VanDerWaalsContact C-N 3.32Å; S679-T681 WeakPolarHBondContact CB-OG1 3.3Å; S679-T681 VanDerWaalsContact OG-CB 3.3Å; S679-T681 WeakPolarHBondContact OG-CB 3.26Å; S679-T681 PolarHBondContact OG-N 3.29Å; S679-T681 PolarHBondContact OG-OG1 2.95Å
680	A	89.9	Confident	81.6	Confident	20 Å²	20	59.7 Å²	59.7	17%	0.165	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	45.7	-162.6	0	0	0	0	0	112.6	W649 N676 V677 W682 K706	W649-A680 HydrophobicContact CH2-CB 3.94Å; W649-A680 HydrophobicContact CZ3-CB 4.23Å; N676-A680 CarbonylContact O-C 3.52Å; N676-A680 VanDerWaalsContact O-CA 3.3Å; N676-A680 WeakPolarHBondContact O-CA 3.3Å; N676-A680 PolarHBondContact O-N 2.88Å; V677-A680 PolarHBondContact O-N 3.31Å; A680-W682 VanDerWaalsContact O-CD1 3.32Å; A680-K706 HydrophobicContact CB-CB 3.84Å
681	T	89.4	Confident	82.9	Confident	81 Å²	81	61.7 Å²	61.7	50%	0.497	33%	0.331	S	S	.	.			trans	-88.9	112.4	174.8	-61.6	0	0	0	0	110.3	F665 N676 S679	F665-T681 WeakPolarHBondContact CD1-O 3.37Å; N676-T681 PolarHBondContact O-N 3.14Å; S679-T681 VanDerWaalsContact C-N 3.32Å; S679-T681 WeakPolarHBondContact CB-OG1 3.3Å; S679-T681 VanDerWaalsContact OG-CB 3.3Å; S679-T681 WeakPolarHBondContact OG-CB 3.26Å; S679-T681 PolarHBondContact OG-N 3.29Å; S679-T681 PolarHBondContact OG-OG1 2.95Å
682	W	94.3	Very high	84.4	Confident	48 Å²	48	57.3 Å²	57.3	18%	0.182	31%	0.307	C	S	.	.			trans	-162	162.9	177.3	64.2	-82.7	0	0	0	108.4	Y656 P664 F665 A680 F684 I700 L704	Y656-W682 HydrophobicContact CD2-CE3 4.45Å; Y656-W682 HydrophobicContact CE2-CE3 4.12Å; P664-W682 HydrophobicContact CB-CB 4.02Å; P664-W682 VanDerWaalsContact O-CB 3.24Å; P664-W682 WeakPolarHBondContact O-CB 3.42Å; F665-W682 HydrophobicContact CD1-CB 4.2Å; F665-W682 HydrophobicContact CE1-CB 3.77Å; F665-W682 AromaticContact CE1-CD1 3.51Å; F665-W682 AromaticContact CE1-CG 3.89Å; F665-W682 HydrophobicContact CE1-CG 3.89Å; F665-W682 HydrophobicContact CZ-CB 4.24Å; F665-W682 AromaticContact CZ-CD1 3.67Å; F665-W682 HydrophobicContact CZ-CG 4.05Å; A680-W682 VanDerWaalsContact O-CD1 3.32Å; W682-F684 AromaticContact CH2-CE2 3.86Å; W682-F684 HydrophobicContact CH2-CE2 3.86Å; W682-F684 AromaticContact CH2-CZ 3.82Å; W682-F684 HydrophobicContact CH2-CZ 3.82Å; W682-F684 HydrophobicContact CZ3-CD1 4.25Å; W682-F684 HydrophobicContact CZ3-CD2 4.1Å; W682-F684 AromaticContact CZ3-CE1 3.77Å; W682-F684 HydrophobicContact CZ3-CE1 3.77Å; W682-F684 AromaticContact CZ3-CE2 3.58Å; W682-F684 HydrophobicContact CZ3-CE2 3.58Å; W682-F684 HydrophobicContact CZ3-CG 4.42Å; W682-F684 AromaticContact CZ3-CZ 3.4Å; W682-F684 HydrophobicContact CZ3-CZ 3.4Å; W682-F684 VanDerWaalsContact CZ3-CZ 3.4Å; W682-I700 HydrophobicContact CH2-CG2 3.89Å; W682-I700 HydrophobicContact CZ3-CG2 3.92Å; W682-L704 HydrophobicContact CD2-CB 4.29Å; W682-L704 HydrophobicContact CD2-CD1 4.02Å; W682-L704 HydrophobicContact CE3-CD1 4.34Å; W682-L704 HydrophobicContact CG-CD1 4.4Å; W682-L704 HydrophobicContact CZ2-CB 3.71Å; W682-L704 HydrophobicContact CZ2-CD1 4.48Å; W682-L704 PolarHBondContact NE1-O 3.01Å
683	D	93.1	Very high	85.9	Confident	81 Å²	81	56.7 Å²	56.7	43%	0.433	31%	0.308	S	S	.	.			trans	-150.6	-168.9	-175.3	65.4	77.6	0	0	0	113.4	Y656 E685	Y656-D683 WeakPolarHBondContact CE2-O 3.25Å; Y656-D683 PolarHBondContact OH-O 3.11Å; D683-E685 HydrophobicContact CB-CG 4.46Å; D683-E685 PolarHBondContact OD1-N 2.88Å
684	F	95.2	Very high	86.9	Confident	50 Å²	50	62.8 Å²	62.8	22%	0.219	34%	0.336	C	S	.	.			trans	-133.1	27.9	173	-60.8	-63	0	0	0	111.8	Y656 W682 D686 F689 K697 I700	Y656-F684 HydrophobicContact CD2-CD1 4.48Å; Y656-F684 HydrophobicContact CD2-CE1 4.03Å; Y656-F684 AromaticContact CE2-CD1 3.98Å; Y656-F684 HydrophobicContact CE2-CD1 3.98Å; Y656-F684 AromaticContact CE2-CE1 3.97Å; Y656-F684 HydrophobicContact CE2-CE1 3.97Å; W682-F684 AromaticContact CH2-CE2 3.86Å; W682-F684 HydrophobicContact CH2-CE2 3.86Å; W682-F684 AromaticContact CH2-CZ 3.82Å; W682-F684 HydrophobicContact CH2-CZ 3.82Å; W682-F684 HydrophobicContact CZ3-CD1 4.25Å; W682-F684 HydrophobicContact CZ3-CD2 4.1Å; W682-F684 AromaticContact CZ3-CE1 3.77Å; W682-F684 HydrophobicContact CZ3-CE1 3.77Å; W682-F684 AromaticContact CZ3-CE2 3.58Å; W682-F684 HydrophobicContact CZ3-CE2 3.58Å; W682-F684 HydrophobicContact CZ3-CG 4.42Å; W682-F684 AromaticContact CZ3-CZ 3.4Å; W682-F684 HydrophobicContact CZ3-CZ 3.4Å; W682-F684 VanDerWaalsContact CZ3-CZ 3.4Å; F684-D686 VanDerWaalsContact C-N 3.28Å; F684-D686 PolarHBondContact O-N 2.68Å; F684-F689 HydrophobicContact CB-CB 4.22Å; F684-F689 HydrophobicContact CB-CD2 4.33Å; F684-F689 HydrophobicContact CB-CG 4.17Å; F684-F689 AromaticContact CD1-CD1 3.58Å; F684-F689 HydrophobicContact CD1-CD1 3.58Å; F684-F689 HydrophobicContact CD1-CD2 4.08Å; F684-F689 AromaticContact CD1-CE1 3.59Å; F684-F689 HydrophobicContact CD1-CE1 3.59Å; F684-F689 HydrophobicContact CD1-CE2 4.08Å; F684-F689 AromaticContact CD1-CG 3.83Å; F684-F689 HydrophobicContact CD1-CG 3.83Å; F684-F689 AromaticContact CD1-CZ 3.84Å; F684-F689 HydrophobicContact CD1-CZ 3.84Å; F684-F689 HydrophobicContact CE1-CD1 4.08Å; F684-F689 AromaticContact CE1-CE1 3.79Å; F684-F689 HydrophobicContact CE1-CE1 3.79Å; F684-F689 HydrophobicContact CE1-CZ 4.21Å; F684-F689 HydrophobicContact CG-CD1 4.48Å; F684-F689 HydrophobicContact CG-CG 4.44Å; F684-K697 HydrophobicContact CD1-CG 4.46Å; F684-K697 HydrophobicContact CD2-CB 4.13Å; F684-K697 HydrophobicContact CD2-CD 4.43Å; F684-K697 HydrophobicContact CD2-CG 4.21Å; F684-K697 HydrophobicContact CE1-CB 4.49Å; F684-K697 HydrophobicContact CE1-CG 4.3Å; F684-K697 HydrophobicContact CE2-CB 3.6Å; F684-K697 HydrophobicContact CE2-CG 4.06Å; F684-K697 HydrophobicContact CG-CG 4.41Å; F684-K697 HydrophobicContact CZ-CB 3.79Å; F684-K697 HydrophobicContact CZ-CG 4.09Å; F684-K697 WeakPolarHBondContact CZ-O 3.35Å; F684-I700 HydrophobicContact CE1-CB 4.45Å; F684-I700 HydrophobicContact CE1-CD1 4.27Å; F684-I700 HydrophobicContact CE1-CG2 4.13Å; F684-I700 HydrophobicContact CZ-CB 3.99Å; F684-I700 HydrophobicContact CZ-CG2 3.85Å
685	E	88.7	Confident	88.3	Confident	174 Å²	174	64.1 Å²	64.1	81%	0.813	34%	0.344	S	S	*	.			trans	-76.4	-10.2	-175.4	-64	-163	172.6	0	0	113.7	D683	D683-E685 HydrophobicContact CB-CG 4.46Å; D683-E685 PolarHBondContact OD1-N 2.88Å
686	D	91.3	Very high	89.6	Confident	48 Å²	48	61.6 Å²	61.6	26%	0.257	32%	0.323	S	S	.	.	S	Bend	trans	-79.9	135.9	177	-178.9	-74.9	0	0	0	112.8	L662 F684 A688 F689 R739	L662-D686 HydrophobicContact CD1-CB 3.97Å; F684-D686 VanDerWaalsContact C-N 3.28Å; F684-D686 PolarHBondContact O-N 2.68Å; D686-A688 PolarHBondContact O-N 3.3Å; D686-A688 WeakPolarHBondContact OD1-CB 3.34Å; D686-A688 PolarHBondContact OD1-N 3.23Å; D686-F689 PolarHBondContact O-N 2.87Å; D686-R739 IonicContact OD1-CZ 2.86Å; D686-R739 IonicContact OD1-NE 3.84Å; D686-R739 IonicContact OD1-NH1 3.39Å; D686-R739 PolarHBondContact OD1-NH1 2.89Å; D686-R739 IonicContact OD1-NH2 2.73Å; D686-R739 PolarHBondContact OD1-NH2 2.74Å; D686-R739 VanDerWaalsContact OD1-NH2 3.11Å; D686-R739 IonicContact OD2-CZ 2.7Å; D686-R739 IonicContact OD2-NH1 3.98Å; D686-R739 PolarHBondContact OD2-NH1 3.35Å; D686-R739 IonicContact OD2-NH2 3.6Å; D686-R739 PolarHBondContact OD2-NH2 3.36Å
687	E	89.4	Confident	90.5	Very high	132 Å²	132	61.2 Å²	61.2	62%	0.617	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-45.1	-25.1	177.3	52.9	164.9	-146.9	0	0	115.5	F689 D690 R739	E687-F689 PolarHBondContact O-N 3.23Å; E687-F689 VanDerWaalsContact O-N 3.11Å; E687-D690 WeakPolarHBondContact O-CB 3.31Å; E687-D690 PolarHBondContact O-N 3.1Å; E687-D690 VanDerWaalsContact O-N 3.13Å; E687-R739 IonicContact OE1-CZ 2.74Å; E687-R739 IonicContact OE1-NE 2.75Å; E687-R739 IonicContact OE1-NH2 3.2Å; E687-R739 PolarHBondContact OE1-NH2 3.21Å
688	A	88.3	Confident	91.2	Very high	24 Å²	24	64.7 Å²	64.7	20%	0.198	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-61.2	-16.4	174.1	0	0	0	0	0	113.4	D686 I692	D686-A688 PolarHBondContact O-N 3.3Å; D686-A688 WeakPolarHBondContact OD1-CB 3.34Å; D686-A688 PolarHBondContact OD1-N 3.23Å; A688-I692 WeakPolarHBondContact O-CG1 3.15Å
689	F	92.3	Very high	92.2	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.009	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-99.9	-2	177.3	-68.6	-76.6	0	0	0	114.7	Y656 S660 F684 D686 E687 E691 I692 K697	Y656-F689 HydrophobicContact CD1-CZ 4.13Å; Y656-F689 HydrophobicContact CD2-CE1 4.38Å; Y656-F689 AromaticContact CD2-CZ 3.74Å; Y656-F689 HydrophobicContact CD2-CZ 3.74Å; Y656-F689 HydrophobicContact CE1-CE2 4.1Å; Y656-F689 AromaticContact CE1-CZ 3.84Å; Y656-F689 HydrophobicContact CE1-CZ 3.84Å; Y656-F689 HydrophobicContact CE2-CE1 4.29Å; Y656-F689 AromaticContact CE2-CE2 3.82Å; Y656-F689 HydrophobicContact CE2-CE2 3.82Å; Y656-F689 AromaticContact CE2-CZ 3.39Å; Y656-F689 HydrophobicContact CE2-CZ 3.39Å; Y656-F689 HydrophobicContact CG-CZ 4.1Å; Y656-F689 AromaticContact CZ-CE2 3.55Å; Y656-F689 AromaticContact CZ-CZ 3.46Å; Y656-F689 VanDerWaalsContact CZ-CZ 3.46Å; S660-F689 VanDerWaalsContact CB-CZ 3.41Å; F684-F689 HydrophobicContact CB-CB 4.22Å; F684-F689 HydrophobicContact CB-CD2 4.33Å; F684-F689 HydrophobicContact CB-CG 4.17Å; F684-F689 AromaticContact CD1-CD1 3.58Å; F684-F689 HydrophobicContact CD1-CD1 3.58Å; F684-F689 HydrophobicContact CD1-CD2 4.08Å; F684-F689 AromaticContact CD1-CE1 3.59Å; F684-F689 HydrophobicContact CD1-CE1 3.59Å; F684-F689 HydrophobicContact CD1-CE2 4.08Å; F684-F689 AromaticContact CD1-CG 3.83Å; F684-F689 HydrophobicContact CD1-CG 3.83Å; F684-F689 AromaticContact CD1-CZ 3.84Å; F684-F689 HydrophobicContact CD1-CZ 3.84Å; F684-F689 HydrophobicContact CE1-CD1 4.08Å; F684-F689 AromaticContact CE1-CE1 3.79Å; F684-F689 HydrophobicContact CE1-CE1 3.79Å; F684-F689 HydrophobicContact CE1-CZ 4.21Å; F684-F689 HydrophobicContact CG-CD1 4.48Å; F684-F689 HydrophobicContact CG-CG 4.44Å; D686-F689 PolarHBondContact O-N 2.87Å; E687-F689 PolarHBondContact O-N 3.23Å; E687-F689 VanDerWaalsContact O-N 3.11Å; F689-E691 PolarHBondContact O-N 3.34Å; F689-I692 HydrophobicContact CD1-CB 4.21Å; F689-I692 HydrophobicContact CD1-CG1 4.01Å; F689-I692 HydrophobicContact CD1-CG2 4.29Å; F689-I692 PolarHBondContact O-N 2.81Å; F689-K697 WeakPolarHBondContact O-CE 3.3Å; F689-K697 PolarHBondContact O-NZ 2.97Å
690	D	90.5	Very high	93.1	Very high	135 Å²	135	60.1 Å²	60.1	72%	0.722	31%	0.307	S	S	*	.	S	Bend	trans	-63.6	-38.7	-179	-79.2	-23.1	0	0	0	112.9	E687	E687-D690 WeakPolarHBondContact O-CB 3.31Å; E687-D690 PolarHBondContact O-N 3.1Å; E687-D690 VanDerWaalsContact O-N 3.13Å
691	E	87.1	Confident	93.5	Very high	132 Å²	132	61.9 Å²	61.9	62%	0.617	32%	0.316	S	S	*	.	S	Bend	trans	-94.2	-3.1	178	-62.5	-160.2	151.2	0	0	114.2	F689 T733	F689-E691 PolarHBondContact O-N 3.34Å; E691-T733 WeakPolarHBondContact OE2-CB 3.39Å; E691-T733 WeakPolarHBondContact OE2-CG2 3.34Å; E691-T733 PolarHBondContact OE2-OG1 3.11Å
692	I	92.6	Very high	93.9	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.026	30%	0.301	C	S	.	.	S	Bend	trans	-78.4	134.1	-179.2	-61.7	-59.8	0	0	0	110.2	L659 A688 F689 A696 K697 L735	L659-I692 HydrophobicContact CB-CD1 4.01Å; L659-I692 HydrophobicContact CD1-CG2 4.08Å; L659-I692 HydrophobicContact CD2-CD1 4.21Å; A688-I692 WeakPolarHBondContact O-CG1 3.15Å; F689-I692 HydrophobicContact CD1-CB 4.21Å; F689-I692 HydrophobicContact CD1-CG1 4.01Å; F689-I692 HydrophobicContact CD1-CG2 4.29Å; F689-I692 PolarHBondContact O-N 2.81Å; I692-A696 HydrophobicContact CG2-CB 3.76Å; I692-K697 HydrophobicContact CG2-CG 4.33Å; I692-K697 WeakPolarHBondContact O-CE 3.48Å; I692-K697 PolarHBondContact O-NZ 3.14Å; I692-L735 HydrophobicContact CD1-CD1 4.44Å; I692-L735 HydrophobicContact CD1-CD2 3.49Å; I692-L735 VanDerWaalsContact CD1-CD2 3.49Å
693	S	93.7	Very high	94.1	Very high	32 Å²	32	57.3 Å²	57.3	22%	0.224	29%	0.292	C	S	.	.			trans	-65	144.1	-177	86.6	0	0	0	0	113.4	E563 N695 A696 K697	E563-S693 VanDerWaalsContact OE1-CB 3.31Å; E563-S693 WeakPolarHBondContact OE1-CB 3.41Å; E563-S693 PolarHBondContact OE1-OG 2.82Å; E563-S693 WeakPolarHBondContact OE2-CB 3.03Å; E563-S693 PolarHBondContact OE2-N 2.75Å; S693-N695 PolarHBondContact O-N 3.47Å; S693-N695 VanDerWaalsContact O-N 3.16Å; S693-A696 WeakPolarHBondContact O-CA 3.46Å; S693-A696 VanDerWaalsContact O-CB 3.26Å; S693-A696 WeakPolarHBondContact O-CB 3.31Å; S693-A696 PolarHBondContact O-N 2.72Å; S693-A696 PolarHBondContact OG-N 3.29Å; S693-K697 PolarHBondContact O-N 3.14Å
694	E	94.5	Very high	94.3	Very high	131 Å²	131	53.7 Å²	53.7	61%	0.612	27%	0.273	S	S	*	.	H	α-helix	trans	-58.4	-28.9	176.3	-60.4	-55.4	117.7	0	0	112.6	A696 K697 D698	E694-A696 VanDerWaalsContact C-N 3.3Å; E694-A696 PolarHBondContact O-N 3.01Å; E694-K697 PolarHBondContact O-N 2.83Å; E694-K697 WeakPolarHBondContact OE1-CD 3.43Å; E694-K697 WeakPolarHBondContact OE1-CE 3.21Å; E694-K697 IonicContact OE1-NZ 3.42Å; E694-K697 PolarHBondContact OE1-NZ 2.81Å; E694-D698 WeakPolarHBondContact O-CB 3.35Å; E694-D698 PolarHBondContact O-N 2.84Å
695	N	95.6	Very high	94.2	Very high	64 Å²	64	54.2 Å²	54.2	34%	0.342	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-35.7	172.7	-74	-21.6	0	0	0	112	S693 F699 W722	S693-N695 PolarHBondContact O-N 3.47Å; S693-N695 VanDerWaalsContact O-N 3.16Å; N695-F699 WeakPolarHBondContact O-CB 3.23Å; N695-F699 PolarHBondContact O-N 2.75Å; N695-W722 HydrophobicContact CB-CB 3.93Å; N695-W722 HydrophobicContact CB-CG 4.26Å; N695-W722 WeakPolarHBondContact O-CB 3.31Å
696	A	96.5	Very high	94.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-72.5	-40.5	176.6	0	0	0	0	0	111.5	L659 I692 S693 E694 F699 I700 W722	L659-A696 HydrophobicContact CD1-CB 3.8Å; I692-A696 HydrophobicContact CG2-CB 3.76Å; S693-A696 WeakPolarHBondContact O-CA 3.46Å; S693-A696 VanDerWaalsContact O-CB 3.26Å; S693-A696 WeakPolarHBondContact O-CB 3.31Å; S693-A696 PolarHBondContact O-N 2.72Å; S693-A696 PolarHBondContact OG-N 3.29Å; E694-A696 VanDerWaalsContact C-N 3.3Å; E694-A696 PolarHBondContact O-N 3.01Å; A696-F699 WeakPolarHBondContact O-CB 3.47Å; A696-F699 PolarHBondContact O-N 2.88Å; A696-I700 PolarHBondContact O-N 2.92Å; A696-W722 HydrophobicContact CB-CD2 4.18Å; A696-W722 HydrophobicContact CB-CG 4.29Å; A696-W722 HydrophobicContact CB-CZ2 4.03Å; A696-W722 VanDerWaalsContact CB-NE1 3.33Å
697	K	97.8	Very high	93.9	Very high	30 Å²	30	52.9 Å²	52.9	13%	0.13	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-46	175.2	-63.7	176.2	-167.8	167.3	0	111.1	F684 F689 I692 S693 E694 F699 I700 T701	F684-K697 HydrophobicContact CD1-CG 4.46Å; F684-K697 HydrophobicContact CD2-CB 4.13Å; F684-K697 HydrophobicContact CD2-CD 4.43Å; F684-K697 HydrophobicContact CD2-CG 4.21Å; F684-K697 HydrophobicContact CE1-CB 4.49Å; F684-K697 HydrophobicContact CE1-CG 4.3Å; F684-K697 HydrophobicContact CE2-CB 3.6Å; F684-K697 HydrophobicContact CE2-CG 4.06Å; F684-K697 HydrophobicContact CG-CG 4.41Å; F684-K697 HydrophobicContact CZ-CB 3.79Å; F684-K697 HydrophobicContact CZ-CG 4.09Å; F684-K697 WeakPolarHBondContact CZ-O 3.35Å; F689-K697 WeakPolarHBondContact O-CE 3.3Å; F689-K697 PolarHBondContact O-NZ 2.97Å; I692-K697 HydrophobicContact CG2-CG 4.33Å; I692-K697 WeakPolarHBondContact O-CE 3.48Å; I692-K697 PolarHBondContact O-NZ 3.14Å; S693-K697 PolarHBondContact O-N 3.14Å; E694-K697 PolarHBondContact O-N 2.83Å; E694-K697 WeakPolarHBondContact OE1-CD 3.43Å; E694-K697 WeakPolarHBondContact OE1-CE 3.21Å; E694-K697 IonicContact OE1-NZ 3.42Å; E694-K697 PolarHBondContact OE1-NZ 2.81Å; K697-F699 PolarHBondContact O-N 3.32Å; K697-I700 PolarHBondContact O-N 2.99Å; K697-T701 WeakPolarHBondContact O-CB 3.18Å; K697-T701 PolarHBondContact O-N 2.97Å; K697-T701 PolarHBondContact O-OG1 3.34Å
698	D	98.1	Very high	93.7	Very high	73 Å²	73	48 Å²	48	39%	0.39	25%	0.246	S	C	.	.	H	α-helix	trans	-62.1	-40.5	174	-175.8	46.5	0	0	0	112	E694 I700 T701 N702 H720	E694-D698 WeakPolarHBondContact O-CB 3.35Å; E694-D698 PolarHBondContact O-N 2.84Å; D698-I700 PolarHBondContact O-N 2.9Å; D698-T701 PolarHBondContact O-N 2.78Å; D698-N702 PolarHBondContact O-N 2.79Å; D698-N702 PolarHBondContact O-ND2 2.85Å; D698-N702 PolarHBondContact OD1-ND2 3.2Å; D698-H720 IonicContact OD2-CE1 3.64Å; D698-H720 IonicContact OD2-NE2 2.73Å; D698-H720 PolarHBondContact OD2-NE2 3.47Å
699	F	98.6	Very high	93.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-47.8	176.4	-178.1	-107.2	0	0	0	112.4	M570 I574 N695 A696 K697 N702 L703 L712 C717 H720 W722 L723	M570-F699 HydrophobicContact CE-CE1 4.43Å; I574-F699 HydrophobicContact CD1-CZ 3.83Å; N695-F699 WeakPolarHBondContact O-CB 3.23Å; N695-F699 PolarHBondContact O-N 2.75Å; A696-F699 WeakPolarHBondContact O-CB 3.47Å; A696-F699 PolarHBondContact O-N 2.88Å; K697-F699 PolarHBondContact O-N 3.32Å; F699-N702 PolarHBondContact O-N 2.71Å; F699-L703 HydrophobicContact CD1-CD1 3.98Å; F699-L703 HydrophobicContact CE1-CD1 3.5Å; F699-L703 VanDerWaalsContact CE1-CD1 3.5Å; F699-L703 HydrophobicContact CE2-CD1 4.32Å; F699-L703 HydrophobicContact CZ-CD1 3.69Å; F699-L703 WeakPolarHBondContact O-CG 3.25Å; F699-L703 PolarHBondContact O-N 2.74Å; F699-L712 HydrophobicContact CD2-CD1 3.97Å; F699-L712 HydrophobicContact CE2-CD1 4.03Å; F699-C717 HydrophobicContact CE2-CB 3.76Å; F699-C717 HydrophobicContact CZ-CB 4.1Å; F699-H720 VanDerWaalsContact CA-CE1 3.43Å; F699-H720 WeakPolarHBondContact CA-CE1 3.06Å; F699-H720 HydrophobicContact CD2-CB 3.98Å; F699-H720 AromaticContact CD2-CG 3.61Å; F699-H720 AromaticContact CD2-ND1 3.56Å; F699-H720 HydrophobicContact CE2-CB 4.3Å; F699-H720 PolarHBondContact N-CE1 2.99Å; F699-W722 HydrophobicContact CB-CB 4.24Å; F699-W722 HydrophobicContact CB-CD2 4.32Å; F699-W722 HydrophobicContact CB-CE3 3.91Å; F699-W722 HydrophobicContact CB-CG 4.46Å; F699-W722 HydrophobicContact CD1-CD2 4.47Å; F699-W722 AromaticContact CD1-CE3 3.37Å; F699-W722 HydrophobicContact CD1-CE3 3.37Å; F699-W722 AromaticContact CD1-CZ3 3.43Å; F699-W722 HydrophobicContact CD1-CZ3 3.43Å; F699-W722 VanDerWaalsContact CD1-CZ3 3.43Å; F699-W722 HydrophobicContact CD2-CE3 4.2Å; F699-W722 AromaticContact CE1-CE3 3.87Å; F699-W722 HydrophobicContact CE1-CE3 3.87Å; F699-W722 AromaticContact CE1-CZ3 3.66Å; F699-W722 HydrophobicContact CE1-CZ3 3.66Å; F699-W722 HydrophobicContact CG-CD2 4.42Å; F699-W722 AromaticContact CG-CE3 3.55Å; F699-W722 HydrophobicContact CG-CE3 3.55Å; F699-W722 HydrophobicContact CG-CZ3 4.12Å; F699-W722 HydrophobicContact CZ-CE3 4.46Å; F699-W722 HydrophobicContact CZ-CZ3 4.49Å; F699-L723 HydrophobicContact CE2-CD1 3.83Å; F699-L723 HydrophobicContact CE2-CG 4.29Å; F699-L723 HydrophobicContact CZ-CD1 3.76Å; F699-L723 HydrophobicContact CZ-CG 4.43Å
700	I	98.6	Very high	93.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-43.9	175.8	-72	168	0	0	0	110.8	C655 Y656 L659 W682 F684 A696 K697 D698 N702 L703 L704	C655-I700 HydrophobicContact CB-CD1 4.34Å; C655-I700 HydrophobicContact CB-CG1 4Å; Y656-I700 HydrophobicContact CD2-CD1 4.42Å; Y656-I700 HydrophobicContact CD2-CG2 4.16Å; L659-I700 HydrophobicContact CD1-CD1 3.9Å; W682-I700 HydrophobicContact CH2-CG2 3.89Å; W682-I700 HydrophobicContact CZ3-CG2 3.92Å; F684-I700 HydrophobicContact CE1-CB 4.45Å; F684-I700 HydrophobicContact CE1-CD1 4.27Å; F684-I700 HydrophobicContact CE1-CG2 4.13Å; F684-I700 HydrophobicContact CZ-CB 3.99Å; F684-I700 HydrophobicContact CZ-CG2 3.85Å; A696-I700 PolarHBondContact O-N 2.92Å; K697-I700 PolarHBondContact O-N 2.99Å; D698-I700 PolarHBondContact O-N 2.9Å; I700-N702 PolarHBondContact O-N 3.35Å; I700-L703 PolarHBondContact O-N 3.03Å; I700-L704 HydrophobicContact CG2-CD1 3.72Å; I700-L704 HydrophobicContact CG2-CG 4.13Å; I700-L704 PolarHBondContact O-N 2.97Å
701	T	98.3	Very high	93.5	Very high	57 Å²	57	49.4 Å²	49.4	35%	0.35	25%	0.248	S	C	.	.	H	α-helix	trans	-58.8	-32.3	177.9	-55.4	0	0	0	0	112	K697 D698 L703 K705	K697-T701 WeakPolarHBondContact O-CB 3.18Å; K697-T701 PolarHBondContact O-N 2.97Å; K697-T701 PolarHBondContact O-OG1 3.34Å; D698-T701 PolarHBondContact O-N 2.78Å; T701-L703 VanDerWaalsContact C-N 3.34Å; T701-K705 VanDerWaalsContact O-CE 3.25Å; T701-K705 WeakPolarHBondContact O-CE 3.3Å; T701-K705 WeakPolarHBondContact O-CG 3.13Å
702	N	97.8	Very high	93.8	Very high	34 Å²	34	44.2 Å²	44.2	18%	0.182	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	0.1	176	-70.9	-71.6	0	0	0	114.7	D698 F699 I700 K705 R711 L712	D698-N702 PolarHBondContact O-N 2.79Å; D698-N702 PolarHBondContact O-ND2 2.85Å; D698-N702 PolarHBondContact OD1-ND2 3.2Å; F699-N702 PolarHBondContact O-N 2.71Å; I700-N702 PolarHBondContact O-N 3.35Å; N702-K705 PolarHBondContact OD1-NZ 3.02Å; N702-R711 CarbonylContact O-C 3.57Å; N702-R711 WeakPolarHBondContact O-CA 3.32Å; N702-L712 HydrophobicContact CB-CD1 3.89Å; N702-L712 HydrophobicContact CB-CD2 4.06Å; N702-L712 HydrophobicContact CB-CG 3.73Å; N702-L712 PolarHBondContact O-N 3.42Å
703	L	98	Very high	93.7	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-45.5	172.2	-68.8	170.5	0	0	0	112.7	M648 I651 F699 I700 T701 K705 R711 L712	M648-L703 HydrophobicContact CB-CD2 4.05Å; M648-L703 HydrophobicContact CE-CD2 3.68Å; I651-L703 HydrophobicContact CG2-CD1 4.02Å; F699-L703 HydrophobicContact CD1-CD1 3.98Å; F699-L703 HydrophobicContact CE1-CD1 3.5Å; F699-L703 VanDerWaalsContact CE1-CD1 3.5Å; F699-L703 HydrophobicContact CE2-CD1 4.32Å; F699-L703 HydrophobicContact CZ-CD1 3.69Å; F699-L703 WeakPolarHBondContact O-CG 3.25Å; F699-L703 PolarHBondContact O-N 2.74Å; I700-L703 PolarHBondContact O-N 3.03Å; T701-L703 VanDerWaalsContact C-N 3.34Å; L703-K705 PolarHBondContact O-N 3.31Å; L703-R711 WeakPolarHBondContact O-CD 3.38Å; L703-R711 WeakPolarHBondContact O-CG 3.41Å; L703-L712 HydrophobicContact CD2-CB 3.91Å
704	L	97.9	Very high	93.6	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	23%	0.227	C	C	.	.	S	Bend	trans	-83.6	53	-175.7	-63	-174.7	0	0	0	113.2	W649 V653 P664 F665 W682 I700	W649-L704 HydrophobicContact CD2-CD2 4.08Å; W649-L704 HydrophobicContact CE3-CD2 4.17Å; W649-L704 WeakPolarHBondContact O-CD2 3.4Å; V653-L704 HydrophobicContact CG2-CD2 3.78Å; P664-L704 HydrophobicContact CB-CD1 4.14Å; P664-L704 HydrophobicContact CG-CD1 4.13Å; F665-L704 HydrophobicContact CE2-CD1 4.32Å; F665-L704 HydrophobicContact CE2-CD2 4.12Å; F665-L704 HydrophobicContact CZ-CD1 4.25Å; F665-L704 HydrophobicContact CZ-CD2 4.28Å; W682-L704 HydrophobicContact CD2-CB 4.29Å; W682-L704 HydrophobicContact CD2-CD1 4.02Å; W682-L704 HydrophobicContact CE3-CD1 4.34Å; W682-L704 HydrophobicContact CG-CD1 4.4Å; W682-L704 HydrophobicContact CZ2-CB 3.71Å; W682-L704 HydrophobicContact CZ2-CD1 4.48Å; W682-L704 PolarHBondContact NE1-O 3.01Å; I700-L704 HydrophobicContact CG2-CD1 3.72Å; I700-L704 HydrophobicContact CG2-CG 4.13Å; I700-L704 PolarHBondContact O-N 2.97Å
705	K	92.8	Very high	93.2	Very high	61 Å²	61	41.8 Å²	41.8	27%	0.265	22%	0.221	S	C	.	.			trans	-103.3	140.9	175.4	-66.1	175.6	-175.3	158	0	111.1	T701 N702 L703 A710 R711	T701-K705 VanDerWaalsContact O-CE 3.25Å; T701-K705 WeakPolarHBondContact O-CE 3.3Å; T701-K705 WeakPolarHBondContact O-CG 3.13Å; N702-K705 PolarHBondContact OD1-NZ 3.02Å; L703-K705 PolarHBondContact O-N 3.31Å; K705-A710 HydrophobicContact CD-CB 3.72Å; K705-A710 VanDerWaalsContact CD-O 3.31Å; K705-A710 WeakPolarHBondContact CD-O 3.47Å; K705-A710 PolarHBondContact NZ-O 3.13Å; K705-R711 HydrophobicContact CB-CG 4.27Å; K705-R711 PolarHBondContact O-NE 2.89Å; K705-R711 PolarHBondContact O-NH2 2.76Å
706	K	88.5	Confident	92.9	Very high	104 Å²	104	43.6 Å²	43.6	45%	0.452	23%	0.227	S	C	.	.	S	Bend	trans	-57.1	-53.3	174.4	-176.4	161.8	177.8	159.3	0	111.6	T678 A680 M708 R711	T678-K706 WeakPolarHBondContact O-CE 3.39Å; T678-K706 PolarHBondContact O-NZ 2.59Å; A680-K706 HydrophobicContact CB-CB 3.84Å; K706-M708 PolarHBondContact O-N 3.02Å; K706-M708 VanDerWaalsContact O-N 3.14Å; K706-R711 PolarHBondContact O-NH2 3.25Å
707	D	84.5	Confident	92.9	Very high	90 Å²	90	43.6 Å²	43.6	48%	0.481	23%	0.227	S	C	.	.	S	Bend	trans	-63.7	113	173.8	174.1	22.4	0	0	0	111.4	K709 A710	D707-K709 PolarHBondContact O-N 3.36Å; D707-K709 WeakPolarHBondContact OD1-CB 3.39Å; D707-K709 PolarHBondContact OD1-N 2.79Å; D707-A710 HydrophobicContact CB-CB 4.11Å; D707-A710 PolarHBondContact O-N 2.81Å; D707-A710 VanDerWaalsContact O-N 3.17Å; D707-A710 WeakPolarHBondContact OD2-CB 3.38Å; D707-A710 PolarHBondContact OD2-N 3.41Å
708	M	86.6	Confident	92.7	Very high	30 Å²	30	45 Å²	45	15%	0.148	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.2	-31.9	175.5	-173.4	179	54.6	0	0	112.7	E635 A641 P645 K706 A710	E635-M708 HydrophobicContact CG-SD 4.29Å; A641-M708 WeakPolarHBondContact O-CE 3.4Å; P645-M708 HydrophobicContact CB-CG 3.6Å; P645-M708 VanDerWaalsContact CB-O 3.31Å; P645-M708 WeakPolarHBondContact CB-O 3.5Å; P645-M708 HydrophobicContact CG-CG 3.85Å; K706-M708 PolarHBondContact O-N 3.02Å; K706-M708 VanDerWaalsContact O-N 3.14Å; M708-A710 VanDerWaalsContact C-N 3.33Å
709	K	82.3	Confident	92.5	Very high	142 Å²	142	47.4 Å²	47.4	62%	0.617	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-79	-14.6	-178	-63.7	174.5	179.1	174.8	0	112.6	D707 E796	D707-K709 PolarHBondContact O-N 3.36Å; D707-K709 WeakPolarHBondContact OD1-CB 3.39Å; D707-K709 PolarHBondContact OD1-N 2.79Å; K709-E796 IonicContact NZ-OE1 2.83Å; K709-E796 PolarHBondContact NZ-OE1 2.82Å
710	A	89.4	Confident	92.5	Very high	39 Å²	39	48.1 Å²	48.1	32%	0.322	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-94.5	-5	176.7	0	0	0	0	0	114.8	K705 D707 M708	K705-A710 HydrophobicContact CD-CB 3.72Å; K705-A710 VanDerWaalsContact CD-O 3.31Å; K705-A710 WeakPolarHBondContact CD-O 3.47Å; K705-A710 PolarHBondContact NZ-O 3.13Å; D707-A710 HydrophobicContact CB-CB 4.11Å; D707-A710 PolarHBondContact O-N 2.81Å; D707-A710 VanDerWaalsContact O-N 3.17Å; D707-A710 WeakPolarHBondContact OD2-CB 3.38Å; D707-A710 PolarHBondContact OD2-N 3.41Å; M708-A710 VanDerWaalsContact C-N 3.33Å
711	R	95.3	Very high	92.4	Very high	10 Å²	10	51.5 Å²	51.5	4%	0.038	27%	0.268	C	S	.	.	S	Bend	trans	-77.7	150.2	178	-54.5	-177.8	-167.4	144.9	11	111.2	E635 P645 N702 L703 K705 K706	E635-R711 VanDerWaalsContact CD-NH1 3.34Å; E635-R711 IonicContact OE1-CZ 2.59Å; E635-R711 IonicContact OE1-NH1 3.39Å; E635-R711 PolarHBondContact OE1-NH1 3.32Å; E635-R711 IonicContact OE1-NH2 2.84Å; E635-R711 IonicContact OE2-CZ 2.65Å; E635-R711 IonicContact OE2-NH1 2.99Å; E635-R711 PolarHBondContact OE2-NH1 3.31Å; E635-R711 VanDerWaalsContact OE2-NH1 3.14Å; E635-R711 IonicContact OE2-NH2 2.78Å; E635-R711 PolarHBondContact OE2-NH2 3.43Å; P645-R711 HydrophobicContact CB-CB 4.19Å; P645-R711 WeakPolarHBondContact O-CD 3.48Å; P645-R711 PolarHBondContact O-NH1 3.46Å; N702-R711 CarbonylContact O-C 3.57Å; N702-R711 WeakPolarHBondContact O-CA 3.32Å; L703-R711 WeakPolarHBondContact O-CD 3.38Å; L703-R711 WeakPolarHBondContact O-CG 3.41Å; K705-R711 HydrophobicContact CB-CG 4.27Å; K705-R711 PolarHBondContact O-NE 2.89Å; K705-R711 PolarHBondContact O-NH2 2.76Å; K706-R711 PolarHBondContact O-NH2 3.25Å
712	L	91.6	Very high	92.3	Very high	22 Å²	22	48.8 Å²	48.8	12%	0.115	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-63.7	139.5	169.6	-57.5	176.2	0	0	0	110.7	M648 F699 N702 L703 Q716 C717	M648-L712 WeakPolarHBondContact CB-O 3.47Å; M648-L712 WeakPolarHBondContact CE-O 3.44Å; M648-L712 VanDerWaalsContact CG-O 3.25Å; M648-L712 WeakPolarHBondContact CG-O 3.48Å; F699-L712 HydrophobicContact CD2-CD1 3.97Å; F699-L712 HydrophobicContact CE2-CD1 4.03Å; N702-L712 HydrophobicContact CB-CD1 3.89Å; N702-L712 HydrophobicContact CB-CD2 4.06Å; N702-L712 HydrophobicContact CB-CG 3.73Å; N702-L712 PolarHBondContact O-N 3.42Å; L703-L712 HydrophobicContact CD2-CB 3.91Å; L712-Q716 HydrophobicContact CB-CB 4.3Å; L712-Q716 HydrophobicContact CD2-CB 4.06Å; L712-C717 VanDerWaalsContact CB-SG 3.6Å
713	S	91.3	Very high	92.2	Very high	42 Å²	42	47.7 Å²	47.7	29%	0.294	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-86	159.8	161.3	63.3	0	0	0	0	111	P715 Q716 C717	S713-P715 VanDerWaalsContact C-CD 3.49Å; S713-P715 VanDerWaalsContact C-N 3.33Å; S713-Q716 WeakPolarHBondContact O-CA 3.45Å; S713-Q716 WeakPolarHBondContact O-CB 3.38Å; S713-Q716 PolarHBondContact O-N 2.72Å; S713-Q716 PolarHBondContact OG-OE1 2.95Å; S713-C717 PolarHBondContact O-N 2.88Å; S713-C717 PolarHBondContact O-SG 2.89Å
714	C	91.8	Very high	91.9	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-50.6	-43.1	-179.8	-52.4	0	0	0	0	114.3	I574 N578 M648 Q716 C717 F718	I574-C714 HydrophobicContact CG2-CB 3.74Å; N578-C714 HydrophobicContact CB-CB 3.66Å; M648-C714 HydrophobicContact SD-CB 4.49Å; M648-C714 PolarHBondContact SD-SG 2.89Å; C714-Q716 VanDerWaalsContact C-N 3.3Å; C714-Q716 PolarHBondContact O-N 2.94Å; C714-C717 WeakPolarHBondContact O-CB 3.49Å; C714-C717 PolarHBondContact O-N 2.81Å; C714-C717 VanDerWaalsContact O-N 3.15Å; C714-F718 HydrophobicContact CB-CE2 4.48Å; C714-F718 WeakPolarHBondContact O-CD2 3.4Å; C714-F718 PolarHBondContact O-N 3.35Å
715	P	86.1	Confident	91.5	Very high	76 Å²	76	55.8 Å²	55.8	49%	0.494	28%	0.281	S	S	.	.	H	α-helix	trans	-59	-35.8	174.4	-26.2	36.7	0	0	0	114.2	S713	S713-P715 VanDerWaalsContact C-CD 3.49Å; S713-P715 VanDerWaalsContact C-N 3.33Å
716	Q	89.9	Confident	91	Very high	102 Å²	102	56.9 Å²	56.9	48%	0.477	29%	0.29	S	S	.	.	H	α-helix	trans	-74.4	-31.5	176	-65.8	164.1	-67.7	0	0	111.7	L712 S713 C714 E719 H720	L712-Q716 HydrophobicContact CB-CB 4.3Å; L712-Q716 HydrophobicContact CD2-CB 4.06Å; S713-Q716 WeakPolarHBondContact O-CA 3.45Å; S713-Q716 WeakPolarHBondContact O-CB 3.38Å; S713-Q716 PolarHBondContact O-N 2.72Å; S713-Q716 PolarHBondContact OG-OE1 2.95Å; C714-Q716 VanDerWaalsContact C-N 3.3Å; C714-Q716 PolarHBondContact O-N 2.94Å; Q716-E719 PolarHBondContact O-N 3.44Å; Q716-H720 PolarHBondContact O-N 3.01Å; Q716-H720 VanDerWaalsContact O-N 3.13Å
717	C	96.4	Very high	90.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-43.6	173.3	-64	0	0	0	0	112.3	I574 M648 F699 L712 S713 C714 E719 H720 L723	I574-C717 HydrophobicContact CD1-CB 4.11Å; I574-C717 HydrophobicContact CG2-CB 4.08Å; M648-C717 WeakPolarHBondContact CE-SG 3.04Å; F699-C717 HydrophobicContact CE2-CB 3.76Å; F699-C717 HydrophobicContact CZ-CB 4.1Å; L712-C717 VanDerWaalsContact CB-SG 3.6Å; S713-C717 PolarHBondContact O-N 2.88Å; S713-C717 PolarHBondContact O-SG 2.89Å; C714-C717 WeakPolarHBondContact O-CB 3.49Å; C714-C717 PolarHBondContact O-N 2.81Å; C714-C717 VanDerWaalsContact O-N 3.15Å; C717-E719 PolarHBondContact O-N 2.85Å; C717-H720 WeakPolarHBondContact O-CB 3.42Å; C717-H720 PolarHBondContact O-N 2.87Å; C717-L723 HydrophobicContact CB-CD1 4.3Å
718	F	93.2	Very high	90.3	Very high	60 Å²	60	55.1 Å²	55.1	26%	0.263	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-28.1	176.4	-69.1	-66	0	0	0	113.5	L571 I574 D575 N578 C714	L571-F718 HydrophobicContact CD2-CD1 3.85Å; L571-F718 HydrophobicContact CD2-CE1 3.94Å; I574-F718 HydrophobicContact CB-CZ 4.26Å; I574-F718 HydrophobicContact CG2-CD2 4.38Å; I574-F718 HydrophobicContact CG2-CE1 4.27Å; I574-F718 HydrophobicContact CG2-CE2 3.75Å; I574-F718 HydrophobicContact CG2-CZ 3.7Å; D575-F718 HydrophobicContact CB-CZ 4.08Å; N578-F718 HydrophobicContact CB-CE2 4.08Å; N578-F718 WeakPolarHBondContact ND2-CE2 3.41Å; C714-F718 HydrophobicContact CB-CE2 4.48Å; C714-F718 WeakPolarHBondContact O-CD2 3.4Å; C714-F718 PolarHBondContact O-N 3.35Å
719	E	94.4	Very high	89.8	Confident	123 Å²	123	59 Å²	59	58%	0.575	31%	0.312	S	S	*	.	H	α-helix	trans	-85.4	-8.6	176.2	-71.3	-65.6	120.9	0	0	113.2	Q716 C717 K724	Q716-E719 PolarHBondContact O-N 3.44Å; C717-E719 PolarHBondContact O-N 2.85Å; E719-K724 IonicContact OE1-NZ 2.98Å; E719-K724 PolarHBondContact OE1-NZ 2.72Å; E719-K724 IonicContact OE2-NZ 2.59Å; E719-K724 PolarHBondContact OE2-NZ 3.06Å
720	H	97.7	Very high	89.7	Confident	15 Å²	15	53.2 Å²	53.2	7%	0.069	29%	0.287	C	S	.	.	S	Bend	trans	-67.1	136.9	-178	-160.2	-95.4	0	0	0	111.7	D698 F699 Q716 C717 W722 L723 K724	D698-H720 IonicContact OD2-CE1 3.64Å; D698-H720 IonicContact OD2-NE2 2.73Å; D698-H720 PolarHBondContact OD2-NE2 3.47Å; F699-H720 VanDerWaalsContact CA-CE1 3.43Å; F699-H720 WeakPolarHBondContact CA-CE1 3.06Å; F699-H720 HydrophobicContact CD2-CB 3.98Å; F699-H720 AromaticContact CD2-CG 3.61Å; F699-H720 AromaticContact CD2-ND1 3.56Å; F699-H720 HydrophobicContact CE2-CB 4.3Å; F699-H720 PolarHBondContact N-CE1 2.99Å; Q716-H720 PolarHBondContact O-N 3.01Å; Q716-H720 VanDerWaalsContact O-N 3.13Å; C717-H720 WeakPolarHBondContact O-CB 3.42Å; C717-H720 PolarHBondContact O-N 2.87Å; H720-W722 PolarHBondContact ND1-N 2.98Å; H720-W722 PolarHBondContact O-N 2.79Å; H720-L723 PolarHBondContact O-N 3.39Å; H720-K724 VanDerWaalsContact O-CB 3.26Å; H720-K724 WeakPolarHBondContact O-CB 3.39Å; H720-K724 PolarHBondContact O-N 2.91Å
721	P	96.3	Very high	88.8	Confident	71 Å²	71	61.2 Å²	61.2	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-50.6	-37.1	-178.2	-29.7	35.7	0	0	0	114	L723 K724 Q725	P721-L723 PolarHBondContact O-N 2.87Å; P721-K724 PolarHBondContact O-N 2.97Å; P721-Q725 WeakPolarHBondContact O-CB 3.45Å; P721-Q725 PolarHBondContact O-N 3Å; P721-Q725 VanDerWaalsContact O-N 3.16Å
722	W	96.4	Very high	87.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-38.2	179.5	-170.3	56.8	0	0	0	115.4	E563 V566 I567 M570 C655 L659 N695 A696 F699 H720 Q725	E563-W722 HydrophobicContact CG-CZ2 4.19Å; E563-W722 PolarHBondContact OE1-NE1 3.02Å; V566-W722 HydrophobicContact CG1-CH2 4.02Å; V566-W722 HydrophobicContact CG1-CZ2 4.4Å; I567-W722 HydrophobicContact CD1-CZ2 4.41Å; I567-W722 HydrophobicContact CG1-CD2 4.13Å; I567-W722 HydrophobicContact CG1-CH2 4.17Å; I567-W722 HydrophobicContact CG1-CZ2 3.59Å; M570-W722 HydrophobicContact CB-CZ3 4.27Å; M570-W722 HydrophobicContact CG-CH2 3.97Å; M570-W722 HydrophobicContact CG-CZ3 4.02Å; C655-W722 WeakPolarHBondContact SG-CH2 3.15Å; C655-W722 VanDerWaalsContact SG-CZ3 3.52Å; L659-W722 HydrophobicContact CD1-CZ2 4.27Å; L659-W722 HydrophobicContact CD2-CZ2 4.25Å; N695-W722 HydrophobicContact CB-CB 3.93Å; N695-W722 HydrophobicContact CB-CG 4.26Å; N695-W722 WeakPolarHBondContact O-CB 3.31Å; A696-W722 HydrophobicContact CB-CD2 4.18Å; A696-W722 HydrophobicContact CB-CG 4.29Å; A696-W722 HydrophobicContact CB-CZ2 4.03Å; A696-W722 VanDerWaalsContact CB-NE1 3.33Å; F699-W722 HydrophobicContact CB-CB 4.24Å; F699-W722 HydrophobicContact CB-CD2 4.32Å; F699-W722 HydrophobicContact CB-CE3 3.91Å; F699-W722 HydrophobicContact CB-CG 4.46Å; F699-W722 HydrophobicContact CD1-CD2 4.47Å; F699-W722 AromaticContact CD1-CE3 3.37Å; F699-W722 HydrophobicContact CD1-CE3 3.37Å; F699-W722 AromaticContact CD1-CZ3 3.43Å; F699-W722 HydrophobicContact CD1-CZ3 3.43Å; F699-W722 VanDerWaalsContact CD1-CZ3 3.43Å; F699-W722 HydrophobicContact CD2-CE3 4.2Å; F699-W722 AromaticContact CE1-CE3 3.87Å; F699-W722 HydrophobicContact CE1-CE3 3.87Å; F699-W722 AromaticContact CE1-CZ3 3.66Å; F699-W722 HydrophobicContact CE1-CZ3 3.66Å; F699-W722 HydrophobicContact CG-CD2 4.42Å; F699-W722 AromaticContact CG-CE3 3.55Å; F699-W722 HydrophobicContact CG-CE3 3.55Å; F699-W722 HydrophobicContact CG-CZ3 4.12Å; F699-W722 HydrophobicContact CZ-CE3 4.46Å; F699-W722 HydrophobicContact CZ-CZ3 4.49Å; H720-W722 PolarHBondContact ND1-N 2.98Å; H720-W722 PolarHBondContact O-N 2.79Å; W722-Q725 WeakPolarHBondContact O-CG 3.46Å; W722-Q725 PolarHBondContact O-NE2 2.93Å
723	L	95.6	Very high	87.4	Confident	11 Å²	11	64.5 Å²	64.5	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-94.2	-18	-180	-63.5	-174.6	0	0	0	112.4	I567 M570 L571 I574 F699 C717 H720 P721	I567-L723 HydrophobicContact CB-CD2 4.39Å; I567-L723 HydrophobicContact CG1-CD2 4.3Å; I567-L723 HydrophobicContact CG2-CD2 3.98Å; M570-L723 HydrophobicContact CB-CD2 4.22Å; L571-L723 HydrophobicContact CD2-CB 4.1Å; L571-L723 HydrophobicContact CD2-CD1 4.4Å; L571-L723 HydrophobicContact CG-CD2 4.38Å; I574-L723 HydrophobicContact CD1-CD1 3.52Å; F699-L723 HydrophobicContact CE2-CD1 3.83Å; F699-L723 HydrophobicContact CE2-CG 4.29Å; F699-L723 HydrophobicContact CZ-CD1 3.76Å; F699-L723 HydrophobicContact CZ-CG 4.43Å; C717-L723 HydrophobicContact CB-CD1 4.3Å; H720-L723 PolarHBondContact O-N 3.39Å; P721-L723 PolarHBondContact O-N 2.87Å
724	K	92.6	Very high	87.3	Confident	119 Å²	119	68.1 Å²	68.1	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-93.2	-12.4	-176.3	-171.2	157.4	177.6	155.9	0	114.6	E719 H720 P721	E719-K724 IonicContact OE1-NZ 2.98Å; E719-K724 PolarHBondContact OE1-NZ 2.72Å; E719-K724 IonicContact OE2-NZ 2.59Å; E719-K724 PolarHBondContact OE2-NZ 3.06Å; H720-K724 VanDerWaalsContact O-CB 3.26Å; H720-K724 WeakPolarHBondContact O-CB 3.39Å; H720-K724 PolarHBondContact O-N 2.91Å; P721-K724 PolarHBondContact O-N 2.97Å
725	Q	88	Confident	87.1	Confident	55 Å²	55	68.8 Å²	68.8	26%	0.257	35%	0.351	S	S	.	.	S	Bend	trans	-68.3	149.4	177.5	60.6	-172.8	-26.6	0	0	113.4	P721 W722 T727 M730	P721-Q725 WeakPolarHBondContact O-CB 3.45Å; P721-Q725 PolarHBondContact O-N 3Å; P721-Q725 VanDerWaalsContact O-N 3.16Å; W722-Q725 WeakPolarHBondContact O-CG 3.46Å; W722-Q725 PolarHBondContact O-NE2 2.93Å; Q725-T727 PolarHBondContact O-N 2.59Å; Q725-M730 HydrophobicContact CG-SD 4.49Å; Q725-M730 VanDerWaalsContact NE2-CE 3.34Å
726	D	84.2	Confident	86.9	Confident	83 Å²	83	68.5 Å²	68.5	44%	0.444	35%	0.351	S	S	.	.			trans	-73.2	94.5	174.9	-178.5	5.1	0	0	0	111.2	N728 T729 M730	D726-N728 PolarHBondContact O-N 3.05Å; D726-N728 VanDerWaalsContact OD1-CB 3.31Å; D726-N728 WeakPolarHBondContact OD1-CB 3.46Å; D726-N728 PolarHBondContact OD1-N 2.96Å; D726-N728 PolarHBondContact OD1-ND2 3.12Å; D726-T729 HydrophobicContact CB-CG2 4.48Å; D726-T729 PolarHBondContact O-N 2.89Å; D726-T729 PolarHBondContact O-OG1 3.1Å; D726-M730 PolarHBondContact O-N 2.87Å
727	T	81	Confident	86.6	Confident	32 Å²	32	64.6 Å²	64.6	20%	0.196	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-26.7	175.5	53	0	0	0	0	114.8	R564 I567 Q725	R564-T727 PolarHBondContact NE-O 3.06Å; R564-T727 PolarHBondContact NH2-O 2.83Å; I567-T727 HydrophobicContact CB-CG2 4.45Å; I567-T727 HydrophobicContact CD1-CG2 4.44Å; I567-T727 HydrophobicContact CG2-CG2 3.84Å; Q725-T727 PolarHBondContact O-N 2.59Å
728	N	76.9	Confident	86	Confident	126 Å²	126	70.9 Å²	70.9	67%	0.674	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-37.5	178.6	-58.8	-77.3	0	0	0	112	R564 D726	R564-N728 PolarHBondContact NH2-O 2.81Å; D726-N728 PolarHBondContact O-N 3.05Å; D726-N728 VanDerWaalsContact OD1-CB 3.31Å; D726-N728 WeakPolarHBondContact OD1-CB 3.46Å; D726-N728 PolarHBondContact OD1-N 2.96Å; D726-N728 PolarHBondContact OD1-ND2 3.12Å
729	T	75.4	Confident	85.4	Confident	111 Å²	111	70.3 Å²	70.3	68%	0.681	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-17.5	179.2	66.1	0	0	0	0	113.4	D726 K731	D726-T729 HydrophobicContact CB-CG2 4.48Å; D726-T729 PolarHBondContact O-N 2.89Å; D726-T729 PolarHBondContact O-OG1 3.1Å; T729-K731 PolarHBondContact O-N 2.84Å
730	M	79.9	Confident	85.1	Confident	20 Å²	20	64.5 Å²	64.5	10%	0.099	33%	0.33	C	S	.	.			trans	-66.3	121.5	-176.4	-166.4	-178.6	-174.1	0	0	111.3	E563 R564 I567 Q725 D726 T732	E563-M730 HydrophobicContact CB-CE 4.46Å; E563-M730 HydrophobicContact CG-CE 4.05Å; E563-M730 WeakPolarHBondContact OE1-CE 3.08Å; R564-M730 PolarHBondContact NH2-O 2.96Å; I567-M730 HydrophobicContact CD1-CE 3.95Å; I567-M730 HydrophobicContact CD1-SD 3.7Å; Q725-M730 HydrophobicContact CG-SD 4.49Å; Q725-M730 VanDerWaalsContact NE2-CE 3.34Å; D726-M730 PolarHBondContact O-N 2.87Å; M730-T732 HydrophobicContact CB-CG2 4.46Å; M730-T732 HydrophobicContact CE-CG2 4.17Å; M730-T732 HydrophobicContact CG-CG2 3.81Å; M730-T732 HydrophobicContact SD-CG2 3.86Å
731	K	71.4	Confident	84.3	Confident	207 Å²	207	66.9 Å²	66.9	90%	0.9	34%	0.341	S	S	*	.			trans	-72.9	128.3	164.1	-66.2	-178.2	-179.1	179.8	0	108.2	T729	T729-K731 PolarHBondContact O-N 2.84Å
732	T	75.4	Confident	83.4	Confident	42 Å²	42	70.1 Å²	70.1	26%	0.258	35%	0.347	S	S	.	.			trans	-136	135.8	177.7	53.3	0	0	0	0	109.3	E563 R564 M730	E563-T732 HydrophobicContact CB-CG2 4.11Å; R564-T732 HydrophobicContact CB-CG2 3.93Å; M730-T732 HydrophobicContact CB-CG2 4.46Å; M730-T732 HydrophobicContact CE-CG2 4.17Å; M730-T732 HydrophobicContact CG-CG2 3.81Å; M730-T732 HydrophobicContact SD-CG2 3.86Å
733	T	82.3	Confident	82.7	Confident	59 Å²	59	70.9 Å²	70.9	36%	0.362	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-85.2	174	169.6	60.5	0	0	0	0	110.6	T562 E691	T562-T733 WeakPolarHBondContact CG2-O 3.26Å; E691-T733 WeakPolarHBondContact OE2-CB 3.39Å; E691-T733 WeakPolarHBondContact OE2-CG2 3.34Å; E691-T733 PolarHBondContact OE2-OG1 3.11Å
734	K	87.4	Confident	81.7	Confident	119 Å²	119	70.9 Å²	70.9	52%	0.517	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-89.1	119.1	-179.3	-178.9	173.8	-169.8	150.3	0	109.2	E560	E560-K734 HydrophobicContact CG-CD 4.27Å; E560-K734 HydrophobicContact CG-CG 4.24Å; E560-K734 WeakPolarHBondContact OE2-CD 3.34Å; E560-K734 VanDerWaalsContact OE2-CE 3.26Å; E560-K734 WeakPolarHBondContact OE2-CE 3.35Å; E560-K734 IonicContact OE2-NZ 3.67Å; E560-K734 PolarHBondContact OE2-NZ 3.18Å
735	L	87.8	Confident	80.5	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.068	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-73.6	141.7	-177.7	-57.2	-176.7	0	0	0	111	L561 V566 L659 I692 K737	L561-L735 HydrophobicContact CD2-CB 4.35Å; L561-L735 HydrophobicContact CG-CB 4.21Å; L561-L735 HydrophobicContact CG-CD1 4.27Å; L561-L735 PolarHBondContact O-N 2.91Å; V566-L735 HydrophobicContact CG2-CD1 4.15Å; L659-L735 HydrophobicContact CD2-CD1 4.16Å; I692-L735 HydrophobicContact CD1-CD1 4.44Å; I692-L735 HydrophobicContact CD1-CD2 3.49Å; I692-L735 VanDerWaalsContact CD1-CD2 3.49Å; L735-K737 PolarHBondContact O-N 3.28Å
736	S	83.4	Confident	79.4	Confident	70 Å²	70	72.6 Å²	72.6	49%	0.49	36%	0.358	S	S	.	.			trans	-70	113.4	-176.3	-177.3	0	0	0	0	111.8	E738	S736-E738 VanDerWaalsContact C-N 3.27Å; S736-E738 PolarHBondContact O-N 3Å
737	K	83.1	Confident	78.4	Confident	21 Å²	21	69.8 Å²	69.8	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-72.4	-15.5	177.6	-64.1	-169.9	176.3	-144.2	0	113.9	I554 D556 F559 L735 M740 K741	I554-K737 VanDerWaalsContact O-CE 3.25Å; I554-K737 WeakPolarHBondContact O-CE 3.34Å; I554-K737 PolarHBondContact O-NZ 2.82Å; D556-K737 PolarHBondContact O-NZ 2.67Å; F559-K737 WeakPolarHBondContact O-CE 3.16Å; F559-K737 PolarHBondContact O-NZ 3.47Å; L735-K737 PolarHBondContact O-N 3.28Å; K737-M740 PolarHBondContact O-N 3.15Å; K737-K741 WeakPolarHBondContact O-CB 3.4Å; K737-K741 VanDerWaalsContact O-CG 3.25Å; K737-K741 WeakPolarHBondContact O-CG 3.41Å; K737-K741 PolarHBondContact O-N 3.14Å
738	E	82.8	Confident	77.2	Confident	131 Å²	131	72.3 Å²	72.3	61%	0.612	35%	0.349	S	S	*	.	H	α-helix	trans	-67.1	-43.5	-174	-65.3	-167	-177.3	0	0	112.8	S736 K741 K742	S736-E738 VanDerWaalsContact C-N 3.27Å; S736-E738 PolarHBondContact O-N 3Å; E738-K741 PolarHBondContact O-N 2.92Å; E738-K742 WeakPolarHBondContact O-CG 3.47Å; E738-K742 PolarHBondContact O-N 3.05Å
739	R	82.3	Confident	75.3	Confident	48 Å²	48	75 Å²	75	18%	0.181	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-47	176.1	-70.8	164.3	170	-92.7	4.5	110	S660 G661 D686 E687 K741 K742 Y743	S660-R739 VanDerWaalsContact O-CB 3.29Å; S660-R739 WeakPolarHBondContact O-CB 3.21Å; G661-R739 CarbonylContact O-C 3.53Å; D686-R739 IonicContact OD1-CZ 2.86Å; D686-R739 IonicContact OD1-NE 3.84Å; D686-R739 IonicContact OD1-NH1 3.39Å; D686-R739 PolarHBondContact OD1-NH1 2.89Å; D686-R739 IonicContact OD1-NH2 2.73Å; D686-R739 PolarHBondContact OD1-NH2 2.74Å; D686-R739 VanDerWaalsContact OD1-NH2 3.11Å; D686-R739 IonicContact OD2-CZ 2.7Å; D686-R739 IonicContact OD2-NH1 3.98Å; D686-R739 PolarHBondContact OD2-NH1 3.35Å; D686-R739 IonicContact OD2-NH2 3.6Å; D686-R739 PolarHBondContact OD2-NH2 3.36Å; E687-R739 IonicContact OE1-CZ 2.74Å; E687-R739 IonicContact OE1-NE 2.75Å; E687-R739 IonicContact OE1-NH2 3.2Å; E687-R739 PolarHBondContact OE1-NH2 3.21Å; R739-K741 PolarHBondContact O-N 3.14Å; R739-K742 WeakPolarHBondContact O-CB 3.45Å; R739-K742 PolarHBondContact O-N 3.29Å; R739-K742 VanDerWaalsContact O-N 3.13Å; R739-Y743 PolarHBondContact O-N 2.9Å
740	M	86.6	Confident	73.7	Confident	1 Å²	1	75 Å²	75	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-44.9	174.9	-174.9	63.2	75.5	0	0	112.9	F551 I554 I555 I657 K737 K742 Y743 I744	F551-M740 HydrophobicContact CD1-CE 4.34Å; F551-M740 HydrophobicContact CD1-SD 3.77Å; F551-M740 HydrophobicContact CE1-CE 4.26Å; F551-M740 HydrophobicContact CE1-SD 4.17Å; I554-M740 HydrophobicContact CD1-CE 3.75Å; I554-M740 HydrophobicContact CD1-CG 4.3Å; I554-M740 HydrophobicContact CD1-SD 4.15Å; I554-M740 HydrophobicContact CG1-CG 4.44Å; I555-M740 HydrophobicContact CG2-CB 3.94Å; I555-M740 HydrophobicContact CG2-CG 3.36Å; I657-M740 HydrophobicContact CG2-CE 4.18Å; I657-M740 HydrophobicContact CG2-SD 4.25Å; I657-M740 WeakPolarHBondContact O-CE 3.02Å; K737-M740 PolarHBondContact O-N 3.15Å; M740-K742 VanDerWaalsContact C-N 3.34Å; M740-K742 PolarHBondContact O-N 3.28Å; M740-Y743 PolarHBondContact O-N 3.49Å; M740-Y743 HydrophobicContact SD-CD1 4.3Å; M740-I744 HydrophobicContact CG-CD1 3.75Å; M740-I744 WeakPolarHBondContact O-CD1 3.47Å; M740-I744 WeakPolarHBondContact O-CG1 3.43Å; M740-I744 PolarHBondContact O-N 3.39Å; M740-I744 HydrophobicContact SD-CD1 3.99Å; M740-I744 HydrophobicContact SD-CG1 4.39Å
741	K	81.2	Confident	72.1	Confident	66 Å²	66	78.5 Å²	78.5	29%	0.287	36%	0.357	S	S	.	.	H	α-helix	trans	-59.2	-42	174.5	-77.7	172	176.7	177.8	0	111.5	I555 E557 K737 E738 R739 L745	I555-K741 HydrophobicContact CB-CG 3.79Å; I555-K741 HydrophobicContact CD1-CG 3.99Å; I555-K741 HydrophobicContact CG1-CG 4.49Å; I555-K741 HydrophobicContact CG2-CG 3.82Å; I555-K741 WeakPolarHBondContact O-CE 3.25Å; E557-K741 IonicContact OE1-NZ 2.7Å; E557-K741 PolarHBondContact OE1-NZ 3.17Å; E557-K741 IonicContact OE2-NZ 2.62Å; E557-K741 PolarHBondContact OE2-NZ 2.93Å; K737-K741 WeakPolarHBondContact O-CB 3.4Å; K737-K741 VanDerWaalsContact O-CG 3.25Å; K737-K741 WeakPolarHBondContact O-CG 3.41Å; K737-K741 PolarHBondContact O-N 3.14Å; E738-K741 PolarHBondContact O-N 2.92Å; R739-K741 PolarHBondContact O-N 3.14Å; K741-L745 VanDerWaalsContact O-CB 3.24Å; K741-L745 WeakPolarHBondContact O-CB 3.26Å; K741-L745 PolarHBondContact O-N 3.22Å
742	K	77	Confident	70.4	Confident	138 Å²	138	74.9 Å²	74.9	60%	0.6	35%	0.353	S	S	*	.	H	α-helix	trans	-64.3	-45.1	175	-70.7	167.1	-176.8	170.3	0	112.1	E738 R739 M740 L745 R746	E738-K742 WeakPolarHBondContact O-CG 3.47Å; E738-K742 PolarHBondContact O-N 3.05Å; R739-K742 WeakPolarHBondContact O-CB 3.45Å; R739-K742 PolarHBondContact O-N 3.29Å; R739-K742 VanDerWaalsContact O-N 3.13Å; M740-K742 VanDerWaalsContact C-N 3.34Å; M740-K742 PolarHBondContact O-N 3.28Å; K742-L745 PolarHBondContact O-N 2.87Å; K742-R746 PolarHBondContact O-N 2.93Å
743	Y	81.4	Confident	68.3	Low	17 Å²	17	75.1 Å²	75.1	7%	0.067	36%	0.363	C	S	.	.	H	α-helix	trans	-58.7	-52	176.1	169.7	-103.1	0	0	0	111.7	F551 E630 F631 I657 G661 R739 M740 L745 R746 R747	F551-Y743 HydrophobicContact CD1-CE1 4.43Å; E630-Y743 PolarHBondContact OE1-OH 2.68Å; F631-Y743 WeakPolarHBondContact CZ-OH 3.49Å; I657-Y743 HydrophobicContact CD1-CE1 4.47Å; I657-Y743 HydrophobicContact CD1-CE2 4.45Å; I657-Y743 HydrophobicContact CG2-CD1 3.72Å; I657-Y743 HydrophobicContact CG2-CE1 3.63Å; I657-Y743 HydrophobicContact CG2-CG 4.25Å; G661-Y743 WeakPolarHBondContact O-CB 3.39Å; R739-Y743 PolarHBondContact O-N 2.9Å; M740-Y743 PolarHBondContact O-N 3.49Å; M740-Y743 HydrophobicContact SD-CD1 4.3Å; Y743-L745 VanDerWaalsContact C-N 3.3Å; Y743-L745 PolarHBondContact O-N 2.92Å; Y743-R746 PolarHBondContact O-N 2.91Å; Y743-R747 VanDerWaalsContact O-CB 3.31Å; Y743-R747 WeakPolarHBondContact O-CB 3.36Å; Y743-R747 PolarHBondContact O-N 3.34Å; Y743-R747 WeakPolarHBondContact OH-CD 3.44Å; Y743-R747 PolarHBondContact OH-NE 3.48Å
744	I	75.3	Confident	65.9	Low	10 Å²	10	78.3 Å²	78.3	5%	0.051	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-38.3	178.4	-66.9	158.5	0	0	0	111.3	F551 I555 M740 R747 K748	F551-I744 HydrophobicContact CB-CD1 4.14Å; F551-I744 HydrophobicContact CB-CG1 4.31Å; F551-I744 WeakPolarHBondContact O-CD1 3.39Å; I555-I744 HydrophobicContact CB-CD1 4.45Å; I555-I744 HydrophobicContact CD1-CD1 3.8Å; I555-I744 HydrophobicContact CD1-CG2 4.35Å; I555-I744 HydrophobicContact CG1-CD1 4.04Å; I555-I744 HydrophobicContact CG2-CD1 3.59Å; M740-I744 HydrophobicContact CG-CD1 3.75Å; M740-I744 WeakPolarHBondContact O-CD1 3.47Å; M740-I744 WeakPolarHBondContact O-CG1 3.43Å; M740-I744 PolarHBondContact O-N 3.39Å; M740-I744 HydrophobicContact SD-CD1 3.99Å; M740-I744 HydrophobicContact SD-CG1 4.39Å; I744-R747 PolarHBondContact O-N 3.42Å; I744-K748 HydrophobicContact CG2-CD 4.18Å; I744-K748 WeakPolarHBondContact O-CG 3.43Å; I744-K748 PolarHBondContact O-N 3.02Å
745	L	66.6	Low	63.1	Low	97 Å²	97	74.4 Å²	74.4	51%	0.508	36%	0.364	S	S	.	.	H	α-helix	trans	-66.3	-49.4	177.4	-170.9	64	0	0	0	111.5	K741 K742 Y743 R747 K748 W749	K741-L745 VanDerWaalsContact O-CB 3.24Å; K741-L745 WeakPolarHBondContact O-CB 3.26Å; K741-L745 PolarHBondContact O-N 3.22Å; K742-L745 PolarHBondContact O-N 2.87Å; Y743-L745 VanDerWaalsContact C-N 3.3Å; Y743-L745 PolarHBondContact O-N 2.92Å; L745-R747 PolarHBondContact O-N 3.49Å; L745-K748 PolarHBondContact O-N 3.5Å; L745-W749 VanDerWaalsContact O-CD1 3.27Å; L745-W749 PolarHBondContact O-N 2.85Å
746	R	65.4	Low	60.4	Low	114 Å²	114	79.5 Å²	79.5	43%	0.43	40%	0.395	S	S	.	.	H	α-helix	trans	-52.2	-45.4	173.6	179.6	178	177.3	170.5	-0.4	110.8	M666 K742 Y743 K748 W749 Q750	M666-R746 PolarHBondContact SD-NH1 2.89Å; M666-R746 PolarHBondContact SD-NH2 2.78Å; K742-R746 PolarHBondContact O-N 2.93Å; Y743-R746 PolarHBondContact O-N 2.91Å; R746-K748 VanDerWaalsContact C-N 3.33Å; R746-K748 PolarHBondContact O-N 3.04Å; R746-W749 PolarHBondContact O-N 3.03Å; R746-Q750 PolarHBondContact O-N 3.16Å
747	R	64.1	Low	58	Low	23 Å²	23	83.3 Å²	83.3	9%	0.087	40%	0.399	C	S	.	.	H	α-helix	trans	-66.4	-28.6	179.7	-156.2	171.2	-160	-92.3	-4.1	114	E593 Y743 I744 L745 K751	E593-R747 IonicContact OE1-CZ 2.72Å; E593-R747 IonicContact OE1-NH1 3.08Å; E593-R747 PolarHBondContact OE1-NH1 2.88Å; E593-R747 IonicContact OE1-NH2 3.14Å; E593-R747 IonicContact OE2-CZ 3.76Å; E593-R747 IonicContact OE2-NH1 3.39Å; E593-R747 PolarHBondContact OE2-NH1 3.29Å; E593-R747 IonicContact OE2-NH2 2.74Å; E593-R747 PolarHBondContact OE2-NH2 3.13Å; Y743-R747 VanDerWaalsContact O-CB 3.31Å; Y743-R747 WeakPolarHBondContact O-CB 3.36Å; Y743-R747 PolarHBondContact O-N 3.34Å; Y743-R747 WeakPolarHBondContact OH-CD 3.44Å; Y743-R747 PolarHBondContact OH-NE 3.48Å; I744-R747 PolarHBondContact O-N 3.42Å; L745-R747 PolarHBondContact O-N 3.49Å; R747-K751 WeakPolarHBondContact O-CB 3.46Å; R747-K751 WeakPolarHBondContact O-CD 3.1Å; R747-K751 VanDerWaalsContact O-CG 3.29Å; R747-K751 WeakPolarHBondContact O-CG 3.46Å
748	K	54.6	Low	55.7	Low	85 Å²	85	83 Å²	83	37%	0.37	40%	0.4	S	S	.	.	H	α-helix	trans	-77.1	-37.3	171	-75.5	175.4	178.2	-174.5	0	112.2	E552 I744 L745 R746 K751 T752	E552-K748 WeakPolarHBondContact OE1-CE 3.42Å; E552-K748 IonicContact OE1-NZ 3.95Å; E552-K748 PolarHBondContact OE1-NZ 2.98Å; I744-K748 HydrophobicContact CG2-CD 4.18Å; I744-K748 WeakPolarHBondContact O-CG 3.43Å; I744-K748 PolarHBondContact O-N 3.02Å; L745-K748 PolarHBondContact O-N 3.5Å; R746-K748 VanDerWaalsContact C-N 3.33Å; R746-K748 PolarHBondContact O-N 3.04Å; K748-K751 CarbonylContact O-C 3.5Å; K748-K751 VanDerWaalsContact O-C 3.32Å; K748-K751 PolarHBondContact O-N 2.95Å; K748-T752 PolarHBondContact O-N 2.69Å
749	W	37.5	Very low	53.4	Low	184 Å²	184	77.6 Å²	77.6	70%	0.697	38%	0.376	S	S	*	.	H	α-helix	trans	-67.6	-34	175	-84.2	75.3	0	0	0	112.8	L745 R746 K751 T752	L745-W749 VanDerWaalsContact O-CD1 3.27Å; L745-W749 PolarHBondContact O-N 2.85Å; R746-W749 PolarHBondContact O-N 3.03Å; W749-K751 PolarHBondContact O-N 3.21Å; W749-T752 PolarHBondContact O-OG1 3.27Å
750	Q	41.8	Very low	51	Low	111 Å²	111	75.3 Å²	75.3	52%	0.519	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-5.5	169.3	-71.7	172.1	-58.3	0	0	113.7	R746	R746-Q750 PolarHBondContact O-N 3.16Å
751	K	47.4	Very low	49.2	Very low	92 Å²	92	78.6 Å²	78.6	40%	0.4	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	37.3	-169.3	-65.4	-177.4	179.7	176.6	0	113.1	E593 R747 K748 W749 G753	E593-K751 IonicContact OE1-NZ 2.76Å; E593-K751 PolarHBondContact OE1-NZ 3.21Å; R747-K751 WeakPolarHBondContact O-CB 3.46Å; R747-K751 WeakPolarHBondContact O-CD 3.1Å; R747-K751 VanDerWaalsContact O-CG 3.29Å; R747-K751 WeakPolarHBondContact O-CG 3.46Å; K748-K751 CarbonylContact O-C 3.5Å; K748-K751 VanDerWaalsContact O-C 3.32Å; K748-K751 PolarHBondContact O-N 2.95Å; W749-K751 PolarHBondContact O-N 3.21Å; K751-G753 PolarHBondContact O-N 2.9Å
752	T	35.1	Very low	47.5	Very low	131 Å²	131	75.9 Å²	75.9	80%	0.804	37%	0.368	S	S	*	.			trans	-71	64.7	179.6	19.3	0	0	0	0	113	K748 W749	K748-T752 PolarHBondContact O-N 2.69Å; W749-T752 PolarHBondContact O-OG1 3.27Å
753	G	31.7	Very low	45.8	Very low	47 Å²	47	69.4 Å²	69.4	49%	0.485	34%	0.34	S	S	.	.	S	Bend	trans	-149	50	-172.9	0	0	0	0	0	113.9	K751	K751-G753 PolarHBondContact O-N 2.9Å
754	H	30.9	Very low	44	Very low	126 Å²	126	71.1 Å²	71.1	58%	0.583	35%	0.354	S	S	*	.			trans	61.6	121.9	171.4	-59.9	-84.4	0	0	0	119.6	Y356	Y356-H754 AromaticContact CD1-NE2 3.95Å; Y356-H754 AromaticContact CE1-NE2 3.36Å; Y356-H754 WeakPolarHBondContact CE1-NE2 3.21Å
755	A	28.2	Very low	42.8	Very low	37 Å²	37	71.3 Å²	71.3	31%	0.306	36%	0.355	S	S	.	.			trans	-155.4	132.4	132.6	0	0	0	0	0	109.8	R761	A755-R761 HydrophobicContact CB-CG 3.45Å; A755-R761 VanDerWaalsContact CB-CG 3.45Å
756	V	31.3	Very low	41.5	Very low	121 Å²	121	67.1 Å²	67.1	73%	0.733	33%	0.334	S	S	*	.	S	Bend	trans	-105	119.9	167.9	176.7	0	0	0	0	106.5
757	R	34.3	Very low	40.2	Very low	149 Å²	149	63.3 Å²	63.3	56%	0.562	32%	0.322	S	S	*	.	S	Bend	trans	66.7	146.2	-161.4	-51.7	-179.9	-177.6	158.5	-0.6	113.6	E472 G760	E472-R757 IonicContact OE1-CZ 3.52Å; E472-R757 IonicContact OE1-NH1 2.72Å; E472-R757 PolarHBondContact OE1-NH1 2.98Å; E472-R757 IonicContact OE2-NH1 2.67Å; R757-G760 PolarHBondContact O-N 3.46Å
758	A	34.2	Very low	38.9	Very low	14 Å²	14	63.4 Å²	63.4	12%	0.116	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-69.7	-37.7	-170.1	0	0	0	0	0	114	E549 M596 G760 R761	E549-A758 HydrophobicContact CG-CB 4.36Å; M596-A758 HydrophobicContact CE-CB 3.56Å; A758-G760 PolarHBondContact O-N 3.41Å; A758-R761 WeakPolarHBondContact O-CB 3.27Å; A758-R761 PolarHBondContact O-N 3.06Å
759	I	34.7	Very low	38.1	Very low	19 Å²	19	60.6 Å²	60.6	10%	0.097	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-50.8	-30.3	173.1	-59.8	152.4	0	0	0	111.4	L474 V482 A495 M544 I545 M596 R761 L762	L474-I759 HydrophobicContact CB-CB 4.48Å; L474-I759 HydrophobicContact CB-CG2 4.19Å; L474-I759 HydrophobicContact CD1-CB 4.46Å; L474-I759 HydrophobicContact CD1-CD1 4.35Å; L474-I759 HydrophobicContact CD1-CG2 3.78Å; V482-I759 HydrophobicContact CG1-CG2 3.94Å; A495-I759 HydrophobicContact CB-CG2 4.17Å; M544-I759 HydrophobicContact SD-CD1 3.6Å; M544-I759 HydrophobicContact SD-CG1 4.43Å; I545-I759 VanDerWaalsContact O-CD1 3.26Å; I545-I759 WeakPolarHBondContact O-CD1 3.45Å; I545-I759 WeakPolarHBondContact O-CG1 3.45Å; M596-I759 HydrophobicContact CE-CG1 4.32Å; I759-R761 PolarHBondContact O-N 3.5Å; I759-L762 HydrophobicContact CG2-CD1 4.31Å; I759-L762 WeakPolarHBondContact O-CB 3.27Å; I759-L762 PolarHBondContact O-N 3.34Å
760	G	32.8	Very low	38	Very low	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-59.2	-25.2	177.9	0	0	0	0	0	115.1	L474 R757 A758 L762 S763	L474-G760 WeakPolarHBondContact O-CA 3.17Å; L474-G760 PolarHBondContact O-N 3Å; R757-G760 PolarHBondContact O-N 3.46Å; A758-G760 PolarHBondContact O-N 3.41Å; G760-L762 VanDerWaalsContact C-N 3.28Å; G760-L762 PolarHBondContact O-N 3.18Å; G760-S763 WeakPolarHBondContact O-CB 3.44Å; G760-S763 PolarHBondContact O-N 3.43Å; G760-S763 PolarHBondContact O-OG 2.88Å
761	R	48.8	Very low	37.6	Very low	69 Å²	69	49 Å²	49	26%	0.26	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-70.2	-22	-177.1	-62	-179.7	-167.2	-173.1	15.8	113.1	E549 E552 A755 A758 I759 S763 S764	E549-R761 WeakPolarHBondContact OE1-CD 3.36Å; E549-R761 IonicContact OE1-CZ 3.08Å; E549-R761 IonicContact OE1-NE 2.82Å; E549-R761 IonicContact OE1-NH1 3.33Å; E549-R761 PolarHBondContact OE1-NH1 2.93Å; E549-R761 IonicContact OE2-CZ 2.68Å; E549-R761 IonicContact OE2-NH1 2.76Å; E549-R761 PolarHBondContact OE2-NH1 3.3Å; E549-R761 IonicContact OE2-NH2 2.68Å; E552-R761 IonicContact OE1-CZ 2.86Å; E552-R761 IonicContact OE1-NH1 2.93Å; E552-R761 IonicContact OE1-NH2 2.87Å; E552-R761 PolarHBondContact OE1-NH2 3.03Å; E552-R761 IonicContact OE2-NH2 3.68Å; E552-R761 PolarHBondContact OE2-NH2 2.89Å; A755-R761 HydrophobicContact CB-CG 3.45Å; A755-R761 VanDerWaalsContact CB-CG 3.45Å; A758-R761 WeakPolarHBondContact O-CB 3.27Å; A758-R761 PolarHBondContact O-N 3.06Å; I759-R761 PolarHBondContact O-N 3.5Å; R761-S763 PolarHBondContact O-N 3.41Å; R761-S764 PolarHBondContact O-N 3.33Å
762	L	43.8	Very low	36.8	Very low	9 Å²	9	48.5 Å²	48.5	5%	0.047	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55.4	-17.1	170	-74.4	165.2	0	0	0	113.9	V482 K497 L542 I608 I759 G760 S764 M765	V482-L762 HydrophobicContact CG2-CB 3.8Å; K497-L762 WeakPolarHBondContact CE-O 3.4Å; L542-L762 HydrophobicContact CD1-CD1 4.16Å; L542-L762 HydrophobicContact CD1-CD2 4.36Å; I608-L762 HydrophobicContact CB-CD2 4.46Å; I608-L762 HydrophobicContact CD1-CD2 3.89Å; I608-L762 HydrophobicContact CD1-CG 4.2Å; I608-L762 WeakPolarHBondContact O-CD2 3.44Å; I759-L762 HydrophobicContact CG2-CD1 4.31Å; I759-L762 WeakPolarHBondContact O-CB 3.27Å; I759-L762 PolarHBondContact O-N 3.34Å; G760-L762 VanDerWaalsContact C-N 3.28Å; G760-L762 PolarHBondContact O-N 3.18Å; L762-S764 VanDerWaalsContact C-N 3.35Å; L762-M765 HydrophobicContact CD2-SD 3.99Å; L762-M765 HydrophobicContact CG-SD 4.4Å
763	S	41.5	Very low	36.4	Very low	3 Å²	3	46.5 Å²	46.5	2%	0.021	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-77.5	-15.2	174.7	62.7	0	0	0	0	114.7	T476 G477 F479 G480 G760 R761	T476-S763 VanDerWaalsContact CA-OG 3.31Å; T476-S763 WeakPolarHBondContact CA-OG 3.47Å; T476-S763 PolarHBondContact N-OG 2.92Å; T476-S763 PolarHBondContact O-OG 3.3Å; G477-S763 CarbonylContact C-O 3.57Å; G477-S763 VanDerWaalsContact C-O 3.27Å; G477-S763 WeakPolarHBondContact CA-OG 3.24Å; G477-S763 PolarHBondContact N-OG 2.84Å; F479-S763 PolarHBondContact N-O 3.32Å; F479-S763 VanDerWaalsContact N-O 3.11Å; G480-S763 PolarHBondContact N-O 2.93Å; G480-S763 VanDerWaalsContact N-O 3.16Å; G760-S763 WeakPolarHBondContact O-CB 3.44Å; G760-S763 PolarHBondContact O-N 3.43Å; G760-S763 PolarHBondContact O-OG 2.88Å; R761-S763 PolarHBondContact O-N 3.41Å
764	S	43.8	Very low	36.1	Very low	52 Å²	52	50.9 Å²	50.9	36%	0.364	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-101.4	9.5	173.1	-73.2	0	0	0	0	113	G477 K478 F479 R761 L762	G477-S764 WeakPolarHBondContact CA-OG 3.34Å; K478-S764 PolarHBondContact N-OG 2.84Å; K478-S764 VanDerWaalsContact N-OG 3.14Å; F479-S764 WeakPolarHBondContact CD2-O 3.49Å; F479-S764 WeakPolarHBondContact CE2-O 3.48Å; R761-S764 PolarHBondContact O-N 3.33Å; L762-S764 VanDerWaalsContact C-N 3.35Å
765	M	50.2	Low	36.1	Very low	14 Å²	14	55 Å²	55	7%	0.069	30%	0.303	C	S	.	.			trans	-119.3	112.4	-172.5	-71.3	165.9	137.8	0	0	110.2	K497 E593 N594 I608 D609 L762	K497-M765 WeakPolarHBondContact CE-O 3.33Å; K497-M765 PolarHBondContact NZ-O 2.99Å; E593-M765 HydrophobicContact CG-CE 4.3Å; N594-M765 WeakPolarHBondContact OD1-CE 3.41Å; I608-M765 HydrophobicContact CD1-CE 3.81Å; I608-M765 HydrophobicContact CD1-SD 3.88Å; I608-M765 HydrophobicContact CG1-CE 4.41Å; D609-M765 HydrophobicContact CB-CB 4.41Å; D609-M765 HydrophobicContact CB-CE 3.78Å; D609-M765 HydrophobicContact CB-CG 4.35Å; D609-M765 HydrophobicContact CB-SD 4.1Å; D609-M765 VanDerWaalsContact OD2-CB 3.25Å; D609-M765 WeakPolarHBondContact OD2-CB 3.28Å; D609-M765 VanDerWaalsContact OD2-CG 3.29Å; D609-M765 WeakPolarHBondContact OD2-CG 3.39Å; L762-M765 HydrophobicContact CD2-SD 3.99Å; L762-M765 HydrophobicContact CG-SD 4.4Å
766	A	39.7	Very low	36	Very low	9 Å²	9	56.3 Å²	56.3	7%	0.074	32%	0.321	C	S	.	.	S	Bend	trans	-170.7	158.7	173.5	0	0	0	0	0	111.4	F479 I499 E513 M768	F479-A766 HydrophobicContact CB-CB 3.9Å; F479-A766 HydrophobicContact CD2-CB 3.96Å; F479-A766 HydrophobicContact CG-CB 4.02Å; I499-A766 HydrophobicContact CD1-CB 4.46Å; I499-A766 HydrophobicContact CG2-CB 4.36Å; E513-A766 WeakPolarHBondContact OE2-CA 3.2Å; A766-M768 HydrophobicContact CB-CB 4.05Å; A766-M768 HydrophobicContact CB-CG 4.04Å; A766-M768 PolarHBondContact O-N 3.35Å
767	M	39	Very low	35.9	Very low	35 Å²	35	55.9 Å²	55.9	17%	0.172	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	20.8	169.5	-161.4	179.2	-177.9	0	0	114.4	N509 Q512 E513 G611	N509-M767 HydrophobicContact CB-CB 4.03Å; N509-M767 HydrophobicContact CB-CG 3.83Å; N509-M767 HydrophobicContact CB-SD 3.8Å; N509-M767 PolarHBondContact ND2-O 3.16Å; Q512-M767 HydrophobicContact CB-SD 4.34Å; E513-M767 PolarHBondContact OE2-N 3.43Å; G611-M767 WeakPolarHBondContact O-CA 3.49Å; G611-M767 WeakPolarHBondContact O-CB 3.33Å; G611-M767 VanDerWaalsContact O-CG 3.22Å; G611-M767 WeakPolarHBondContact O-CG 3.4Å
768	M	36.4	Very low	35.6	Very low	24 Å²	24	53.5 Å²	53.5	12%	0.118	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-10.7	-173.5	-77.5	-63.7	-59.1	0	0	114.5	F479 I499 K500 D506 V510 A766 G770	F479-M768 HydrophobicContact CB-CB 4.38Å; F479-M768 HydrophobicContact CD1-CB 3.46Å; F479-M768 VanDerWaalsContact CD1-CB 3.46Å; F479-M768 HydrophobicContact CE1-CB 3.9Å; F479-M768 HydrophobicContact CG-CB 3.93Å; I499-M768 HydrophobicContact CG2-CG 4.07Å; K500-M768 WeakPolarHBondContact O-CE 3.47Å; D506-M768 HydrophobicContact CB-CE 3.71Å; D506-M768 HydrophobicContact CB-SD 3.55Å; D506-M768 VanDerWaalsContact CB-SD 3.55Å; V510-M768 HydrophobicContact CG2-CG 4.3Å; V510-M768 HydrophobicContact CG2-SD 4.45Å; A766-M768 HydrophobicContact CB-CB 4.05Å; A766-M768 HydrophobicContact CB-CG 4.04Å; A766-M768 PolarHBondContact O-N 3.35Å; M768-G770 PolarHBondContact O-N 2.73Å
769	A	36.9	Very low	35.2	Very low	27 Å²	27	56.7 Å²	56.7	22%	0.223	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-5.4	-172.6	0	0	0	0	0	115.8	F479 L625	F479-A769 HydrophobicContact CE1-CB 4.26Å; F479-A769 HydrophobicContact CE2-CB 4.33Å; F479-A769 HydrophobicContact CZ-CB 3.59Å; L625-A769 HydrophobicContact CD1-CB 3.45Å; L625-A769 VanDerWaalsContact CD1-CB 3.45Å; L625-A769 HydrophobicContact CD2-CB 3.8Å; L625-A769 HydrophobicContact CG-CB 4.26Å
770	G	35.6	Very low	35.1	Very low	14 Å²	14	62.3 Å²	62.3	14%	0.144	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	39.3	-175.7	0	0	0	0	0	114.4	K623 M768 C788	K623-G770 PolarHBondContact NZ-O 3.34Å; M768-G770 PolarHBondContact O-N 2.73Å; G770-C788 WeakPolarHBondContact CA-SG 3.41Å
771	V	32.7	Very low	35	Very low	37 Å²	37	67.5 Å²	67.5	22%	0.224	40%	0.395	C	S	.	.	S	Bend	trans	-128.9	127.8	170.4	-171.7	0	0	0	0	110.3	K505 D506 A773	K505-V771 HydrophobicContact CD-CG2 4.49Å; K505-V771 HydrophobicContact CG-CG2 4.4Å; D506-V771 WeakPolarHBondContact OD1-CG1 3.31Å; V771-A773 PolarHBondContact O-N 2.9Å
772	S	30.9	Very low	34.2	Very low	82 Å²	82	68.3 Å²	68.3	57%	0.573	41%	0.405	S	S	*	.			trans	-63.7	116.3	-178.9	-176	0	0	0	0	111.2	K774	S772-K774 VanDerWaalsContact C-N 3.3Å; S772-K774 PolarHBondContact O-N 2.91Å; S772-K774 WeakPolarHBondContact OG-CE 3.47Å
773	A	26.8	Very low	33.5	Very low	89 Å²	89	71.7 Å²	71.7	74%	0.736	42%	0.423	S	S	*	.			trans	-74.9	76	-178.9	0	0	0	0	0	112	V771	V771-A773 PolarHBondContact O-N 2.9Å
774	K	25.9	Very low	33.1	Very low	138 Å²	138	77.1 Å²	77.1	60%	0.6	45%	0.448	S	S	*	.			trans	-108.1	125.2	168.8	-53.8	-160.9	-174.4	-149.6	0	108.8	S772 E780	S772-K774 VanDerWaalsContact C-N 3.3Å; S772-K774 PolarHBondContact O-N 2.91Å; S772-K774 WeakPolarHBondContact OG-CE 3.47Å; K774-E780 WeakPolarHBondContact CE-OE1 3.36Å; K774-E780 IonicContact NZ-OE1 3.59Å; K774-E780 PolarHBondContact NZ-OE1 2.96Å; K774-E780 IonicContact NZ-OE2 2.79Å; K774-E780 PolarHBondContact NZ-OE2 2.86Å
775	K	29.8	Very low	32.3	Very low	212 Å²	212	84 Å²	84	92%	0.922	47%	0.472	S	S	*	.	S	Bend	cis	-152.3	123.7	18.1	-165.1	173.3	-172.4	173	0	111.1
776	G	26.5	Very low	31.6	Very low	66 Å²	66	86.5 Å²	86.5	68%	0.68	49%	0.485	S	S	*	.	S	Bend	trans	174.5	31.6	-179.2	0	0	0	0	0	118.7
777	S	30	Very low	31.4	Very low	111 Å²	111	91.7 Å²	91.7	78%	0.776	51%	0.507	S	S	*	.	S	Bend	trans	44	92.6	172.8	57.6	0	0	0	0	115.5
778	P	27.1	Very low	31.2	Very low	99 Å²	99	91.7 Å²	91.7	64%	0.643	51%	0.51	S	S	*	.	S	Bend		-85.2	165.4	72.1	-26.8	37.2	0	0	0	116.3	D782	P778-D782 WeakPolarHBondContact CB-OD2 3.21Å
779	T	27.2	Very low	31.3	Very low	82 Å²	82	93.2 Å²	93.2	50%	0.503	52%	0.519	S	S	.	.			trans	-65.6	166.6	167.5	37	0	0	0	0	111	E781	T779-E781 WeakPolarHBondContact CB-OE2 3.34Å; T779-E781 PolarHBondContact O-N 2.92Å; T779-E781 VanDerWaalsContact O-N 3.13Å; T779-E781 PolarHBondContact OG1-OE2 2.88Å
780	E	30.9	Very low	31.4	Very low	137 Å²	137	97.5 Å²	97.5	64%	0.64	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-75.2	1.7	-174.6	-58.9	-168.9	79.1	0	0	113.2	K774	K774-E780 WeakPolarHBondContact CE-OE1 3.36Å; K774-E780 IonicContact NZ-OE1 3.59Å; K774-E780 PolarHBondContact NZ-OE1 2.96Å; K774-E780 IonicContact NZ-OE2 2.79Å; K774-E780 PolarHBondContact NZ-OE2 2.86Å
781	E	32.6	Very low	31.7	Very low	109 Å²	109	98.3 Å²	98.3	51%	0.509	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-71.8	-31.2	-176	-68.9	128.1	-162.7	0	0	114.7	T779 N783 Q784	T779-E781 WeakPolarHBondContact CB-OE2 3.34Å; T779-E781 PolarHBondContact O-N 2.92Å; T779-E781 VanDerWaalsContact O-N 3.13Å; T779-E781 PolarHBondContact OG1-OE2 2.88Å; E781-N783 PolarHBondContact O-N 2.88Å; E781-Q784 PolarHBondContact O-N 2.84Å
782	D	30.5	Very low	32.3	Very low	85 Å²	85	103.6 Å²	103.6	46%	0.455	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-61.3	5.5	-177.5	-89	-27.7	0	0	0	115.5	K478 P778	K478-D782 PolarHBondContact NZ-O 2.89Å; P778-D782 WeakPolarHBondContact CB-OD2 3.21Å
783	N	29.9	Very low	33.1	Very low	81 Å²	81	101.1 Å²	101.1	43%	0.433	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-123.1	-6.2	-174	-72.4	-54.4	0	0	0	115.9	K478 E781 F785 L786	K478-N783 WeakPolarHBondContact CE-OD1 3.2Å; K478-N783 PolarHBondContact NZ-OD1 2.91Å; E781-N783 PolarHBondContact O-N 2.88Å; N783-F785 PolarHBondContact O-N 2.78Å; N783-L786 PolarHBondContact O-N 2.96Å
784	Q	31.9	Very low	34.1	Very low	117 Å²	117	101 Å²	101	55%	0.547	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1.6	-164	-144.3	174	34.8	0	0	116.4	E781	E781-Q784 PolarHBondContact O-N 2.84Å
785	F	28.9	Very low	35.3	Very low	197 Å²	197	99.5 Å²	99.5	86%	0.864	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	6.2	176.3	-94.7	-76.6	0	0	0	115.3	N783	N783-F785 PolarHBondContact O-N 2.78Å
786	L	33.9	Very low	36.6	Very low	65 Å²	65	94.3 Å²	94.3	34%	0.34	50%	0.499	S	S	.	.			trans	-137.5	89.1	172.8	-78.7	169.6	0	0	0	109.6	L625 N783 C788	L625-L786 HydrophobicContact CB-CD2 4.47Å; L625-L786 HydrophobicContact CD2-CB 4.43Å; N783-L786 PolarHBondContact O-N 2.96Å; L786-C788 PolarHBondContact O-N 3.41Å
787	E	35.3	Very low	38.3	Very low	118 Å²	118	93.2 Å²	93.2	55%	0.551	48%	0.481	S	S	*	.			trans	-62.9	108.4	167	-72.8	-159	142.3	0	0	109.2	L789	E787-L789 PolarHBondContact O-N 3.3Å
788	C	35.8	Very low	40.1	Very low	35 Å²	35	94 Å²	94	24%	0.236	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	87.7	-179.4	-162.7	0	0	0	0	108.6	V624 L625 G770 L786 E790	V624-C788 WeakPolarHBondContact O-CA 3.46Å; L625-C788 HydrophobicContact CD2-CB 4.02Å; G770-C788 WeakPolarHBondContact CA-SG 3.41Å; L786-C788 PolarHBondContact O-N 3.41Å; C788-E790 PolarHBondContact O-N 2.9Å
789	L	38.4	Very low	43.1	Very low	56 Å²	56	89.2 Å²	89.2	29%	0.293	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	110.7	-176.2	-81.2	157	0	0	0	110.1	K623 V624 F626 Y639 E787 Y791	K623-L789 WeakPolarHBondContact CA-O 3.34Å; V624-L789 PolarHBondContact N-O 3.43Å; V624-L789 PolarHBondContact O-N 3.37Å; V624-L789 VanDerWaalsContact O-N 3.12Å; F626-L789 HydrophobicContact CD2-CD1 3.92Å; F626-L789 HydrophobicContact CE2-CB 4.26Å; F626-L789 HydrophobicContact CE2-CD1 3.45Å; F626-L789 VanDerWaalsContact CE2-CD1 3.45Å; F626-L789 HydrophobicContact CE2-CG 4.41Å; F626-L789 HydrophobicContact CZ-CD1 4.41Å; Y639-L789 WeakPolarHBondContact OH-CD1 3.33Å; E787-L789 PolarHBondContact O-N 3.3Å; L789-Y791 PolarHBondContact O-N 3.31Å
790	E	38.4	Very low	45.8	Very low	118 Å²	118	88.2 Å²	88.2	55%	0.551	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	103.1	175.7	-55.4	-161.9	-152.9	0	0	109.8	T621 K623 C788	T621-E790 HydrophobicContact CG2-CB 4.09Å; K623-E790 HydrophobicContact CD-CG 4.08Å; K623-E790 WeakPolarHBondContact CE-OE2 3.47Å; K623-E790 HydrophobicContact CG-CG 4.23Å; K623-E790 IonicContact NZ-OE1 2.77Å; K623-E790 PolarHBondContact NZ-OE1 2.89Å; K623-E790 IonicContact NZ-OE2 2.67Å; K623-E790 PolarHBondContact NZ-OE2 2.81Å; C788-E790 PolarHBondContact O-N 2.9Å
791	Y	42	Very low	48.4	Very low	30 Å²	30	83.5 Å²	83.5	12%	0.118	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.4	179.5	168.4	-114.6	0	0	0	110.6	T621 L622 Y639 L789 Q793 K794	T621-Y791 CarbonylContact C-O 3.46Å; T621-Y791 WeakPolarHBondContact CA-O 3.49Å; T621-Y791 WeakPolarHBondContact CG2-O 3.35Å; L622-Y791 HydrophobicContact CB-CD1 4.33Å; L622-Y791 PolarHBondContact N-O 2.93Å; L622-Y791 PolarHBondContact O-N 2.94Å; Y639-Y791 AromaticContact CD1-CD2 3.72Å; Y639-Y791 HydrophobicContact CD1-CD2 3.72Å; Y639-Y791 HydrophobicContact CD1-CE2 4.45Å; Y639-Y791 AromaticContact CD1-CG 3.91Å; Y639-Y791 HydrophobicContact CD1-CG 3.91Å; Y639-Y791 HydrophobicContact CG-CD2 4.25Å; Y639-Y791 WeakPolarHBondContact O-CE2 3.41Å; Y639-Y791 PolarHBondContact O-OH 3.34Å; L789-Y791 PolarHBondContact O-N 3.31Å; Y791-Q793 HydrophobicContact CD1-CG 4.29Å; Y791-Q793 HydrophobicContact CE1-CB 4.3Å; Y791-Q793 HydrophobicContact CE1-CG 3.99Å; Y791-K794 PolarHBondContact OH-N 3.24Å
792	E	45.1	Very low	50.6	Low	148 Å²	148	81.1 Å²	81.1	69%	0.692	41%	0.407	S	S	*	.			trans	-82	121.3	169.3	-64.3	-163.6	150.2	0	0	109.7	T621 K794	T621-E792 HydrophobicContact CG2-CG 3.87Å; T621-E792 PolarHBondContact OG1-OE1 3.13Å; E792-K794 PolarHBondContact O-N 2.92Å
793	Q	49	Very low	53.2	Low	30 Å²	30	79.7 Å²	79.7	14%	0.14	40%	0.403	C	S	.	.			trans	-65.7	119.9	-176.3	-64.1	-174.8	18	0	0	110.6	A619 L622 I642 Y791 T795	A619-Q793 VanDerWaalsContact CB-OE1 3.3Å; L622-Q793 HydrophobicContact CB-CG 4.36Å; I642-Q793 VanDerWaalsContact CD1-NE2 3.33Å; Y791-Q793 HydrophobicContact CD1-CG 4.29Å; Y791-Q793 HydrophobicContact CE1-CB 4.3Å; Y791-Q793 HydrophobicContact CE1-CG 3.99Å; Q793-T795 PolarHBondContact O-N 3.39Å
794	K	47.3	Very low	56.2	Low	88 Å²	88	79.4 Å²	79.4	38%	0.383	40%	0.404	S	S	.	.			trans	-62.5	104.9	164.4	-74.9	-169.6	176.3	-177.7	0	108.2	Y791 E792 E796 Y825 D827	Y791-K794 PolarHBondContact OH-N 3.24Å; E792-K794 PolarHBondContact O-N 2.92Å; K794-E796 PolarHBondContact O-N 2.59Å; K794-Y825 HydrophobicContact CB-CD1 3.9Å; K794-Y825 HydrophobicContact CB-CD2 3.9Å; K794-Y825 HydrophobicContact CB-CE1 4.35Å; K794-Y825 HydrophobicContact CB-CE2 4.33Å; K794-Y825 HydrophobicContact CB-CG 3.65Å; K794-Y825 HydrophobicContact CD-CD2 3.32Å; K794-Y825 HydrophobicContact CD-CE2 3.76Å; K794-Y825 HydrophobicContact CD-CG 3.91Å; K794-Y825 HydrophobicContact CG-CD2 4.27Å; K794-Y825 HydrophobicContact CG-CG 4.43Å; K794-Y825 WeakPolarHBondContact O-CD1 3.5Å; K794-D827 VanDerWaalsContact NZ-CG 3.33Å; K794-D827 IonicContact NZ-OD1 3.83Å; K794-D827 PolarHBondContact NZ-OD1 2.84Å; K794-D827 IonicContact NZ-OD2 3.33Å; K794-D827 PolarHBondContact NZ-OD2 2.79Å
795	T	51.4	Low	59.1	Low	106 Å²	106	74.2 Å²	74.2	65%	0.65	38%	0.38	S	S	*	.			trans	-67.6	129.6	175.4	50.9	0	0	0	0	110.4	Q793 S797	Q793-T795 PolarHBondContact O-N 3.39Å; T795-S797 WeakPolarHBondContact O-CB 3.41Å; T795-S797 PolarHBondContact O-N 2.81Å; T795-S797 VanDerWaalsContact O-N 3.11Å; T795-S797 PolarHBondContact O-OG 3.38Å
796	E	56.2	Low	62.2	Low	103 Å²	103	72.3 Å²	72.3	48%	0.481	37%	0.371	S	S	.	.			trans	-48.7	118.9	173.6	-91.8	-164.6	171.2	0	0	110.2	K709 K794 Y825 L878	K709-E796 IonicContact NZ-OE1 2.83Å; K709-E796 PolarHBondContact NZ-OE1 2.82Å; K794-E796 PolarHBondContact O-N 2.59Å; E796-Y825 CarbonylContact C-O 3.48Å; E796-Y825 WeakPolarHBondContact CA-O 3.29Å; E796-Y825 HydrophobicContact CG-CD1 4.41Å; E796-L878 HydrophobicContact CB-CD1 3.78Å; E796-L878 HydrophobicContact CG-CD1 4.24Å
797	S	62.4	Low	65.1	Low	43 Å²	43	74.2 Å²	74.2	30%	0.301	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	136.8	-169.1	44.4	0	0	0	0	111.1	T795 Y825 N876	T795-S797 WeakPolarHBondContact O-CB 3.41Å; T795-S797 PolarHBondContact O-N 2.81Å; T795-S797 VanDerWaalsContact O-N 3.11Å; T795-S797 PolarHBondContact O-OG 3.38Å; S797-Y825 PolarHBondContact N-O 2.9Å; S797-Y825 CarbonylContact O-C 3.57Å; S797-Y825 PolarHBondContact O-N 3.11Å; S797-Y825 PolarHBondContact OG-N 2.93Å; S797-Y825 VanDerWaalsContact OG-N 3.12Å; S797-N876 PolarHBondContact O-ND2 3.2Å
798	K	68.8	Low	67.8	Low	126 Å²	126	69.9 Å²	69.9	55%	0.548	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	159.4	172.7	65	163.5	-170.1	160.9	0	111.1	L878	K798-L878 HydrophobicContact CB-CB 4.23Å
799	P	88.2	Confident	70.6	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	146.7	178.2	-17.4	33.2	0	0	0	111.6	E823 P828 A874 N876 G879 A881	P799-E823 CarbonylContact C-O 3.59Å; P799-E823 WeakPolarHBondContact CA-O 3.28Å; P799-P828 HydrophobicContact CB-CB 4.25Å; P799-P828 HydrophobicContact CB-CG 4.49Å; P799-P828 HydrophobicContact CG-CB 3.99Å; P799-A874 HydrophobicContact CB-CB 3.81Å; P799-N876 WeakPolarHBondContact CD-OD1 3.32Å; P799-N876 HydrophobicContact CG-CB 4.2Å; P799-G879 WeakPolarHBondContact CD-O 3.39Å; P799-G879 WeakPolarHBondContact CG-O 3.24Å; P799-A881 HydrophobicContact CB-CB 4.28Å; P799-A881 WeakPolarHBondContact O-CB 3.36Å
800	T	85.6	Confident	73.1	Confident	60 Å²	60	74 Å²	74	37%	0.368	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	159.9	177.5	55.8	0	0	0	0	109.7	I822 E823	T800-I822 WeakPolarHBondContact O-CA 3.41Å; T800-E823 PolarHBondContact N-O 2.89Å; T800-E823 PolarHBondContact O-N 3.04Å; T800-E823 PolarHBondContact OG1-O 3.02Å
801	F	85.7	Confident	75.6	Confident	38 Å²	38	70.7 Å²	70.7	17%	0.167	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.7	175	-70.8	-88.4	0	0	0	109.3	V804 C820 K821 I822 V872 A874 A881 C883	F801-V804 HydrophobicContact CB-CG1 3.87Å; F801-C820 HydrophobicContact CD1-CB 4.14Å; F801-C820 HydrophobicContact CE1-CB 4.39Å; F801-K821 CarbonylContact C-O 3.54Å; F801-K821 WeakPolarHBondContact CA-O 3.29Å; F801-I822 HydrophobicContact CD1-CG1 3.9Å; F801-I822 HydrophobicContact CE1-CD1 3.98Å; F801-I822 HydrophobicContact CE1-CG1 3.62Å; F801-I822 HydrophobicContact CZ-CG1 4.41Å; F801-V872 HydrophobicContact CE1-CG1 3.55Å; F801-V872 HydrophobicContact CE1-CG2 4.2Å; F801-V872 HydrophobicContact CZ-CB 4.48Å; F801-V872 HydrophobicContact CZ-CG1 3.7Å; F801-V872 HydrophobicContact CZ-CG2 4.23Å; F801-A874 HydrophobicContact CZ-CB 4.34Å; F801-A881 HydrophobicContact CD2-CB 4Å; F801-A881 HydrophobicContact CE2-CB 3.79Å; F801-C883 HydrophobicContact CD1-CB 4.29Å; F801-C883 HydrophobicContact CD2-CB 4.1Å; F801-C883 HydrophobicContact CE1-CB 4.2Å; F801-C883 HydrophobicContact CE2-CB 4.03Å; F801-C883 HydrophobicContact CG-CB 4.24Å; F801-C883 HydrophobicContact CZ-CB 4.09Å
802	S	78.3	Confident	77.9	Confident	60 Å²	60	73.6 Å²	73.6	42%	0.42	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-21.5	174.2	62.1	0	0	0	0	112.4	K821 E823	S802-K821 PolarHBondContact N-O 2.83Å; S802-E823 VanDerWaalsContact CB-CD 3.43Å; S802-E823 WeakPolarHBondContact CB-OE1 3.34Å; S802-E823 VanDerWaalsContact OG-CD 3.23Å; S802-E823 PolarHBondContact OG-OE1 2.65Å
803	S	85.5	Confident	79.7	Confident	55 Å²	55	69.1 Å²	69.1	39%	0.385	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.4	152.2	78.7	0	0	0	0	110.5	C820 K821	S803-C820 WeakPolarHBondContact O-CB 3.39Å; S803-C820 VanDerWaalsContact OG-C 3.31Å; S803-C820 WeakPolarHBondContact OG-CA 3.31Å; S803-K821 PolarHBondContact N-O 3.36Å; S803-K821 PolarHBondContact O-N 2.97Å; S803-K821 WeakPolarHBondContact OG-CB 3.26Å; S803-K821 PolarHBondContact OG-N 3.37Å
804	V	91.6	Very high	81.6	Confident	75 Å²	75	69.8 Å²	69.8	46%	0.455	38%	0.383	S	S	.	.			trans	-108.6	148.1	-174.1	-74.1	0	0	0	0	110.6	F801 C883	F801-V804 HydrophobicContact CB-CG1 3.87Å; V804-C883 WeakPolarHBondContact CB-SG 3.36Å
805	I	93.2	Very high	83.6	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.041	39%	0.39	C	S	.	.			trans	-61.6	155.6	168.3	60.5	173.3	0	0	0	110.3	F818 C820 W832 V872 C883 A885	I805-F818 HydrophobicContact CB-CB 4.39Å; I805-F818 HydrophobicContact CB-CD1 4.35Å; I805-F818 HydrophobicContact CG2-CB 3.96Å; I805-C820 HydrophobicContact CG2-CB 3.75Å; I805-W832 HydrophobicContact CD1-CZ3 4.18Å; I805-W832 HydrophobicContact CG2-CH2 3.63Å; I805-W832 HydrophobicContact CG2-CZ3 3.97Å; I805-V872 HydrophobicContact CD1-CG1 4.07Å; I805-V872 HydrophobicContact CG1-CG1 4.36Å; I805-V872 HydrophobicContact CG2-CG1 4.22Å; I805-C883 HydrophobicContact CG1-CB 4.22Å; I805-A885 HydrophobicContact CB-CB 4.16Å; I805-A885 HydrophobicContact CD1-CB 3.81Å; I805-A885 HydrophobicContact CG1-CB 3.79Å
806	K	93.5	Very high	85.5	Confident	156 Å²	156	63.7 Å²	63.7	68%	0.678	36%	0.36	S	S	*	.			trans	-136.4	156.2	-177.3	-60.6	176.2	-173	168.4	0	109.1	F818 A885	K806-F818 VanDerWaalsContact O-CD1 3.29Å; K806-F818 WeakPolarHBondContact O-CD1 3.35Å; K806-F818 VanDerWaalsContact O-CE1 3.26Å; K806-F818 WeakPolarHBondContact O-CE1 3.43Å; K806-A885 WeakPolarHBondContact O-CB 3.48Å
807	D	94.8	Very high	87.3	Confident	106 Å²	106	64.5 Å²	64.5	57%	0.567	36%	0.358	S	S	*	.			trans	-61.6	144.8	178.9	-43.3	-52.2	0	0	0	110.6	A885 D886	D807-A885 WeakPolarHBondContact OD1-CA 3.49Å; D807-D886 VanDerWaalsContact CA-O 3.27Å; D807-D886 WeakPolarHBondContact CA-O 3.48Å; D807-D886 PolarHBondContact OD1-N 3Å
808	V	92.4	Very high	88.7	Confident	27 Å²	27	62.5 Å²	62.5	16%	0.164	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.9	-173.8	172	0	0	0	0	109.1	V810 A816 F818 D886 L887 L888	V808-V810 HydrophobicContact CG1-CG1 3.8Å; V808-A816 HydrophobicContact CG1-CB 4.04Å; V808-F818 HydrophobicContact CB-CE1 4.04Å; V808-F818 HydrophobicContact CB-CZ 4.27Å; V808-F818 HydrophobicContact CG2-CD1 3.84Å; V808-F818 HydrophobicContact CG2-CE1 3.61Å; V808-F818 HydrophobicContact CG2-CZ 4.23Å; V808-D886 PolarHBondContact N-O 3.03Å; V808-L887 HydrophobicContact CB-CD1 3.78Å; V808-L887 HydrophobicContact CG1-CD1 3.66Å; V808-L888 PolarHBondContact O-N 3.24Å
809	E	94.2	Very high	89.6	Confident	156 Å²	156	60 Å²	60	73%	0.729	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.8	174.8	-64	175	161.9	0	0	107.9	L888	E809-L888 HydrophobicContact CG-CB 4.25Å; E809-L888 HydrophobicContact CG-CD1 4.2Å
810	V	92.1	Very high	89.5	Confident	22 Å²	22	60.2 Å²	60.2	13%	0.133	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.5	-175.2	-78.4	0	0	0	0	111.8	V808 A816 V862 L887 L888 V889 E890	V808-V810 HydrophobicContact CG1-CG1 3.8Å; V810-A816 HydrophobicContact CG1-CB 4.22Å; V810-A816 HydrophobicContact CG2-CB 4.24Å; V810-V862 HydrophobicContact CG2-CG1 3.96Å; V810-L887 HydrophobicContact CG2-CD1 3.72Å; V810-L888 PolarHBondContact N-O 3.1Å; V810-V889 CarbonylContact O-C 3.57Å; V810-V889 WeakPolarHBondContact O-CA 3.17Å; V810-E890 PolarHBondContact O-N 2.86Å
811	V	89.8	Confident	89.5	Confident	47 Å²	47	59.7 Å²	59.7	29%	0.285	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	143.4	172.1	179.9	0	0	0	0	110.1	S814 E890 M892	V811-S814 VanDerWaalsContact O-CB 3.28Å; V811-S814 WeakPolarHBondContact O-CB 3.36Å; V811-S814 PolarHBondContact O-N 3.05Å; V811-S814 VanDerWaalsContact O-N 3.11Å; V811-S814 PolarHBondContact O-OG 2.87Å; V811-E890 WeakPolarHBondContact CA-O 3.42Å; V811-E890 HydrophobicContact CG2-CB 4.46Å; V811-M892 HydrophobicContact CG1-CE 4.1Å; V811-M892 HydrophobicContact CG1-CG 3.83Å; V811-M892 HydrophobicContact CG1-SD 4.35Å; V811-M892 HydrophobicContact CG2-CE 4.19Å
812	E	90.7	Very high	89.4	Confident	91 Å²	91	58.1 Å²	58.1	43%	0.425	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	138.7	174.1	-172.7	164.3	-135.9	0	0	112.1	S814 G864 V889 E890	E812-S814 VanDerWaalsContact C-N 3.29Å; E812-S814 PolarHBondContact O-N 3.38Å; E812-G864 PolarHBondContact OE1-N 2.8Å; E812-V889 HydrophobicContact CB-CG1 3.99Å; E812-E890 PolarHBondContact N-O 3.13Å
813	G	83.1	Confident	89.3	Confident	54 Å²	54	59.9 Å²	59.9	56%	0.557	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-7.1	-174.3	0	0	0	0	0	115.4	V862	G813-V862 PolarHBondContact N-O 2.88Å
814	S	88.9	Confident	88.5	Confident	45 Å²	45	58 Å²	58	32%	0.315	32%	0.315	S	S	.	.	S	Bend	trans	-84.7	-164.9	173.1	76.8	0	0	0	0	112.2	V811 E812 E861 V862	V811-S814 VanDerWaalsContact O-CB 3.28Å; V811-S814 WeakPolarHBondContact O-CB 3.36Å; V811-S814 PolarHBondContact O-N 3.05Å; V811-S814 VanDerWaalsContact O-N 3.11Å; V811-S814 PolarHBondContact O-OG 2.87Å; E812-S814 VanDerWaalsContact C-N 3.29Å; E812-S814 PolarHBondContact O-N 3.38Å; S814-E861 WeakPolarHBondContact O-CA 3.4Å; S814-E861 PolarHBondContact O-N 2.72Å; S814-V862 PolarHBondContact O-N 3.23Å
815	A	88.9	Confident	87.1	Confident	64 Å²	64	55.8 Å²	55.8	53%	0.529	30%	0.299	S	S	.	.			trans	-125.7	130.9	179.9	0	0	0	0	0	111	I859	A815-I859 CarbonylContact C-O 3.59Å; A815-I859 VanDerWaalsContact CA-O 3.23Å; A815-I859 WeakPolarHBondContact CA-O 3.41Å; A815-I859 WeakPolarHBondContact CB-O 3.32Å
816	A	90.8	Very high	85.6	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	151.2	176.7	0	0	0	0	0	111.2	V808 V810 I859 V862 L887	V808-A816 HydrophobicContact CG1-CB 4.04Å; V810-A816 HydrophobicContact CG1-CB 4.22Å; V810-A816 HydrophobicContact CG2-CB 4.24Å; A816-I859 HydrophobicContact CB-CB 4.24Å; A816-I859 HydrophobicContact CB-CD1 4.27Å; A816-I859 PolarHBondContact N-O 2.99Å; A816-I859 PolarHBondContact O-N 2.91Å; A816-V862 HydrophobicContact CB-CG2 3.78Å; A816-L887 HydrophobicContact CB-CD1 3.68Å; A816-L887 HydrophobicContact CB-CD2 4.17Å
817	R	94.1	Very high	84.4	Confident	120 Å²	120	54.6 Å²	54.6	45%	0.453	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	124.6	179.1	178.1	175.5	170.7	118.5	8.7	110.7	D819 S856 L857 I858	R817-D819 WeakPolarHBondContact CD-OD2 3.42Å; R817-D819 IonicContact CZ-OD1 2.73Å; R817-D819 VanDerWaalsContact CZ-OD1 3.27Å; R817-D819 IonicContact CZ-OD2 3.57Å; R817-D819 VanDerWaalsContact NE-CG 3.3Å; R817-D819 IonicContact NE-OD1 2.76Å; R817-D819 PolarHBondContact NE-OD1 2.85Å; R817-D819 IonicContact NE-OD2 2.72Å; R817-D819 PolarHBondContact NE-OD2 2.84Å; R817-D819 IonicContact NH2-OD1 3.66Å; R817-D819 PolarHBondContact NH2-OD1 2.85Å; R817-D819 IonicContact NH2-OD2 3.54Å; R817-S856 PolarHBondContact NH2-OG 3.21Å; R817-L857 WeakPolarHBondContact CA-O 3.38Å; R817-I858 HydrophobicContact CG-CG1 4.15Å
818	F	92.3	Very high	83.5	Confident	2 Å²	2	50 Å²	50	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.6	168.3	-64.6	-75.9	0	0	0	109.2	I805 K806 V808 W832 S856 L857 I859 Y870 A885 L887	I805-F818 HydrophobicContact CB-CB 4.39Å; I805-F818 HydrophobicContact CB-CD1 4.35Å; I805-F818 HydrophobicContact CG2-CB 3.96Å; K806-F818 VanDerWaalsContact O-CD1 3.29Å; K806-F818 WeakPolarHBondContact O-CD1 3.35Å; K806-F818 VanDerWaalsContact O-CE1 3.26Å; K806-F818 WeakPolarHBondContact O-CE1 3.43Å; V808-F818 HydrophobicContact CB-CE1 4.04Å; V808-F818 HydrophobicContact CB-CZ 4.27Å; V808-F818 HydrophobicContact CG2-CD1 3.84Å; V808-F818 HydrophobicContact CG2-CE1 3.61Å; V808-F818 HydrophobicContact CG2-CZ 4.23Å; F818-W832 HydrophobicContact CB-CH2 3.77Å; F818-W832 HydrophobicContact CB-CZ3 3.8Å; F818-W832 HydrophobicContact CG-CZ3 4.43Å; F818-S856 CarbonylContact O-C 3.56Å; F818-S856 WeakPolarHBondContact O-CA 3.2Å; F818-L857 HydrophobicContact CB-CB 4.46Å; F818-L857 HydrophobicContact CD2-CD2 4.2Å; F818-L857 PolarHBondContact N-O 2.86Å; F818-L857 PolarHBondContact O-N 3.2Å; F818-I859 HydrophobicContact CE2-CD1 4.11Å; F818-Y870 HydrophobicContact CD2-CG 4.35Å; F818-Y870 HydrophobicContact CE2-CD1 4.15Å; F818-Y870 AromaticContact CE2-CD2 3.69Å; F818-Y870 HydrophobicContact CE2-CD2 3.69Å; F818-Y870 HydrophobicContact CE2-CE2 4.27Å; F818-Y870 AromaticContact CE2-CG 3.64Å; F818-Y870 HydrophobicContact CE2-CG 3.64Å; F818-Y870 AromaticContact CZ-CD2 3.89Å; F818-Y870 HydrophobicContact CZ-CD2 3.89Å; F818-Y870 HydrophobicContact CZ-CG 4.1Å; F818-A885 HydrophobicContact CD1-CB 4.03Å; F818-A885 HydrophobicContact CE1-CB 3.69Å; F818-L887 HydrophobicContact CE2-CB 4.47Å; F818-L887 HydrophobicContact CZ-CB 3.99Å; F818-L887 HydrophobicContact CZ-CD1 4.36Å
819	D	88.6	Confident	83	Confident	73 Å²	73	56 Å²	56	39%	0.39	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.3	178.7	-76.6	-60.8	0	0	0	111.2	R817 S856	R817-D819 WeakPolarHBondContact CD-OD2 3.42Å; R817-D819 IonicContact CZ-OD1 2.73Å; R817-D819 VanDerWaalsContact CZ-OD1 3.27Å; R817-D819 IonicContact CZ-OD2 3.57Å; R817-D819 VanDerWaalsContact NE-CG 3.3Å; R817-D819 IonicContact NE-OD1 2.76Å; R817-D819 PolarHBondContact NE-OD1 2.85Å; R817-D819 IonicContact NE-OD2 2.72Å; R817-D819 PolarHBondContact NE-OD2 2.84Å; R817-D819 IonicContact NH2-OD1 3.66Å; R817-D819 PolarHBondContact NH2-OD1 2.85Å; R817-D819 IonicContact NH2-OD2 3.54Å; D819-S856 WeakPolarHBondContact OD1-CB 3.38Å; D819-S856 PolarHBondContact OD1-OG 2.66Å
820	C	85.8	Confident	82.8	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.034	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	170	172.7	63.4	0	0	0	0	111.5	F801 S803 I805 C855	F801-C820 HydrophobicContact CD1-CB 4.14Å; F801-C820 HydrophobicContact CE1-CB 4.39Å; S803-C820 WeakPolarHBondContact O-CB 3.39Å; S803-C820 VanDerWaalsContact OG-C 3.31Å; S803-C820 WeakPolarHBondContact OG-CA 3.31Å; I805-C820 HydrophobicContact CG2-CB 3.75Å; C820-C855 PolarHBondContact N-O 2.89Å; C820-C855 PolarHBondContact O-N 3.4Å; C820-C855 PolarHBondContact SG-O 2.94Å; C820-C855 VanDerWaalsContact SG-O 3.41Å
821	K	85.9	Confident	82.8	Confident	49 Å²	49	51.9 Å²	51.9	21%	0.213	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.9	175	-167.9	-179.3	-178	74	0	109.5	F801 S802 S803 E852 G853 N854	F801-K821 CarbonylContact C-O 3.54Å; F801-K821 WeakPolarHBondContact CA-O 3.29Å; S802-K821 PolarHBondContact N-O 2.83Å; S803-K821 PolarHBondContact N-O 3.36Å; S803-K821 PolarHBondContact O-N 2.97Å; S803-K821 WeakPolarHBondContact OG-CB 3.26Å; S803-K821 PolarHBondContact OG-N 3.37Å; K821-E852 WeakPolarHBondContact CE-O 3.33Å; K821-E852 PolarHBondContact NZ-O 2.7Å; K821-G853 CarbonylContact C-O 3.47Å; K821-G853 WeakPolarHBondContact CA-O 3.27Å; K821-N854 PolarHBondContact NZ-OD1 3.42Å
822	I	83.9	Confident	83	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.2	-169	-55.8	173.9	0	0	0	108.4	T800 F801 P828 V830 Y849 G853 C855 V872 A874	T800-I822 WeakPolarHBondContact O-CA 3.41Å; F801-I822 HydrophobicContact CD1-CG1 3.9Å; F801-I822 HydrophobicContact CE1-CD1 3.98Å; F801-I822 HydrophobicContact CE1-CG1 3.62Å; F801-I822 HydrophobicContact CZ-CG1 4.41Å; I822-P828 HydrophobicContact CG2-CG 3.61Å; I822-V830 HydrophobicContact CD1-CB 4.4Å; I822-V830 HydrophobicContact CD1-CG1 3.79Å; I822-V830 HydrophobicContact CD1-CG2 3.63Å; I822-Y849 HydrophobicContact CB-CE2 4.47Å; I822-Y849 HydrophobicContact CD1-CE2 4.27Å; I822-G853 PolarHBondContact N-O 2.95Å; I822-C855 HydrophobicContact CD1-CB 3.85Å; I822-C855 HydrophobicContact CG1-CB 4.46Å; I822-V872 HydrophobicContact CD1-CG2 4.44Å; I822-A874 HydrophobicContact CD1-CB 4.37Å; I822-A874 HydrophobicContact CG2-CB 3.76Å
823	E	74.9	Confident	83.2	Confident	96 Å²	96	47.9 Å²	47.9	45%	0.449	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.1	-179	-74	173.2	-159.2	0	0	110.5	P799 T800 S802	P799-E823 CarbonylContact C-O 3.59Å; P799-E823 WeakPolarHBondContact CA-O 3.28Å; T800-E823 PolarHBondContact N-O 2.89Å; T800-E823 PolarHBondContact O-N 3.04Å; T800-E823 PolarHBondContact OG1-O 3.02Å; S802-E823 VanDerWaalsContact CB-CD 3.43Å; S802-E823 WeakPolarHBondContact CB-OE1 3.34Å; S802-E823 VanDerWaalsContact OG-CD 3.23Å; S802-E823 PolarHBondContact OG-OE1 2.65Å
824	G	68.1	Low	83.8	Confident	15 Å²	15	47.3 Å²	47.3	16%	0.155	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.7	161.4	177.1	0	0	0	0	0	111.2
825	Y	62.1	Low	83.9	Confident	30 Å²	30	49.6 Å²	49.6	12%	0.118	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	130.7	176.5	-173.4	-103.9	0	0	0	111.8	E640 A641 K794 E796 S797 L878	E640-Y825 WeakPolarHBondContact CA-OH 3.23Å; A641-Y825 HydrophobicContact CB-CD1 4.35Å; A641-Y825 HydrophobicContact CB-CE1 3.6Å; A641-Y825 PolarHBondContact N-OH 3.42Å; K794-Y825 HydrophobicContact CB-CD1 3.9Å; K794-Y825 HydrophobicContact CB-CD2 3.9Å; K794-Y825 HydrophobicContact CB-CE1 4.35Å; K794-Y825 HydrophobicContact CB-CE2 4.33Å; K794-Y825 HydrophobicContact CB-CG 3.65Å; K794-Y825 HydrophobicContact CD-CD2 3.32Å; K794-Y825 HydrophobicContact CD-CE2 3.76Å; K794-Y825 HydrophobicContact CD-CG 3.91Å; K794-Y825 HydrophobicContact CG-CD2 4.27Å; K794-Y825 HydrophobicContact CG-CG 4.43Å; K794-Y825 WeakPolarHBondContact O-CD1 3.5Å; E796-Y825 CarbonylContact C-O 3.48Å; E796-Y825 WeakPolarHBondContact CA-O 3.29Å; E796-Y825 HydrophobicContact CG-CD1 4.41Å; S797-Y825 PolarHBondContact N-O 2.9Å; S797-Y825 CarbonylContact O-C 3.57Å; S797-Y825 PolarHBondContact O-N 3.11Å; S797-Y825 PolarHBondContact OG-N 2.93Å; S797-Y825 VanDerWaalsContact OG-N 3.12Å; Y825-L878 WeakPolarHBondContact O-CD1 3.46Å
826	P	62.9	Low	83.9	Confident	42 Å²	42	53 Å²	53	27%	0.273	27%	0.266	S	S	.	.	S	Bend	cis	-56.4	151.8	1.3	-26.2	36.3	0	0	0	113.9	N876	P826-N876 VanDerWaalsContact O-CB 3.32Å; P826-N876 WeakPolarHBondContact O-CB 3.42Å; P826-N876 PolarHBondContact O-ND2 2.87Å
827	D	67.2	Low	83.9	Confident	96 Å²	96	59.9 Å²	59.9	51%	0.513	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-59.9	129	-173.4	-58.1	-42.1	0	0	0	109.7	K794	K794-D827 VanDerWaalsContact NZ-CG 3.33Å; K794-D827 IonicContact NZ-OD1 3.83Å; K794-D827 PolarHBondContact NZ-OD1 2.84Å; K794-D827 IonicContact NZ-OD2 3.33Å; K794-D827 PolarHBondContact NZ-OD2 2.79Å
828	P	76.2	Confident	83.7	Confident	9 Å²	9	58 Å²	58	6%	0.058	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-80.8	148.5	-164	28.7	-34.3	0	0	0	114.4	P799 I822 A874 V875 N876	P799-P828 HydrophobicContact CB-CB 4.25Å; P799-P828 HydrophobicContact CB-CG 4.49Å; P799-P828 HydrophobicContact CG-CB 3.99Å; I822-P828 HydrophobicContact CG2-CG 3.61Å; P828-A874 HydrophobicContact CB-CB 4.16Å; P828-A874 HydrophobicContact CG-CB 4.33Å; P828-V875 CarbonylContact C-O 3.57Å; P828-V875 VanDerWaalsContact CA-O 3.24Å; P828-V875 WeakPolarHBondContact CA-O 3.36Å; P828-V875 WeakPolarHBondContact CB-O 3.34Å; P828-N876 HydrophobicContact CB-CB 4.33Å
829	E	83.3	Confident	83.7	Confident	153 Å²	153	59 Å²	59	72%	0.715	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	131	162.2	-67	-175	169.7	0	0	109.3	A874 V875	E829-A874 CarbonylContact O-C 3.56Å; E829-A874 WeakPolarHBondContact O-CA 3.35Å; E829-V875 PolarHBondContact N-O 2.93Å; E829-V875 PolarHBondContact O-N 3.2Å
830	V	89.1	Confident	83.5	Confident	36 Å²	36	63.5 Å²	63.5	22%	0.218	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.3	-176.7	-173.1	0	0	0	0	110.3	I822 Y849 V872 K873	I822-V830 HydrophobicContact CD1-CB 4.4Å; I822-V830 HydrophobicContact CD1-CG1 3.79Å; I822-V830 HydrophobicContact CD1-CG2 3.63Å; V830-Y849 HydrophobicContact CG2-CD1 4.17Å; V830-Y849 HydrophobicContact CG2-CE1 3.73Å; V830-Y849 HydrophobicContact CG2-CE2 4.09Å; V830-V872 HydrophobicContact CG1-CG2 3.66Å; V830-K873 CarbonylContact C-O 3.55Å; V830-K873 WeakPolarHBondContact CA-O 3.37Å
831	V	91.6	Very high	83.3	Confident	56 Å²	56	70.1 Å²	70.1	34%	0.339	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.5	178.5	-175	0	0	0	0	109.7	Y833 P838 K873	V831-Y833 HydrophobicContact CB-CE2 3.83Å; V831-Y833 HydrophobicContact CG1-CD2 4.18Å; V831-Y833 HydrophobicContact CG1-CE2 3.54Å; V831-P838 HydrophobicContact CG1-CB 4.18Å; V831-K873 PolarHBondContact N-O 3.06Å; V831-K873 PolarHBondContact O-N 2.92Å
832	W	95.1	Very high	83.4	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.008	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	150	173.3	-69.2	83.4	0	0	0	111.2	I805 F818 P838 I839 I847 C855 L857 M871 V872	I805-W832 HydrophobicContact CD1-CZ3 4.18Å; I805-W832 HydrophobicContact CG2-CH2 3.63Å; I805-W832 HydrophobicContact CG2-CZ3 3.97Å; F818-W832 HydrophobicContact CB-CH2 3.77Å; F818-W832 HydrophobicContact CB-CZ3 3.8Å; F818-W832 HydrophobicContact CG-CZ3 4.43Å; W832-P838 WeakPolarHBondContact O-CA 3.35Å; W832-I839 HydrophobicContact CB-CB 4.28Å; W832-I839 HydrophobicContact CB-CD1 4.13Å; W832-I839 PolarHBondContact O-N 2.99Å; W832-I847 HydrophobicContact CB-CD1 4.4Å; W832-I847 HydrophobicContact CG-CD1 4.46Å; W832-C855 PolarHBondContact NE1-SG 2.94Å; W832-C855 VanDerWaalsContact NE1-SG 3.37Å; W832-L857 HydrophobicContact CD2-CB 3.72Å; W832-L857 HydrophobicContact CD2-CD2 4.1Å; W832-L857 HydrophobicContact CD2-CG 4.42Å; W832-L857 HydrophobicContact CE3-CB 3.64Å; W832-L857 HydrophobicContact CE3-CD2 3.58Å; W832-L857 HydrophobicContact CE3-CG 4.22Å; W832-L857 HydrophobicContact CG-CB 4.44Å; W832-L857 HydrophobicContact CH2-CB 3.68Å; W832-L857 HydrophobicContact CZ2-CB 3.79Å; W832-L857 HydrophobicContact CZ3-CB 3.61Å; W832-L857 HydrophobicContact CZ3-CD2 4.03Å; W832-L857 HydrophobicContact CZ3-CG 4.48Å; W832-M871 CarbonylContact C-O 3.48Å; W832-M871 WeakPolarHBondContact CA-O 3.37Å; W832-V872 HydrophobicContact CD2-CB 3.89Å; W832-V872 HydrophobicContact CD2-CG2 4.08Å; W832-V872 HydrophobicContact CE3-CB 3.84Å; W832-V872 HydrophobicContact CH2-CB 4.17Å; W832-V872 HydrophobicContact CH2-CG1 4.5Å; W832-V872 HydrophobicContact CZ2-CB 4.17Å; W832-V872 HydrophobicContact CZ2-CG2 4.1Å; W832-V872 HydrophobicContact CZ3-CB 3.99Å; W832-V872 HydrophobicContact CZ3-CG1 4.48Å
833	Y	94.8	Very high	83.2	Confident	53 Å²	53	82.1 Å²	82.1	21%	0.208	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.6	-178.3	-61.7	-105	0	0	0	110.6	V831 D836 Q837 P838 Y870 M871 K873	V831-Y833 HydrophobicContact CB-CE2 3.83Å; V831-Y833 HydrophobicContact CG1-CD2 4.18Å; V831-Y833 HydrophobicContact CG1-CE2 3.54Å; Y833-D836 WeakPolarHBondContact CD1-O 3.48Å; Y833-Q837 CarbonylContact C-O 3.48Å; Y833-Q837 WeakPolarHBondContact CA-O 3.25Å; Y833-P838 HydrophobicContact CD1-CB 4.05Å; Y833-P838 HydrophobicContact CE1-CB 3.88Å; Y833-P838 HydrophobicContact CE1-CG 4.48Å; Y833-Y870 WeakPolarHBondContact O-CA 3.48Å; Y833-M871 HydrophobicContact CD1-CE 4.33Å; Y833-M871 HydrophobicContact CD2-CE 3.77Å; Y833-M871 HydrophobicContact CE2-CE 4.26Å; Y833-M871 HydrophobicContact CG-CE 3.83Å; Y833-M871 PolarHBondContact N-O 3.38Å; Y833-M871 PolarHBondContact O-N 2.82Å; Y833-K873 HydrophobicContact CE2-CB 3.92Å
834	K	95.6	Very high	83.9	Confident	41 Å²	41	80.3 Å²	80.3	18%	0.178	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	120.2	168.2	-176.5	-175.6	-177.6	-175.3	0	106.8	D836 Q837 I839 F845 D865 D866 A868 K869 Y870	K834-D836 PolarHBondContact O-N 2.87Å; K834-Q837 PolarHBondContact N-O 2.92Å; K834-Q837 PolarHBondContact O-N 3.25Å; K834-I839 HydrophobicContact CB-CD1 4.01Å; K834-I839 HydrophobicContact CB-CG1 4.02Å; K834-F845 HydrophobicContact CD-CZ 4.18Å; K834-D865 WeakPolarHBondContact CE-O 3.33Å; K834-D865 PolarHBondContact NZ-O 3.18Å; K834-D866 IonicContact NZ-OD1 2.76Å; K834-D866 PolarHBondContact NZ-OD1 2.87Å; K834-A868 HydrophobicContact CD-CB 4.16Å; K834-A868 VanDerWaalsContact CE-CB 3.43Å; K834-A868 HydrophobicContact CG-CB 3.64Å; K834-K869 WeakPolarHBondContact CA-O 3.44Å; K834-Y870 HydrophobicContact CB-CD1 4.33Å; K834-Y870 HydrophobicContact CB-CE1 3.98Å; K834-Y870 HydrophobicContact CD-CE1 4.17Å; K834-Y870 WeakPolarHBondContact CD-OH 3.46Å; K834-Y870 VanDerWaalsContact CE-OH 3.31Å; K834-Y870 WeakPolarHBondContact CE-OH 3.3Å; K834-Y870 HydrophobicContact CG-CE1 3.99Å; K834-Y870 HydrophobicContact CG-CE2 4.31Å
835	D	91	Very high	84.9	Confident	93 Å²	93	81 Å²	81	50%	0.497	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	55.5	-175.3	-55.2	-36.6	0	0	0	113.3	Q837 A868 K869	D835-Q837 PolarHBondContact O-N 3.44Å; D835-A868 WeakPolarHBondContact OD2-CB 3.44Å; D835-K869 PolarHBondContact N-O 3.35Å; D835-K869 PolarHBondContact OD1-N 2.69Å
836	D	88.8	Confident	85.9	Confident	135 Å²	135	83.5 Å²	83.5	72%	0.722	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	4.1	-175.8	-65.8	-37	0	0	0	116.4	Y833 K834	Y833-D836 WeakPolarHBondContact CD1-O 3.48Å; K834-D836 PolarHBondContact O-N 2.87Å
837	Q	90.4	Very high	87	Confident	146 Å²	146	83.9 Å²	83.9	68%	0.682	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.7	173.1	-61.8	-167.8	49	0	0	111.7	Y833 K834 D835 I839	Y833-Q837 CarbonylContact C-O 3.48Å; Y833-Q837 WeakPolarHBondContact CA-O 3.25Å; K834-Q837 PolarHBondContact N-O 2.92Å; K834-Q837 PolarHBondContact O-N 3.25Å; D835-Q837 PolarHBondContact O-N 3.44Å; Q837-I839 PolarHBondContact O-N 2.85Å
838	P	90.8	Very high	87.5	Confident	82 Å²	82	83.7 Å²	83.7	53%	0.532	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	124.2	-176.8	27.6	-34.1	0	0	0	111.6	V831 W832 Y833	V831-P838 HydrophobicContact CG1-CB 4.18Å; W832-P838 WeakPolarHBondContact O-CA 3.35Å; Y833-P838 HydrophobicContact CD1-CB 4.05Å; Y833-P838 HydrophobicContact CE1-CB 3.88Å; Y833-P838 HydrophobicContact CE1-CG 4.48Å
839	I	91.6	Very high	87.6	Confident	22 Å²	22	87.7 Å²	87.7	11%	0.113	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-69.9	142.8	176.1	-59.4	177.3	0	0	0	109	W832 K834 Q837 F845 I847 L857 Y870	W832-I839 HydrophobicContact CB-CB 4.28Å; W832-I839 HydrophobicContact CB-CD1 4.13Å; W832-I839 PolarHBondContact O-N 2.99Å; K834-I839 HydrophobicContact CB-CD1 4.01Å; K834-I839 HydrophobicContact CB-CG1 4.02Å; Q837-I839 PolarHBondContact O-N 2.85Å; I839-F845 HydrophobicContact CG2-CB 3.64Å; I839-F845 HydrophobicContact CG2-CD1 4.26Å; I839-F845 HydrophobicContact CG2-CD2 3.88Å; I839-F845 HydrophobicContact CG2-CG 3.66Å; I839-I847 HydrophobicContact CG2-CD1 4.38Å; I839-L857 HydrophobicContact CD1-CD1 4.45Å; I839-L857 HydrophobicContact CD1-CD2 3.74Å; I839-Y870 HydrophobicContact CD1-CD1 3.79Å; I839-Y870 HydrophobicContact CD1-CE1 3.71Å
840	K	84.6	Confident	86.8	Confident	168 Å²	168	83.7 Å²	83.7	73%	0.73	40%	0.404	S	S	*	.			trans	-114	145.3	167.6	-66.4	-176.4	-179.9	-179.7	0	109.3	T842	K840-T842 PolarHBondContact O-N 2.85Å
841	E	80.8	Confident	85.1	Confident	144 Å²	144	91 Å²	91	67%	0.673	44%	0.436	S	S	*	.			trans	-60	132.1	174.6	-160.9	-170	170.8	0	0	110.7	F845	E841-F845 CarbonylContact C-O 3.53Å; E841-F845 WeakPolarHBondContact CA-O 3.37Å
842	T	88.7	Confident	83.6	Confident	72 Å²	72	95.1 Å²	95.1	44%	0.442	45%	0.452	S	S	.	.			trans	-150.2	-174.2	-176.7	55.2	0	0	0	0	109	K840 H844 F845	K840-T842 PolarHBondContact O-N 2.85Å; T842-H844 VanDerWaalsContact C-N 3.26Å; T842-H844 PolarHBondContact OG1-N 2.88Å; T842-F845 PolarHBondContact N-O 2.95Å; T842-F845 VanDerWaalsContact O-O 3.05Å; T842-F845 PolarHBondContact OG1-N 2.89Å
843	R	79.6	Confident	82.1	Confident	234 Å²	234	95.4 Å²	95.4	88%	0.883	46%	0.455	S	S	*	.	S	Bend	trans	-69.4	-28.2	169.1	-65	-176.1	-178	178.9	0.4	112.7	Q846	R843-Q846 PolarHBondContact O-NE2 3.2Å
844	H	89.8	Confident	81.3	Confident	57 Å²	57	95.4 Å²	95.4	26%	0.264	46%	0.459	S	S	.	.	S	Bend	trans	-77.4	-55.6	179.6	-157.5	71.1	0	0	0	110.7	T842 I859 S860 D866	T842-H844 VanDerWaalsContact C-N 3.26Å; T842-H844 PolarHBondContact OG1-N 2.88Å; H844-I859 WeakPolarHBondContact O-CA 3.15Å; H844-S860 PolarHBondContact CE1-O 2.93Å; H844-S860 PolarHBondContact ND1-O 2.86Å; H844-S860 VanDerWaalsContact ND1-O 3.13Å; H844-S860 PolarHBondContact O-N 2.63Å; H844-D866 IonicContact CD2-OD1 3.93Å; H844-D866 IonicContact CD2-OD2 3.97Å; H844-D866 IonicContact CE1-OD2 3.51Å; H844-D866 IonicContact NE2-OD1 3.43Å; H844-D866 PolarHBondContact NE2-OD1 3.43Å; H844-D866 IonicContact NE2-OD2 2.8Å; H844-D866 PolarHBondContact NE2-OD2 2.76Å
845	F	88.9	Confident	80.9	Confident	31 Å²	31	93.5 Å²	93.5	14%	0.136	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	108.2	179	-60.5	-62.8	0	0	0	111.1	K834 I839 E841 T842 L857 I858 I859 Y870	K834-F845 HydrophobicContact CD-CZ 4.18Å; I839-F845 HydrophobicContact CG2-CB 3.64Å; I839-F845 HydrophobicContact CG2-CD1 4.26Å; I839-F845 HydrophobicContact CG2-CD2 3.88Å; I839-F845 HydrophobicContact CG2-CG 3.66Å; E841-F845 CarbonylContact C-O 3.53Å; E841-F845 WeakPolarHBondContact CA-O 3.37Å; T842-F845 PolarHBondContact N-O 2.95Å; T842-F845 VanDerWaalsContact O-O 3.05Å; T842-F845 PolarHBondContact OG1-N 2.89Å; F845-L857 HydrophobicContact CB-CD1 4.26Å; F845-L857 HydrophobicContact CD1-CD1 4.27Å; F845-I858 WeakPolarHBondContact CA-O 3.44Å; F845-I859 HydrophobicContact CD1-CG1 3.93Å; F845-I859 HydrophobicContact CD1-CG2 4.24Å; F845-I859 HydrophobicContact CE1-CD1 4.17Å; F845-I859 HydrophobicContact CE1-CG1 3.97Å; F845-I859 HydrophobicContact CE1-CG2 3.9Å; F845-Y870 HydrophobicContact CE1-CE1 4.14Å
846	Q	83.7	Confident	80.9	Confident	82 Å²	82	89.5 Å²	89.5	38%	0.383	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.5	173.4	-65.2	164.9	41.7	0	0	108.9	R843 I858 S860	R843-Q846 PolarHBondContact O-NE2 3.2Å; Q846-I858 HydrophobicContact CB-CB 4.33Å; Q846-I858 PolarHBondContact N-O 2.81Å; Q846-I858 PolarHBondContact O-N 3.48Å; Q846-S860 PolarHBondContact NE2-OG 2.98Å
847	I	85.6	Confident	81.1	Confident	50 Å²	50	83 Å²	83	26%	0.256	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	113.8	-175	-59.9	172.2	0	0	0	109.1	W832 I839 S856 L857	W832-I847 HydrophobicContact CB-CD1 4.4Å; W832-I847 HydrophobicContact CG-CD1 4.46Å; I839-I847 HydrophobicContact CG2-CD1 4.38Å; I847-S856 WeakPolarHBondContact CA-O 3.35Å; I847-L857 HydrophobicContact CD1-CD1 4.46Å; I847-L857 HydrophobicContact CG1-CD1 3.79Å
848	D	78	Confident	81.3	Confident	91 Å²	91	77.7 Å²	77.7	49%	0.487	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.9	172	-74.4	-49.4	0	0	0	110.1	C855 S856	D848-C855 WeakPolarHBondContact O-CA 3.26Å; D848-C855 PolarHBondContact O-SG 2.87Å; D848-S856 PolarHBondContact N-O 2.87Å; D848-S856 PolarHBondContact O-N 3.37Å
849	Y	78.9	Confident	81.4	Confident	94 Å²	94	73.8 Å²	73.8	37%	0.369	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	130.8	167.7	-176	-136	0	0	0	109.5	I822 V830 N854 C855	I822-Y849 HydrophobicContact CB-CE2 4.47Å; I822-Y849 HydrophobicContact CD1-CE2 4.27Å; V830-Y849 HydrophobicContact CG2-CD1 4.17Å; V830-Y849 HydrophobicContact CG2-CE1 3.73Å; V830-Y849 HydrophobicContact CG2-CE2 4.09Å; Y849-N854 WeakPolarHBondContact CA-O 3.37Å; Y849-N854 WeakPolarHBondContact CD2-O 3.48Å; Y849-C855 HydrophobicContact CD2-CB 3.65Å; Y849-C855 HydrophobicContact CE2-CB 4.26Å; Y849-C855 HydrophobicContact CG-CB 4.49Å
850	D	65	Low	81.4	Confident	69 Å²	69	74.2 Å²	74.2	37%	0.369	35%	0.35	S	S	.	.			trans	-118.5	168.9	-175.6	72	23	0	0	0	114.6	E852 G853 N854	D850-E852 PolarHBondContact O-N 2.97Å; D850-E852 WeakPolarHBondContact OD1-CA 3.11Å; D850-E852 WeakPolarHBondContact OD1-CB 3.49Å; D850-E852 PolarHBondContact OD1-N 3.34Å; D850-G853 PolarHBondContact O-N 3.1Å; D850-G853 PolarHBondContact OD1-N 3.13Å; D850-N854 PolarHBondContact N-O 2.87Å; D850-N854 VanDerWaalsContact N-O 3.1Å; D850-N854 WeakPolarHBondContact OD1-CB 3.45Å; D850-N854 PolarHBondContact OD1-N 2.9Å; D850-N854 PolarHBondContact OD1-ND2 3.01Å; D850-N854 WeakPolarHBondContact OD2-CB 3.32Å; D850-N854 PolarHBondContact OD2-ND2 2.87Å
851	E	53.1	Low	81.6	Confident	190 Å²	190	73.9 Å²	73.9	89%	0.888	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.3	-179.9	-63.5	-178.1	-168.7	0	0	113.6	G853	E851-G853 VanDerWaalsContact C-N 3.33Å
852	E	59.8	Low	82.2	Confident	142 Å²	142	67.1 Å²	67.1	66%	0.664	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.2	171.8	-60	-172	177.8	0	0	112.3	K821 D850 N854	K821-E852 WeakPolarHBondContact CE-O 3.33Å; K821-E852 PolarHBondContact NZ-O 2.7Å; D850-E852 PolarHBondContact O-N 2.97Å; D850-E852 WeakPolarHBondContact OD1-CA 3.11Å; D850-E852 WeakPolarHBondContact OD1-CB 3.49Å; D850-E852 PolarHBondContact OD1-N 3.34Å; E852-N854 PolarHBondContact OE2-ND2 2.82Å
853	G	64.2	Low	82.3	Confident	7 Å²	7	65.2 Å²	65.2	7%	0.072	31%	0.31	C	S	.	.			trans	83.2	10.1	-179.2	0	0	0	0	0	114.7	K821 I822 D850 E851	K821-G853 CarbonylContact C-O 3.47Å; K821-G853 WeakPolarHBondContact CA-O 3.27Å; I822-G853 PolarHBondContact N-O 2.95Å; D850-G853 PolarHBondContact O-N 3.1Å; D850-G853 PolarHBondContact OD1-N 3.13Å; E851-G853 VanDerWaalsContact C-N 3.33Å
854	N	78.9	Confident	82.6	Confident	54 Å²	54	56.1 Å²	56.1	29%	0.289	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.3	173.4	-47.7	-55.9	0	0	0	108.6	K821 Y849 D850 E852	K821-N854 PolarHBondContact NZ-OD1 3.42Å; Y849-N854 WeakPolarHBondContact CA-O 3.37Å; Y849-N854 WeakPolarHBondContact CD2-O 3.48Å; D850-N854 PolarHBondContact N-O 2.87Å; D850-N854 VanDerWaalsContact N-O 3.1Å; D850-N854 WeakPolarHBondContact OD1-CB 3.45Å; D850-N854 PolarHBondContact OD1-N 2.9Å; D850-N854 PolarHBondContact OD1-ND2 3.01Å; D850-N854 WeakPolarHBondContact OD2-CB 3.32Å; D850-N854 PolarHBondContact OD2-ND2 2.87Å; E852-N854 PolarHBondContact OE2-ND2 2.82Å
855	C	86.3	Confident	82.6	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.9	-178.8	-169.8	0	0	0	0	111.9	C820 I822 W832 D848 Y849	C820-C855 PolarHBondContact N-O 2.89Å; C820-C855 PolarHBondContact O-N 3.4Å; C820-C855 PolarHBondContact SG-O 2.94Å; C820-C855 VanDerWaalsContact SG-O 3.41Å; I822-C855 HydrophobicContact CD1-CB 3.85Å; I822-C855 HydrophobicContact CG1-CB 4.46Å; W832-C855 PolarHBondContact NE1-SG 2.94Å; W832-C855 VanDerWaalsContact NE1-SG 3.37Å; D848-C855 WeakPolarHBondContact O-CA 3.26Å; D848-C855 PolarHBondContact O-SG 2.87Å; Y849-C855 HydrophobicContact CD2-CB 3.65Å; Y849-C855 HydrophobicContact CE2-CB 4.26Å; Y849-C855 HydrophobicContact CG-CB 4.49Å
856	S	91.1	Very high	82.8	Confident	8 Å²	8	59 Å²	59	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.5	-176.4	-48.4	0	0	0	0	112	R817 F818 D819 I847 D848	R817-S856 PolarHBondContact NH2-OG 3.21Å; F818-S856 CarbonylContact O-C 3.56Å; F818-S856 WeakPolarHBondContact O-CA 3.2Å; D819-S856 WeakPolarHBondContact OD1-CB 3.38Å; D819-S856 PolarHBondContact OD1-OG 2.66Å; I847-S856 WeakPolarHBondContact CA-O 3.35Å; D848-S856 PolarHBondContact N-O 2.87Å; D848-S856 PolarHBondContact O-N 3.37Å
857	L	93.9	Very high	83.3	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.9	165.1	172.4	67.3	0	0	0	108.2	R817 F818 W832 I839 F845 I847 I859 Y870	R817-L857 WeakPolarHBondContact CA-O 3.38Å; F818-L857 HydrophobicContact CB-CB 4.46Å; F818-L857 HydrophobicContact CD2-CD2 4.2Å; F818-L857 PolarHBondContact N-O 2.86Å; F818-L857 PolarHBondContact O-N 3.2Å; W832-L857 HydrophobicContact CD2-CB 3.72Å; W832-L857 HydrophobicContact CD2-CD2 4.1Å; W832-L857 HydrophobicContact CD2-CG 4.42Å; W832-L857 HydrophobicContact CE3-CB 3.64Å; W832-L857 HydrophobicContact CE3-CD2 3.58Å; W832-L857 HydrophobicContact CE3-CG 4.22Å; W832-L857 HydrophobicContact CG-CB 4.44Å; W832-L857 HydrophobicContact CH2-CB 3.68Å; W832-L857 HydrophobicContact CZ2-CB 3.79Å; W832-L857 HydrophobicContact CZ3-CB 3.61Å; W832-L857 HydrophobicContact CZ3-CD2 4.03Å; W832-L857 HydrophobicContact CZ3-CG 4.48Å; I839-L857 HydrophobicContact CD1-CD1 4.45Å; I839-L857 HydrophobicContact CD1-CD2 3.74Å; F845-L857 HydrophobicContact CB-CD1 4.26Å; F845-L857 HydrophobicContact CD1-CD1 4.27Å; I847-L857 HydrophobicContact CD1-CD1 4.46Å; I847-L857 HydrophobicContact CG1-CD1 3.79Å; L857-I859 HydrophobicContact CG-CG1 4.4Å; L857-Y870 HydrophobicContact CD2-CD1 3.52Å; L857-Y870 HydrophobicContact CD2-CE1 3.86Å
858	I	94	Very high	83.8	Confident	34 Å²	34	57.1 Å²	57.1	17%	0.174	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131	178.6	-57.3	170.1	0	0	0	108.4	R817 F845 Q846	R817-I858 HydrophobicContact CG-CG1 4.15Å; F845-I858 WeakPolarHBondContact CA-O 3.44Å; Q846-I858 HydrophobicContact CB-CB 4.33Å; Q846-I858 PolarHBondContact N-O 2.81Å; Q846-I858 PolarHBondContact O-N 3.48Å
859	I	93.8	Very high	84.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.1	-180	-47.2	171.9	0	0	0	107.2	A815 A816 F818 H844 F845 L857 V862 Y870 L887	A815-I859 CarbonylContact C-O 3.59Å; A815-I859 VanDerWaalsContact CA-O 3.23Å; A815-I859 WeakPolarHBondContact CA-O 3.41Å; A815-I859 WeakPolarHBondContact CB-O 3.32Å; A816-I859 HydrophobicContact CB-CB 4.24Å; A816-I859 HydrophobicContact CB-CD1 4.27Å; A816-I859 PolarHBondContact N-O 2.99Å; A816-I859 PolarHBondContact O-N 2.91Å; F818-I859 HydrophobicContact CE2-CD1 4.11Å; H844-I859 WeakPolarHBondContact O-CA 3.15Å; F845-I859 HydrophobicContact CD1-CG1 3.93Å; F845-I859 HydrophobicContact CD1-CG2 4.24Å; F845-I859 HydrophobicContact CE1-CD1 4.17Å; F845-I859 HydrophobicContact CE1-CG1 3.97Å; F845-I859 HydrophobicContact CE1-CG2 3.9Å; L857-I859 HydrophobicContact CG-CG1 4.4Å; I859-V862 HydrophobicContact CB-CG2 4.07Å; I859-V862 HydrophobicContact CG2-CG2 3.87Å; I859-Y870 HydrophobicContact CD1-CE1 3.8Å; I859-Y870 HydrophobicContact CD1-CE2 4.22Å; I859-L887 HydrophobicContact CD1-CD2 3.61Å
860	S	90.1	Very high	85.5	Confident	31 Å²	31	52.3 Å²	52.3	22%	0.217	28%	0.278	C	S	.	.	S	Bend	trans	-94.2	141.6	-178.6	-54.9	0	0	0	0	110.7	H844 Q846 V862	H844-S860 PolarHBondContact CE1-O 2.93Å; H844-S860 PolarHBondContact ND1-O 2.86Å; H844-S860 VanDerWaalsContact ND1-O 3.13Å; H844-S860 PolarHBondContact O-N 2.63Å; Q846-S860 PolarHBondContact NE2-OG 2.98Å; S860-V862 PolarHBondContact O-N 3.35Å
861	E	89.6	Confident	86.9	Confident	161 Å²	161	50.5 Å²	50.5	75%	0.752	27%	0.268	S	S	*	.	S	Bend	trans	52.7	53	176.9	-62.7	174.3	-152.2	0	0	112	S814 S863	S814-E861 WeakPolarHBondContact O-CA 3.4Å; S814-E861 PolarHBondContact O-N 2.72Å; E861-S863 PolarHBondContact O-N 3Å
862	V	92.7	Very high	89	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.226	C	C	.	.			trans	-53.3	130.6	-175.7	175	0	0	0	0	111.1	V810 G813 S814 A816 I859 S860 D866 L887 V889	V810-V862 HydrophobicContact CG2-CG1 3.96Å; G813-V862 PolarHBondContact N-O 2.88Å; S814-V862 PolarHBondContact O-N 3.23Å; A816-V862 HydrophobicContact CB-CG2 3.78Å; I859-V862 HydrophobicContact CB-CG2 4.07Å; I859-V862 HydrophobicContact CG2-CG2 3.87Å; S860-V862 PolarHBondContact O-N 3.35Å; V862-D866 HydrophobicContact CG1-CB 4.12Å; V862-L887 HydrophobicContact CG1-CD2 4.32Å; V862-V889 HydrophobicContact CG1-CG1 4.18Å; V862-V889 HydrophobicContact CG1-CG2 3.63Å
863	S	91.6	Very high	90.5	Very high	33 Å²	33	36.7 Å²	36.7	23%	0.231	20%	0.203	C	C	.	.			trans	-115.9	166.3	-177.1	67	0	0	0	0	112.1	E861 D865 D866	E861-S863 PolarHBondContact O-N 3Å; S863-D865 PolarHBondContact O-N 2.96Å; S863-D865 VanDerWaalsContact O-N 3.13Å; S863-D865 PolarHBondContact OG-N 2.73Å; S863-D866 PolarHBondContact N-OD2 2.83Å; S863-D866 WeakPolarHBondContact O-CA 3.37Å; S863-D866 WeakPolarHBondContact O-CB 3.38Å; S863-D866 PolarHBondContact O-N 2.9Å; S863-D866 PolarHBondContact OG-OD2 2.76Å
864	G	86	Confident	91.8	Very high	42 Å²	42	36.4 Å²	36.4	43%	0.433	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-57.5	-19.9	169.2	0	0	0	0	0	115	E812 D866	E812-G864 PolarHBondContact OE1-N 2.8Å; G864-D866 PolarHBondContact O-N 3.42Å
865	D	89.9	Confident	92	Very high	145 Å²	145	36.1 Å²	36.1	78%	0.775	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-74.7	-8.2	171.1	-82.6	-20.9	0	0	0	112.6	K834 S863	K834-D865 WeakPolarHBondContact CE-O 3.33Å; K834-D865 PolarHBondContact NZ-O 3.18Å; S863-D865 PolarHBondContact O-N 2.96Å; S863-D865 VanDerWaalsContact O-N 3.13Å; S863-D865 PolarHBondContact OG-N 2.73Å
866	D	93.1	Very high	91.6	Very high	4 Å²	4	37 Å²	37	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-97.8	-9.2	179.9	-64.9	-60.5	0	0	0	115.5	K834 H844 V862 S863 G864 A868 Y870 L887	K834-D866 IonicContact NZ-OD1 2.76Å; K834-D866 PolarHBondContact NZ-OD1 2.87Å; H844-D866 IonicContact CD2-OD1 3.93Å; H844-D866 IonicContact CD2-OD2 3.97Å; H844-D866 IonicContact CE1-OD2 3.51Å; H844-D866 IonicContact NE2-OD1 3.43Å; H844-D866 PolarHBondContact NE2-OD1 3.43Å; H844-D866 IonicContact NE2-OD2 2.8Å; H844-D866 PolarHBondContact NE2-OD2 2.76Å; V862-D866 HydrophobicContact CG1-CB 4.12Å; S863-D866 PolarHBondContact N-OD2 2.83Å; S863-D866 WeakPolarHBondContact O-CA 3.37Å; S863-D866 WeakPolarHBondContact O-CB 3.38Å; S863-D866 PolarHBondContact O-N 2.9Å; S863-D866 PolarHBondContact OG-OD2 2.76Å; G864-D866 PolarHBondContact O-N 3.42Å; D866-A868 WeakPolarHBondContact O-CB 3.44Å; D866-A868 PolarHBondContact O-N 3.44Å; D866-Y870 PolarHBondContact O-OH 2.8Å; D866-L887 HydrophobicContact CB-CD2 4.16Å; D866-L887 WeakPolarHBondContact O-CD2 3.47Å
867	D	94.6	Very high	90.5	Very high	82 Å²	82	41 Å²	41	44%	0.439	23%	0.232	S	C	.	.			trans	-63	102.7	168.1	-162.7	-71.9	0	0	0	109.5	L887 L888 V889	D867-L887 WeakPolarHBondContact CA-O 3.49Å; D867-L888 WeakPolarHBondContact OD2-CA 3.49Å; D867-V889 HydrophobicContact CB-CB 4.32Å; D867-V889 HydrophobicContact CB-CG2 3.99Å; D867-V889 PolarHBondContact OD2-N 3.4Å
868	A	94.8	Very high	89.1	Confident	10 Å²	10	44.7 Å²	44.7	8%	0.083	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	165.5	-163.2	0	0	0	0	0	112.4	K834 D835 D866 Y870 L887	K834-A868 HydrophobicContact CD-CB 4.16Å; K834-A868 VanDerWaalsContact CE-CB 3.43Å; K834-A868 HydrophobicContact CG-CB 3.64Å; D835-A868 WeakPolarHBondContact OD2-CB 3.44Å; D866-A868 WeakPolarHBondContact O-CB 3.44Å; D866-A868 PolarHBondContact O-N 3.44Å; A868-Y870 HydrophobicContact CB-CE2 3.95Å; A868-Y870 WeakPolarHBondContact O-CD2 3.35Å; A868-L887 PolarHBondContact N-O 2.93Å; A868-L887 PolarHBondContact O-N 2.91Å
869	K	95.2	Very high	88.3	Confident	84 Å²	84	44.5 Å²	44.5	37%	0.365	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.3	173	-175.5	160	-152.8	76.6	0	111.3	K834 D835 D886	K834-K869 WeakPolarHBondContact CA-O 3.44Å; D835-K869 PolarHBondContact N-O 3.35Å; D835-K869 PolarHBondContact OD1-N 2.69Å; K869-D886 WeakPolarHBondContact CB-OD1 3.47Å; K869-D886 WeakPolarHBondContact CD-OD1 3.46Å; K869-D886 WeakPolarHBondContact CG-OD1 3.49Å; K869-D886 IonicContact NZ-OD1 2.63Å; K869-D886 PolarHBondContact NZ-OD1 3.42Å; K869-D886 IonicContact NZ-OD2 2.99Å; K869-D886 PolarHBondContact NZ-OD2 2.95Å
870	Y	97	Very high	88.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.1	176.9	-71.2	-95.3	0	0	0	111.3	F818 Y833 K834 I839 F845 L857 I859 D866 A868 T884 A885 L887	F818-Y870 HydrophobicContact CD2-CG 4.35Å; F818-Y870 HydrophobicContact CE2-CD1 4.15Å; F818-Y870 AromaticContact CE2-CD2 3.69Å; F818-Y870 HydrophobicContact CE2-CD2 3.69Å; F818-Y870 HydrophobicContact CE2-CE2 4.27Å; F818-Y870 AromaticContact CE2-CG 3.64Å; F818-Y870 HydrophobicContact CE2-CG 3.64Å; F818-Y870 AromaticContact CZ-CD2 3.89Å; F818-Y870 HydrophobicContact CZ-CD2 3.89Å; F818-Y870 HydrophobicContact CZ-CG 4.1Å; Y833-Y870 WeakPolarHBondContact O-CA 3.48Å; K834-Y870 HydrophobicContact CB-CD1 4.33Å; K834-Y870 HydrophobicContact CB-CE1 3.98Å; K834-Y870 HydrophobicContact CD-CE1 4.17Å; K834-Y870 WeakPolarHBondContact CD-OH 3.46Å; K834-Y870 VanDerWaalsContact CE-OH 3.31Å; K834-Y870 WeakPolarHBondContact CE-OH 3.3Å; K834-Y870 HydrophobicContact CG-CE1 3.99Å; K834-Y870 HydrophobicContact CG-CE2 4.31Å; I839-Y870 HydrophobicContact CD1-CD1 3.79Å; I839-Y870 HydrophobicContact CD1-CE1 3.71Å; F845-Y870 HydrophobicContact CE1-CE1 4.14Å; L857-Y870 HydrophobicContact CD2-CD1 3.52Å; L857-Y870 HydrophobicContact CD2-CE1 3.86Å; I859-Y870 HydrophobicContact CD1-CE1 3.8Å; I859-Y870 HydrophobicContact CD1-CE2 4.22Å; D866-Y870 PolarHBondContact O-OH 2.8Å; A868-Y870 HydrophobicContact CB-CE2 3.95Å; A868-Y870 WeakPolarHBondContact O-CD2 3.35Å; Y870-T884 CarbonylContact O-C 3.53Å; Y870-T884 VanDerWaalsContact O-CA 3.25Å; Y870-T884 WeakPolarHBondContact O-CA 3.25Å; Y870-A885 WeakPolarHBondContact CA-O 3.3Å; Y870-A885 PolarHBondContact N-O 3.49Å; Y870-A885 PolarHBondContact O-N 3.18Å; Y870-A885 VanDerWaalsContact O-O 3.06Å; Y870-L887 HydrophobicContact CD2-CB 3.87Å; Y870-L887 HydrophobicContact CE2-CB 3.64Å; Y870-L887 HydrophobicContact CE2-CD2 3.85Å; Y870-L887 HydrophobicContact CE2-CG 4.41Å
871	M	96.4	Very high	88	Confident	32 Å²	32	49.2 Å²	49.2	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.9	175.2	172.8	176.2	62.2	0	0	110.7	W832 Y833 T882 C883 T884	W832-M871 CarbonylContact C-O 3.48Å; W832-M871 WeakPolarHBondContact CA-O 3.37Å; Y833-M871 HydrophobicContact CD1-CE 4.33Å; Y833-M871 HydrophobicContact CD2-CE 3.77Å; Y833-M871 HydrophobicContact CE2-CE 4.26Å; Y833-M871 HydrophobicContact CG-CE 3.83Å; Y833-M871 PolarHBondContact N-O 3.38Å; Y833-M871 PolarHBondContact O-N 2.82Å; M871-T882 HydrophobicContact SD-CG2 3.92Å; M871-C883 CarbonylContact C-O 3.51Å; M871-C883 VanDerWaalsContact CA-O 3.3Å; M871-C883 WeakPolarHBondContact CA-O 3.47Å; M871-C883 WeakPolarHBondContact CG-O 3.46Å; M871-T884 HydrophobicContact CB-CG2 3.94Å; M871-T884 HydrophobicContact CG-CG2 3.95Å; M871-T884 HydrophobicContact SD-CG2 4.29Å
872	V	95.4	Very high	88.2	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.3	165.8	58.2	0	0	0	0	109.4	F801 I805 I822 V830 W832 T882 C883	F801-V872 HydrophobicContact CE1-CG1 3.55Å; F801-V872 HydrophobicContact CE1-CG2 4.2Å; F801-V872 HydrophobicContact CZ-CB 4.48Å; F801-V872 HydrophobicContact CZ-CG1 3.7Å; F801-V872 HydrophobicContact CZ-CG2 4.23Å; I805-V872 HydrophobicContact CD1-CG1 4.07Å; I805-V872 HydrophobicContact CG1-CG1 4.36Å; I805-V872 HydrophobicContact CG2-CG1 4.22Å; I822-V872 HydrophobicContact CD1-CG2 4.44Å; V830-V872 HydrophobicContact CG1-CG2 3.66Å; W832-V872 HydrophobicContact CD2-CB 3.89Å; W832-V872 HydrophobicContact CD2-CG2 4.08Å; W832-V872 HydrophobicContact CE3-CB 3.84Å; W832-V872 HydrophobicContact CH2-CB 4.17Å; W832-V872 HydrophobicContact CH2-CG1 4.5Å; W832-V872 HydrophobicContact CZ2-CB 4.17Å; W832-V872 HydrophobicContact CZ2-CG2 4.1Å; W832-V872 HydrophobicContact CZ3-CB 3.99Å; W832-V872 HydrophobicContact CZ3-CG1 4.48Å; V872-T882 CarbonylContact O-C 3.58Å; V872-T882 VanDerWaalsContact O-CA 3.29Å; V872-T882 WeakPolarHBondContact O-CA 3.31Å; V872-C883 HydrophobicContact CG1-CB 3.85Å; V872-C883 PolarHBondContact N-O 3.35Å; V872-C883 PolarHBondContact O-N 3.12Å
873	K	93.1	Very high	88.2	Confident	42 Å²	42	45.9 Å²	45.9	18%	0.183	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.5	176.9	-179.9	162.8	173.7	155.6	0	110	V830 V831 Y833 V875 E880 A881 T882	V830-K873 CarbonylContact C-O 3.55Å; V830-K873 WeakPolarHBondContact CA-O 3.37Å; V831-K873 PolarHBondContact N-O 3.06Å; V831-K873 PolarHBondContact O-N 2.92Å; Y833-K873 HydrophobicContact CE2-CB 3.92Å; K873-V875 HydrophobicContact CD-CG2 4.31Å; K873-V875 VanDerWaalsContact CE-CG2 3.49Å; K873-V875 HydrophobicContact CG-CG2 3.95Å; K873-E880 VanDerWaalsContact CE-OE2 3.31Å; K873-E880 WeakPolarHBondContact CE-OE2 3.24Å; K873-E880 IonicContact NZ-OE1 2.73Å; K873-E880 PolarHBondContact NZ-OE1 3.34Å; K873-E880 IonicContact NZ-OE2 2.69Å; K873-E880 PolarHBondContact NZ-OE2 3.19Å; K873-A881 WeakPolarHBondContact CA-O 3.45Å; K873-T882 HydrophobicContact CB-CG2 3.87Å; K873-T882 HydrophobicContact CD-CG2 3.93Å; K873-T882 HydrophobicContact CG-CG2 3.77Å
874	A	91.3	Very high	88.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.3	175.4	0	0	0	0	0	110.1	P799 F801 I822 P828 E829 E880 A881	P799-A874 HydrophobicContact CB-CB 3.81Å; F801-A874 HydrophobicContact CZ-CB 4.34Å; I822-A874 HydrophobicContact CD1-CB 4.37Å; I822-A874 HydrophobicContact CG2-CB 3.76Å; P828-A874 HydrophobicContact CB-CB 4.16Å; P828-A874 HydrophobicContact CG-CB 4.33Å; E829-A874 CarbonylContact O-C 3.56Å; E829-A874 WeakPolarHBondContact O-CA 3.35Å; A874-E880 CarbonylContact O-C 3.54Å; A874-E880 VanDerWaalsContact O-CA 3.25Å; A874-E880 WeakPolarHBondContact O-CA 3.46Å; A874-A881 PolarHBondContact N-O 3.46Å; A874-A881 PolarHBondContact O-N 3.35Å
875	V	83.3	Confident	88.9	Confident	49 Å²	49	45.5 Å²	45.5	30%	0.297	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135.5	-175.4	-170.3	0	0	0	0	111	P828 E829 K873 E880	P828-V875 CarbonylContact C-O 3.57Å; P828-V875 VanDerWaalsContact CA-O 3.24Å; P828-V875 WeakPolarHBondContact CA-O 3.36Å; P828-V875 WeakPolarHBondContact CB-O 3.34Å; E829-V875 PolarHBondContact N-O 2.93Å; E829-V875 PolarHBondContact O-N 3.2Å; K873-V875 HydrophobicContact CD-CG2 4.31Å; K873-V875 VanDerWaalsContact CE-CG2 3.49Å; K873-V875 HydrophobicContact CG-CG2 3.95Å; V875-E880 HydrophobicContact CG1-CB 4.44Å; V875-E880 HydrophobicContact CG2-CB 4.03Å
876	N	78	Confident	89.2	Confident	20 Å²	20	41.4 Å²	41.4	11%	0.107	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	-176.9	165.1	77.5	12.6	0	0	0	111.1	S797 P799 P826 P828 L878 G879	S797-N876 PolarHBondContact O-ND2 3.2Å; P799-N876 WeakPolarHBondContact CD-OD1 3.32Å; P799-N876 HydrophobicContact CG-CB 4.2Å; P826-N876 VanDerWaalsContact O-CB 3.32Å; P826-N876 WeakPolarHBondContact O-CB 3.42Å; P826-N876 PolarHBondContact O-ND2 2.87Å; P828-N876 HydrophobicContact CB-CB 4.33Å; N876-L878 PolarHBondContact O-N 3.22Å; N876-L878 WeakPolarHBondContact OD1-CA 3.18Å; N876-L878 WeakPolarHBondContact OD1-CB 3.31Å; N876-L878 PolarHBondContact OD1-N 2.94Å; N876-G879 PolarHBondContact N-O 3.37Å; N876-G879 PolarHBondContact O-N 3.36Å; N876-G879 VanDerWaalsContact O-O 3.13Å; N876-G879 PolarHBondContact OD1-N 3.1Å
877	S	67.3	Low	89.3	Confident	90 Å²	90	41.2 Å²	41.2	63%	0.629	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.5	-177.4	57.6	0	0	0	0	115.7
878	L	64.8	Low	89.2	Confident	79 Å²	79	41.1 Å²	41.1	41%	0.414	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-8.6	-177.6	-58.7	167.7	0	0	0	112.9	E796 K798 Y825 N876	E796-L878 HydrophobicContact CB-CD1 3.78Å; E796-L878 HydrophobicContact CG-CD1 4.24Å; K798-L878 HydrophobicContact CB-CB 4.23Å; Y825-L878 WeakPolarHBondContact O-CD1 3.46Å; N876-L878 PolarHBondContact O-N 3.22Å; N876-L878 WeakPolarHBondContact OD1-CA 3.18Å; N876-L878 WeakPolarHBondContact OD1-CB 3.31Å; N876-L878 PolarHBondContact OD1-N 2.94Å
879	G	76.8	Confident	89.1	Confident	29 Å²	29	41.5 Å²	41.5	30%	0.299	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	153	-165.9	175	0	0	0	0	0	114	P799 N876	P799-G879 WeakPolarHBondContact CD-O 3.39Å; P799-G879 WeakPolarHBondContact CG-O 3.24Å; N876-G879 PolarHBondContact N-O 3.37Å; N876-G879 PolarHBondContact O-N 3.36Å; N876-G879 VanDerWaalsContact O-O 3.13Å; N876-G879 PolarHBondContact OD1-N 3.1Å
880	E	89.3	Confident	88.8	Confident	110 Å²	110	43.9 Å²	43.9	51%	0.514	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.7	179.7	60.1	176.8	-114.2	0	0	112.2	K873 A874 V875	K873-E880 VanDerWaalsContact CE-OE2 3.31Å; K873-E880 WeakPolarHBondContact CE-OE2 3.24Å; K873-E880 IonicContact NZ-OE1 2.73Å; K873-E880 PolarHBondContact NZ-OE1 3.34Å; K873-E880 IonicContact NZ-OE2 2.69Å; K873-E880 PolarHBondContact NZ-OE2 3.19Å; A874-E880 CarbonylContact O-C 3.54Å; A874-E880 VanDerWaalsContact O-CA 3.25Å; A874-E880 WeakPolarHBondContact O-CA 3.46Å; V875-E880 HydrophobicContact CG1-CB 4.44Å; V875-E880 HydrophobicContact CG2-CB 4.03Å
881	A	88.1	Confident	87.9	Confident	20 Å²	20	48.6 Å²	48.6	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.7	166.6	0	0	0	0	0	110.2	P799 F801 K873 A874	P799-A881 HydrophobicContact CB-CB 4.28Å; P799-A881 WeakPolarHBondContact O-CB 3.36Å; F801-A881 HydrophobicContact CD2-CB 4Å; F801-A881 HydrophobicContact CE2-CB 3.79Å; K873-A881 WeakPolarHBondContact CA-O 3.45Å; A874-A881 PolarHBondContact N-O 3.46Å; A874-A881 PolarHBondContact O-N 3.35Å
882	T	94.6	Very high	86.3	Confident	74 Å²	74	54.1 Å²	54.1	45%	0.454	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	154.8	174	52	0	0	0	0	111.2	M871 V872 K873	M871-T882 HydrophobicContact SD-CG2 3.92Å; V872-T882 CarbonylContact O-C 3.58Å; V872-T882 VanDerWaalsContact O-CA 3.29Å; V872-T882 WeakPolarHBondContact O-CA 3.31Å; K873-T882 HydrophobicContact CB-CG2 3.87Å; K873-T882 HydrophobicContact CD-CG2 3.93Å; K873-T882 HydrophobicContact CG-CG2 3.77Å
883	C	92.6	Very high	84.5	Confident	18 Å²	18	58.7 Å²	58.7	12%	0.122	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.2	170.3	-168	0	0	0	0	109.5	F801 V804 I805 M871 V872	F801-C883 HydrophobicContact CD1-CB 4.29Å; F801-C883 HydrophobicContact CD2-CB 4.1Å; F801-C883 HydrophobicContact CE1-CB 4.2Å; F801-C883 HydrophobicContact CE2-CB 4.03Å; F801-C883 HydrophobicContact CG-CB 4.24Å; F801-C883 HydrophobicContact CZ-CB 4.09Å; V804-C883 WeakPolarHBondContact CB-SG 3.36Å; I805-C883 HydrophobicContact CG1-CB 4.22Å; M871-C883 CarbonylContact C-O 3.51Å; M871-C883 VanDerWaalsContact CA-O 3.3Å; M871-C883 WeakPolarHBondContact CA-O 3.47Å; M871-C883 WeakPolarHBondContact CG-O 3.46Å; V872-C883 HydrophobicContact CG1-CB 3.85Å; V872-C883 PolarHBondContact N-O 3.35Å; V872-C883 PolarHBondContact O-N 3.12Å
884	T	96.6	Very high	82.5	Confident	68 Å²	68	59.9 Å²	59.9	42%	0.417	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144	-174.5	68.3	0	0	0	0	111.8	Y870 M871	Y870-T884 CarbonylContact O-C 3.53Å; Y870-T884 VanDerWaalsContact O-CA 3.25Å; Y870-T884 WeakPolarHBondContact O-CA 3.25Å; M871-T884 HydrophobicContact CB-CG2 3.94Å; M871-T884 HydrophobicContact CG-CG2 3.95Å; M871-T884 HydrophobicContact SD-CG2 4.29Å
885	A	95.7	Very high	80.3	Confident	0 Å²	0	69 Å²	69	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.5	171.9	0	0	0	0	0	110.2	I805 K806 D807 F818 Y870	I805-A885 HydrophobicContact CB-CB 4.16Å; I805-A885 HydrophobicContact CD1-CB 3.81Å; I805-A885 HydrophobicContact CG1-CB 3.79Å; K806-A885 WeakPolarHBondContact O-CB 3.48Å; D807-A885 WeakPolarHBondContact OD1-CA 3.49Å; F818-A885 HydrophobicContact CD1-CB 4.03Å; F818-A885 HydrophobicContact CE1-CB 3.69Å; Y870-A885 WeakPolarHBondContact CA-O 3.3Å; Y870-A885 PolarHBondContact N-O 3.49Å; Y870-A885 PolarHBondContact O-N 3.18Å; Y870-A885 VanDerWaalsContact O-O 3.06Å
886	D	95.1	Very high	78.4	Confident	58 Å²	58	74.4 Å²	74.4	31%	0.31	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	142.3	179.4	-61	-40	0	0	0	110.8	D807 V808 K869	D807-D886 VanDerWaalsContact CA-O 3.27Å; D807-D886 WeakPolarHBondContact CA-O 3.48Å; D807-D886 PolarHBondContact OD1-N 3Å; V808-D886 PolarHBondContact N-O 3.03Å; K869-D886 WeakPolarHBondContact CB-OD1 3.47Å; K869-D886 WeakPolarHBondContact CD-OD1 3.46Å; K869-D886 WeakPolarHBondContact CG-OD1 3.49Å; K869-D886 IonicContact NZ-OD1 2.63Å; K869-D886 PolarHBondContact NZ-OD1 3.42Å; K869-D886 IonicContact NZ-OD2 2.99Å; K869-D886 PolarHBondContact NZ-OD2 2.95Å
887	L	95.1	Very high	76.7	Confident	1 Å²	1	82.5 Å²	82.5	1%	0.005	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.8	171.6	-175.3	58.4	0	0	0	108.9	V808 V810 A816 F818 I859 V862 D866 D867 A868 Y870 V889	V808-L887 HydrophobicContact CB-CD1 3.78Å; V808-L887 HydrophobicContact CG1-CD1 3.66Å; V810-L887 HydrophobicContact CG2-CD1 3.72Å; A816-L887 HydrophobicContact CB-CD1 3.68Å; A816-L887 HydrophobicContact CB-CD2 4.17Å; F818-L887 HydrophobicContact CE2-CB 4.47Å; F818-L887 HydrophobicContact CZ-CB 3.99Å; F818-L887 HydrophobicContact CZ-CD1 4.36Å; I859-L887 HydrophobicContact CD1-CD2 3.61Å; V862-L887 HydrophobicContact CG1-CD2 4.32Å; D866-L887 HydrophobicContact CB-CD2 4.16Å; D866-L887 WeakPolarHBondContact O-CD2 3.47Å; D867-L887 WeakPolarHBondContact CA-O 3.49Å; A868-L887 PolarHBondContact N-O 2.93Å; A868-L887 PolarHBondContact O-N 2.91Å; Y870-L887 HydrophobicContact CD2-CB 3.87Å; Y870-L887 HydrophobicContact CE2-CB 3.64Å; Y870-L887 HydrophobicContact CE2-CD2 3.85Å; Y870-L887 HydrophobicContact CE2-CG 4.41Å; L887-V889 HydrophobicContact CG-CG2 4.36Å
888	L	92.9	Very high	75.6	Confident	79 Å²	79	87.2 Å²	87.2	41%	0.414	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.8	176.6	-61.2	177.8	0	0	0	110.3	V808 E809 V810 D867	V808-L888 PolarHBondContact O-N 3.24Å; E809-L888 HydrophobicContact CG-CB 4.25Å; E809-L888 HydrophobicContact CG-CD1 4.2Å; V810-L888 PolarHBondContact N-O 3.1Å; D867-L888 WeakPolarHBondContact OD2-CA 3.49Å
889	V	92.5	Very high	74.6	Confident	19 Å²	19	92.3 Å²	92.3	12%	0.115	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108.2	-174.2	-173	0	0	0	0	111.3	V810 E812 V862 D867 L887 V891	V810-V889 CarbonylContact O-C 3.57Å; V810-V889 WeakPolarHBondContact O-CA 3.17Å; E812-V889 HydrophobicContact CB-CG1 3.99Å; V862-V889 HydrophobicContact CG1-CG1 4.18Å; V862-V889 HydrophobicContact CG1-CG2 3.63Å; D867-V889 HydrophobicContact CB-CB 4.32Å; D867-V889 HydrophobicContact CB-CG2 3.99Å; D867-V889 PolarHBondContact OD2-N 3.4Å; L887-V889 HydrophobicContact CG-CG2 4.36Å; V889-V891 PolarHBondContact O-N 2.71Å
890	E	88.5	Confident	73	Confident	134 Å²	134	100.2 Å²	100.2	63%	0.626	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.5	174.1	-67.7	-161.2	140.9	0	0	111.1	V810 V811 E812	V810-E890 PolarHBondContact O-N 2.86Å; V811-E890 WeakPolarHBondContact CA-O 3.42Å; V811-E890 HydrophobicContact CG2-CB 4.46Å; E812-E890 PolarHBondContact N-O 3.13Å
891	V	79	Confident	71	Confident	98 Å²	98	104.1 Å²	104.1	59%	0.594	56%	0.555	S	S	*	*			trans	-84	119.6	168.8	-177.1	0	0	0	0	108.6	V889 A893	V889-V891 PolarHBondContact O-N 2.71Å; V891-A893 PolarHBondContact O-N 2.94Å
892	M	62.8	Low	69	Low	148 Å²	148	112.7 Å²	112.7	73%	0.729	59%	0.591	S	S	*	*			trans	-66.9	115.7	172.1	-76.3	-166.3	173.1	0	0	110.1	V811 G894	V811-M892 HydrophobicContact CG1-CE 4.1Å; V811-M892 HydrophobicContact CG1-CG 3.83Å; V811-M892 HydrophobicContact CG1-SD 4.35Å; V811-M892 HydrophobicContact CG2-CE 4.19Å; M892-G894 PolarHBondContact O-N 3.33Å
893	A	57.2	Low	66.7	Low	96 Å²	96	118.6 Å²	118.6	79%	0.793	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-63.5	124.5	164	0	0	0	0	0	108.6	V891	V891-A893 PolarHBondContact O-N 2.94Å
894	G	51	Low	64	Low	67 Å²	67	130.6 Å²	130.6	69%	0.691	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-63.1	143.9	177.8	0	0	0	0	0	111.6	M892 D896	M892-G894 PolarHBondContact O-N 3.33Å; G894-D896 PolarHBondContact O-N 2.91Å
895	E	46.3	Very low	62.4	Low	193 Å²	193	133.8 Å²	133.8	90%	0.902	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-70.6	122.6	166.8	-62.6	-179.5	133.3	0	0	108	E897	E895-E897 PolarHBondContact O-N 3Å
896	D	42.6	Very low	60.7	Low	161 Å²	161	140.8 Å²	140.8	86%	0.861	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65.5	122.3	174.3	-71.6	-56.5	0	0	0	109.3	G894 E898	G894-D896 PolarHBondContact O-N 2.91Å; D896-E898 PolarHBondContact O-N 3.47Å
897	E	43.3	Very low	58.8	Low	190 Å²	190	145.4 Å²	145.4	89%	0.888	74%	0.739	S	S	*	*			trans	-71.6	106.9	174.4	-66.8	-175.3	139	0	0	109.7	E895 E899	E895-E897 PolarHBondContact O-N 3Å; E897-E899 PolarHBondContact O-N 3.11Å
898	E	43.3	Very low	56.6	Low	190 Å²	190	153.9 Å²	153.9	89%	0.888	78%	0.782	S	S	*	*			trans	-69.6	116.8	170.2	-70.5	-168.8	138.9	0	0	110.1	D896 E900	D896-E898 PolarHBondContact O-N 3.47Å; E898-E900 PolarHBondContact O-N 3.03Å
899	E	44.2	Very low	54.3	Low	186 Å²	186	158.6 Å²	158.6	87%	0.869	81%	0.805	S	S	*	*			trans	-70.3	116.3	175.9	-64.5	-177.8	127.2	0	0	111	E897 E901	E897-E899 PolarHBondContact O-N 3.11Å; E899-E901 PolarHBondContact O-N 3.14Å
900	E	42.1	Very low	51.8	Low	195 Å²	195	167.9 Å²	167.9	91%	0.911	85%	0.851	S	S	*	*			trans	-76.3	108.4	165.7	-72.4	-167.4	138.1	0	0	110	E898	E898-E900 PolarHBondContact O-N 3.03Å
901	E	46.8	Very low	49.2	Very low	192 Å²	192	170.3 Å²	170.3	90%	0.897	87%	0.867	S	S	*	*			trans	-70.8	122.5	169.4	-68.9	-171.9	129.1	0	0	110.9	E899	E899-E901 PolarHBondContact O-N 3.14Å
902	E	47.4	Very low	46.9	Very low	200 Å²	200	175.8 Å²	175.8	94%	0.935	89%	0.889	S	S	*	*			trans	-75.7	136.1	169.5	-68.6	-170.6	128	0	0	111.5
903	E	46.8	Very low	45.6	Very low	197 Å²	197	178.2 Å²	178.2	92%	0.921	90%	0.902	S	S	*	*			trans	-80.6	114.3	175.1	-68.4	-171.7	131.6	0	0	113.1
904	E	35.8	Very low	44.5	Very low	271 Å²	271	185.6 Å²	185.6	100%	1.266	91%	0.912	S	S	*	*			trans	-158.5	0	135.9	-128.5	-176.9	-157.5	0	0	114.4

Retrieved 904 of 904 residues in 648.8 ms (Link to these results)

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