A0A096LXI0_POEFO Loading...

Lysine-specific demethylase 4B

Histone demethylase that specifically demethylates 'Lys-9' of histone H3, thereby playing a role in histone code. Does not demethylate histone H3 'Lys-4', H3 'Lys-27', H3 'Lys-36' nor H4 'Lys-20'. Only able to demethylate trimethylated H3 'Lys-9', with a weaker activity than KDM4A, KDM4C and KDM4D. Demethylation of Lys residue generates formaldehyde and succinate. Plays a critical role in the development of the central nervous system (CNS).

AlphaFold DB , UniProt , Accession A0A096LXI0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,227 aa.

						>A0A096LXI0_POEFO|A0A096LXI0
MDTDKSMETVSAPNPAPTTPPDPGPVSFPALGSSPAPDHVPIQEPAAAETPSNPVTSEQHAAPDITPVLPVDLEGTSKPVPGFEPLQQVGPGPPPLPPAAAKNPSCKIMTFRPTMEEFKDFAQYIVYMESQGAHRAGLAKVIPPEGWKPRQSYDTIEDMVIPAPIMQVVTGQSGLFTQYNIQKKSMTVGEYRKLANSKKYCTPRHKDFDDLERKYWKNLTFVSPIYGADVSGSIYDEGIHEWNIGHLNTLLDMVEQECGIVIEGVNTPYLYFGMWKTTFAWHTEDMDLYSINYLHFGQPKSWYTVPPEHGKRLERLAQGFFPGSSQGCDAFLRHKMTLISPSILKKYGIPFDRITQNEGEFMITFPYGYHAGFNHGFNCAESTNFATLRWVDYGKNATLCSCRKDMVKISMDVFVRCLQPSRYELWKQGKDITVLDHLKATELSSPELESWRQQRIAYRQNLLQKAMHKMKQVRRLKLEEVKVLAEEGIELNAAEYQRQVEEREAQRKQEREERLAREAMLALEALEREEQKAAEAAAKAADSPVKAEEQEVDIKPPNFMEDIEKKKLKKQKRMSNIQGPISGFEEAFEQFAKSANRNVDTSSIKNEDMSMEINTAQQLTFTKMKMPKEVKKSRRHPLSKPPMRSPLSIVKQDPTTEKELSSQMPMDSSMKKQEHLWRNHSPNFLAEKSFNAAVAGLEPYCAVCSLFCSYMKPNRDVISLTPEASLPRHGMSTRPLVPEMCFSVGAVNTEPPPTNYHIGEDGTSLLIRCKCCAMQVHASCYGLKPESVRDSWTCTRCTAEAWVVECCLCNLRGGALKMTTDNRWAHVICAIGVPEARFVNAIDREPVDVSAVPENRKSLKCVFCHTTNPSLNRGACIQCTHENCATSFHVTCAQIAGVVMKPADWPYVVSVSCHKHKKGIQMVNKVNKVNKPRAAPKPAPQGLDLGLKVIGRKSDTWYYHCTIIGIATQTFYEVNFEEGSYCDNVHPENIVSHDCLRNGAPDAGELIEVGTPDGENLNASFVREHVHKLYQVEFQDQSQLMLKQSEIFQLDHELPKRVRARLALPTPQEEVRPADEAQAAKRRRLPSSSAGPNTADPLPAPAQQNHSITTQPTVEPPSMTPTTNQEAPTRVSSIQTDTETPMDTGDNLAEPPPISNPPLTQQHTPFQATLNSDPFLSAPSSSSPLPPPPPPPQHMGDSYTPSSGYVSYMETLLHSRFPQDEGPGPVY
					

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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	32.6	Very low	33	Very low	218 Å²	218	138.8 Å²	138.8	100%	1.074	76%	0.762	S	S	*	*				0	59.9	0	-60.1	177.5	-172.6	0	0	107.7
2	D	30.8	Very low	32.9	Very low	143 Å²	143	135 Å²	135	77%	0.765	76%	0.763	S	S	*	*				98.7	128	51.2	-63.6	-22.1	0	0	0	108.3
3	T	38.1	Very low	34.5	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	76%	0.757	S	S	*	*			cis	-154.2	134.5	2.5	18.4	0	0	0	0	106.4
4	D	37.8	Very low	34.5	Very low	126 Å²	126	134.4 Å²	134.4	67%	0.674	76%	0.763	S	S	*	*				89.1	142.5	67.6	-169.3	31.9	0	0	0	114.3
5	K	33.3	Very low	35.2	Very low	163 Å²	163	133.5 Å²	133.5	71%	0.709	76%	0.764	S	S	*	*			trans	74.8	129.7	176.2	-51.6	-174.3	-177.9	166	0	117.4
6	S	33.3	Very low	35.3	Very low	96 Å²	96	130.9 Å²	130.9	67%	0.671	76%	0.763	S	S	*	*			cis	82.8	147.6	28.4	93.9	0	0	0	0	114.4
7	M	32.6	Very low	35.9	Very low	141 Å²	141	130.9 Å²	130.9	70%	0.695	77%	0.769	S	S	*	*			cis	-164.1	155.4	-2.6	-127.3	157.9	82.4	0	0	110.4
8	E	33.2	Very low	35.7	Very low	153 Å²	153	130.3 Å²	130.3	72%	0.715	77%	0.767	S	S	*	*			trans	61.5	171.3	150.6	-73.4	171.9	171.6	0	0	119.4
9	T	31.8	Very low	35.7	Very low	115 Å²	115	130.3 Å²	130.3	71%	0.706	77%	0.768	S	S	*	*			cis	-146	135.3	6.6	1.6	0	0	0	0	113.4
10	V	30.1	Very low	36.3	Very low	125 Å²	125	129.5 Å²	129.5	76%	0.758	77%	0.767	S	S	*	*				45.7	121.5	122.1	-178.8	0	0	0	0	122.5
11	S	29.2	Very low	37	Very low	122 Å²	122	129.1 Å²	129.1	85%	0.853	77%	0.768	S	S	*	*				174.8	155.1	124.4	-79.4	0	0	0	0	115.3
12	A	32.1	Very low	37.3	Very low	93 Å²	93	125.6 Å²	125.6	77%	0.769	75%	0.754	S	S	*	*			trans	-153.5	-173.1	168.5	0	0	0	0	0	107.8
13	P	53.8	Low	38	Very low	106 Å²	106	124.4 Å²	124.4	69%	0.688	75%	0.754	S	S	*	*			cis	-137	173.8	-8.5	42.4	-26.2	0	0	0	116
14	N	34.7	Very low	37.5	Very low	156 Å²	156	120.9 Å²	120.9	83%	0.834	74%	0.742	S	S	*	*			trans	62.7	173.7	155.1	-74.2	-7.2	0	0	0	118.1
15	P	45.2	Very low	37.8	Very low	120 Å²	120	121.4 Å²	121.4	78%	0.779	75%	0.753	S	S	*	*			cis	-124.8	-173.5	-0.8	43.5	-29	0	0	0	115.2
16	A	36	Very low	37.8	Very low	92 Å²	92	119.9 Å²	119.9	76%	0.76	76%	0.757	S	S	*	*			trans	-119.5	149.1	163.6	0	0	0	0	0	111
17	P	46.1	Very low	37.7	Very low	131 Å²	131	119.4 Å²	119.4	85%	0.851	75%	0.754	S	S	*	*			trans	-141.1	-169.9	131.3	36	-19.7	0	0	0	113.8
18	T	32.7	Very low	37.5	Very low	121 Å²	121	121.8 Å²	121.8	74%	0.742	76%	0.76	S	S	*	*			trans	-121.6	149.6	-145.7	-2	0	0	0	0	117.3
19	T	35	Very low	38.1	Very low	129 Å²	129	120.6 Å²	120.6	79%	0.791	77%	0.766	S	S	*	*			trans	63.4	169.2	152.4	47.1	0	0	0	0	119.3
20	P	48	Very low	38.2	Very low	115 Å²	115	119.8 Å²	119.8	75%	0.747	77%	0.771	S	S	*	*			cis	-126.8	-151.7	-4.2	33.7	-10.7	0	0	0	112.7
21	P	51.5	Low	38	Very low	121 Å²	121	122.1 Å²	122.1	79%	0.786	78%	0.778	S	S	*	*				-123.8	-171.6	-61.6	35.6	-18.2	0	0	0	115.4
22	D	37.4	Very low	37.9	Very low	144 Å²	144	119 Å²	119	77%	0.77	77%	0.766	S	S	*	*			trans	-45.8	156.2	172.7	-168.4	45.2	0	0	0	117.5
23	P	45.4	Very low	37.8	Very low	118 Å²	118	119.9 Å²	119.9	77%	0.766	77%	0.766	S	S	*	*				-148.2	146.4	101.5	39.1	-23.1	0	0	0	117.7
24	G	28.9	Very low	36.8	Very low	51 Å²	51	120.6 Å²	120.6	53%	0.526	77%	0.774	S	S	.	*			trans	-78	166.6	151	0	0	0	0	0	113
25	P	44.5	Very low	37.8	Very low	137 Å²	137	119.1 Å²	119.1	89%	0.89	77%	0.772	S	S	*	*				-149.9	-154.2	81.4	41.4	-21.6	0	0	0	114.8
26	V	32.4	Very low	37.4	Very low	132 Å²	132	117.5 Å²	117.5	80%	0.8	77%	0.769	S	S	*	*			trans	-118.6	163.8	-161	-158.1	0	0	0	0	113.2
27	S	30.1	Very low	38.1	Very low	86 Å²	86	119 Å²	119	60%	0.601	77%	0.772	S	S	*	*			trans	101.3	153.1	136.9	70.3	0	0	0	0	123.8
28	F	28.5	Very low	37.7	Very low	190 Å²	190	119.3 Å²	119.3	83%	0.833	77%	0.766	S	S	*	*			trans	88.4	166	163.7	-55.7	-62.1	0	0	0	119.6
29	P	46.6	Very low	37.7	Very low	128 Å²	128	122.7 Å²	122.7	83%	0.831	77%	0.773	S	S	*	*				-136.7	-154.3	-78	42.6	-23.4	0	0	0	115.7
30	A	32.9	Very low	37.6	Very low	99 Å²	99	122.1 Å²	122.1	82%	0.818	77%	0.769	S	S	*	*			trans	-120.9	174.8	-154	0	0	0	0	0	118.9
31	L	27.2	Very low	37.9	Very low	173 Å²	173	121.9 Å²	121.9	91%	0.906	77%	0.768	S	S	*	*			trans	-162.1	163.8	160.5	-95	173.4	0	0	0	108.5
32	G	26.8	Very low	37.4	Very low	57 Å²	57	123.6 Å²	123.6	59%	0.588	77%	0.768	S	S	*	*			cis	116.1	135.5	-9.9	0	0	0	0	0	115.4
33	S	30.2	Very low	37.4	Very low	111 Å²	111	124.8 Å²	124.8	78%	0.776	77%	0.769	S	S	*	*			cis	-167.9	154.1	-8.5	-70.4	0	0	0	0	112.4
34	S	33.5	Very low	37	Very low	122 Å²	122	126.8 Å²	126.8	85%	0.853	77%	0.768	S	S	*	*			trans	68.4	168	159.9	-59.1	0	0	0	0	119.4
35	P	55.4	Low	38.7	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	78%	0.778	S	S	*	*			cis	-127.7	-171.8	-4.1	42.2	-25.8	0	0	0	115.7
36	A	35.7	Very low	38.5	Very low	86 Å²	86	127.8 Å²	127.8	71%	0.711	77%	0.774	S	S	*	*			trans	-93.2	-178.2	169.2	0	0	0	0	0	112.7
37	P	51.7	Low	38.7	Very low	125 Å²	125	126.2 Å²	126.2	81%	0.812	77%	0.774	S	S	*	*				-153.1	-169.4	87.2	42.2	-22.2	0	0	0	116.9
38	D	38	Very low	39.2	Very low	137 Å²	137	126.1 Å²	126.1	73%	0.733	78%	0.779	S	S	*	*			trans	-87.9	174.2	-166.8	-44.2	-101.5	0	0	0	117.6
39	H	32.1	Very low	39.8	Very low	191 Å²	191	126.1 Å²	126.1	88%	0.884	78%	0.782	S	S	*	*				-169.8	153.7	110.6	-110.4	-78	0	0	0	115.5
40	V	33.6	Very low	39.2	Very low	118 Å²	118	125.9 Å²	125.9	72%	0.715	78%	0.778	S	S	*	*			trans	-130.6	162.5	-174.8	-149.7	0	0	0	0	112.6
41	P	53.5	Low	40.4	Very low	110 Å²	110	126.2 Å²	126.2	71%	0.714	77%	0.772	S	S	*	*			trans	-141	171.8	131.4	33.6	-17.6	0	0	0	113.1
42	I	40.9	Very low	40.9	Very low	156 Å²	156	122.8 Å²	122.8	80%	0.8	76%	0.762	S	S	*	*			cis	176.7	154	-29.6	-102.4	165.4	0	0	0	104.7
43	Q	36.9	Very low	41.6	Very low	170 Å²	170	127.3 Å²	127.3	79%	0.794	77%	0.773	S	S	*	*			cis	-142.3	-93.1	28.2	-173.8	142	-3.3	0	0	115.3
44	E	38.3	Very low	42.7	Very low	160 Å²	160	126.9 Å²	126.9	75%	0.748	77%	0.768	S	S	*	*			trans	-169.3	-172.3	-157	-120.8	-161.7	101.2	0	0	108.7
45	P	64.9	Low	43	Very low	111 Å²	111	127.4 Å²	127.4	72%	0.721	77%	0.765	S	S	*	*			cis	-118.4	-142.1	0	27.1	-0.5	0	0	0	111
46	A	38.8	Very low	42.4	Very low	97 Å²	97	127 Å²	127	80%	0.802	76%	0.761	S	S	*	*			cis	-158.9	-166.2	10.1	0	0	0	0	0	112.9
47	A	37	Very low	42.5	Very low	99 Å²	99	127.3 Å²	127.3	82%	0.818	76%	0.758	S	S	*	*			trans	-135.7	-166.1	-169.1	0	0	0	0	0	111.9
48	A	40.4	Very low	41.9	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	75%	0.751	S	S	*	*			cis	-165.5	170.1	17.2	0	0	0	0	0	115.5
49	E	40.5	Very low	41.7	Very low	189 Å²	189	129 Å²	129	88%	0.883	75%	0.751	S	S	*	*			trans	75.6	177.9	150.8	-73.1	-174	-153.3	0	0	123.2
50	T	34	Very low	41.9	Very low	123 Å²	123	128.4 Å²	128.4	76%	0.755	75%	0.748	S	S	*	*				-136.4	-165	-128.4	0.5	0	0	0	0	113.3
51	P	58.2	Low	42.2	Very low	106 Å²	106	126.5 Å²	126.5	69%	0.688	75%	0.745	S	S	*	*			cis	-141.3	172.5	-27.5	36.8	-16.7	0	0	0	118.5
52	S	38.8	Very low	41.4	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	75%	0.749	S	S	*	*			trans	82.3	136.7	138.7	70.6	0	0	0	0	127
53	N	41.6	Very low	41.8	Very low	153 Å²	153	124.1 Å²	124.1	82%	0.818	75%	0.747	S	S	*	*			trans	64.1	156.7	148	-76.8	-4.5	0	0	0	122.9
54	P	52.3	Low	41.6	Very low	101 Å²	101	123.6 Å²	123.6	66%	0.656	75%	0.75	S	S	*	*			cis	-137	165.5	-34.4	39.4	-24.2	0	0	0	114.7
55	V	41.4	Very low	41.6	Very low	133 Å²	133	123.1 Å²	123.1	81%	0.806	75%	0.751	S	S	*	*			trans	67.7	139.9	153.5	160.2	0	0	0	0	115.6
56	T	41.3	Very low	39.8	Very low	115 Å²	115	123.7 Å²	123.7	71%	0.706	75%	0.752	S	S	*	*			cis	-168.2	172.8	-8.7	30.5	0	0	0	0	105.3
57	S	38.5	Very low	40.4	Very low	94 Å²	94	124.6 Å²	124.6	66%	0.657	75%	0.75	S	S	*	*			cis	-175.1	175	-7	45.5	0	0	0	0	105.1
58	E	39.8	Very low	39.9	Very low	144 Å²	144	126.2 Å²	126.2	67%	0.673	75%	0.75	S	S	*	*			cis	-167.2	-178.7	-20.7	-101.5	168.8	75.1	0	0	105.5
59	Q	33.4	Very low	39.9	Very low	154 Å²	154	130.3 Å²	130.3	72%	0.72	76%	0.759	S	S	*	*			cis	-145.3	-163.6	7.9	-145.2	165.7	63.7	0	0	110.3
60	H	35.7	Very low	39.4	Very low	178 Å²	178	126.2 Å²	126.2	82%	0.824	75%	0.749	S	S	*	*			trans	-150.2	178.5	-163.6	-74.5	-86.7	0	0	0	112.2
61	A	39.3	Very low	38.9	Very low	78 Å²	78	126 Å²	126	65%	0.645	75%	0.747	S	S	*	*			cis	177.2	153.4	-41.8	0	0	0	0	0	110.4
62	A	38.2	Very low	37.4	Very low	97 Å²	97	127.6 Å²	127.6	80%	0.802	75%	0.75	S	S	*	*			trans	61.3	-177.9	156.6	0	0	0	0	0	117.9
63	P	48.2	Very low	36.8	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	75%	0.752	S	S	*	*			cis	-133.6	157.5	-20.8	36.5	-19.5	0	0	0	116.6
64	D	34	Very low	36.2	Very low	158 Å²	158	131.3 Å²	131.3	85%	0.845	76%	0.755	S	S	*	*			trans	65.6	169.6	143.9	-144.4	1.4	0	0	0	123.2
65	I	36.6	Very low	35.2	Very low	151 Å²	151	130 Å²	130	77%	0.774	76%	0.759	S	S	*	*			trans	85.2	144.6	171	-52	178.5	0	0	0	117.4
66	T	27.7	Very low	34.6	Very low	122 Å²	122	130.3 Å²	130.3	75%	0.748	76%	0.762	S	S	*	*			trans	-106	-166.1	-176.6	57.9	0	0	0	0	112.2
67	P	51.1	Low	34	Very low	117 Å²	117	130.4 Å²	130.4	76%	0.76	77%	0.768	S	S	*	*				-119.6	126.4	-96.5	34.5	-17.2	0	0	0	114.1
68	V	27.7	Very low	33.7	Very low	132 Å²	132	135.4 Å²	135.4	80%	0.8	78%	0.777	S	S	*	*			trans	-142.4	130.2	179.5	-177.9	0	0	0	0	112.1
69	L	39.8	Very low	33.6	Very low	171 Å²	171	134 Å²	134	90%	0.895	78%	0.78	S	S	*	*			trans	-94.8	134.5	155.6	-66.3	170.2	0	0	0	107.2
70	P	30	Very low	33.4	Very low	104 Å²	104	133 Å²	133	68%	0.675	79%	0.785	S	S	*	*				-149.2	141.9	98	45.1	-29.5	0	0	0	113.3
71	V	23.4	Very low	33.6	Very low	119 Å²	119	130 Å²	130	72%	0.721	78%	0.781	S	S	*	*				95.3	151.5	89.1	166.9	0	0	0	0	114.2
72	D	25.8	Very low	33.1	Very low	138 Å²	138	129.5 Å²	129.5	74%	0.738	78%	0.784	S	S	*	*			trans	70.9	148.7	164.5	-77.5	-2.2	0	0	0	120.3
73	L	27.3	Very low	32.6	Very low	143 Å²	143	134.5 Å²	134.5	75%	0.749	79%	0.788	S	S	*	*			cis	-162.6	-173.1	-27.9	-127.3	177.1	0	0	0	109.8
74	E	29.1	Very low	31.6	Very low	189 Å²	189	137.2 Å²	137.2	88%	0.883	79%	0.79	S	S	*	*			trans	68.5	131.6	174.8	-48	-164	144.1	0	0	115.9
75	G	30.1	Very low	32.3	Very low	73 Å²	73	134.6 Å²	134.6	75%	0.753	78%	0.782	S	S	*	*			cis	168.5	157.5	-4.7	0	0	0	0	0	108.2
76	T	28.9	Very low	31.9	Very low	141 Å²	141	135.5 Å²	135.5	87%	0.865	79%	0.788	S	S	*	*			cis	-149.3	162.5	-2.2	45.5	0	0	0	0	106.8
77	S	29.6	Very low	32.2	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	80%	0.795	S	S	*	*			cis	-160.8	178.6	43.9	52.4	0	0	0	0	113.4
78	K	32.2	Very low	31.2	Very low	198 Å²	198	142.3 Å²	142.3	86%	0.861	80%	0.801	S	S	*	*			trans	-103.9	-167.9	-168.3	-51.6	174	-179.2	177.5	0	111.7
79	P	37.7	Very low	31.5	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	81%	0.806	S	S	*	*			cis	-120.9	166.5	-19.6	13.9	12.7	0	0	0	113.2
80	V	28	Very low	31.2	Very low	134 Å²	134	138.2 Å²	138.2	81%	0.812	80%	0.796	S	S	*	*			cis	78	140.6	47.2	174.8	0	0	0	0	113
81	P	41.9	Very low	31.8	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	81%	0.806	S	S	*	*			cis	-120.6	171.5	15.5	39.9	-25.3	0	0	0	116.6
82	G	28.5	Very low	32.4	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	81%	0.805	S	S	*	*			cis	-159.7	-151.1	3.6	0	0	0	0	0	109.5
83	F	27.3	Very low	33.1	Very low	201 Å²	201	136.7 Å²	136.7	88%	0.882	81%	0.808	S	S	*	*			cis	-164.3	-173.4	-4.6	-112	-57.1	0	0	0	110.2
84	E	26.2	Very low	34.1	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	81%	0.809	S	S	*	*			trans	-141.8	-165.1	-159.2	-63	-162.3	113.3	0	0	115.9
85	P	48.9	Very low	34.7	Very low	104 Å²	104	132.6 Å²	132.6	68%	0.675	81%	0.807	S	S	*	*				-137.9	-175.7	-72.3	42.7	-26	0	0	0	115.5
86	L	29.3	Very low	35	Very low	170 Å²	170	136.8 Å²	136.8	89%	0.89	81%	0.811	S	S	*	*			trans	-148	172.3	155.5	-86.6	-172.1	0	0	0	113
87	Q	32.8	Very low	35.6	Very low	192 Å²	192	135.2 Å²	135.2	90%	0.897	80%	0.803	S	S	*	*			trans	-97.8	176.9	-149	-67.6	173.6	-62.1	0	0	119.1
88	Q	31	Very low	36.4	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.883	80%	0.804	S	S	*	*			trans	-109.6	170	-172.3	-61.3	177.3	-12.4	0	0	115
89	V	34	Very low	37.1	Very low	151 Å²	151	131 Å²	131	92%	0.915	80%	0.801	S	S	*	*			trans	-138.4	154.8	165.8	-178.1	0	0	0	0	109.7
90	G	33.1	Very low	37.9	Very low	67 Å²	67	130 Å²	130	69%	0.691	80%	0.803	S	S	*	*			trans	-87.6	-178.8	-164.3	0	0	0	0	0	119.4
91	P	43.8	Very low	39.6	Very low	136 Å²	136	126.4 Å²	126.4	88%	0.883	79%	0.787	S	S	*	*			trans	-98.4	165.2	-162.3	38.3	-37.1	0	0	0	116.5
92	G	34.6	Very low	41.6	Very low	67 Å²	67	126.4 Å²	126.4	69%	0.691	78%	0.776	S	S	*	*			trans	-108	-172.8	176.5	0	0	0	0	0	115.3
93	P	41.1	Very low	44.6	Very low	125 Å²	125	124.1 Å²	124.1	81%	0.812	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-74.8	159.3	-171.5	30.7	-36.3	0	0	0	114.7
94	P	47.8	Very low	47.7	Very low	118 Å²	118	119.4 Å²	119.4	77%	0.766	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-76.8	161	-174.2	31.5	-36.7	0	0	0	114.3
95	P	41.5	Very low	50.8	Low	128 Å²	128	114.9 Å²	114.9	83%	0.831	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-72.5	149.4	-176.7	-16.2	31.6	0	0	0	114.3
96	L	37.9	Very low	53	Low	162 Å²	162	110.5 Å²	110.5	85%	0.848	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-73.7	153.9	168.1	-73.1	166.8	0	0	0	111.6
97	P	41.7	Very low	56.2	Low	107 Å²	107	107 Å²	107	70%	0.695	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-64.1	152.4	177.7	27.4	-35.4	0	0	0	112.3	A99	P97-A99 PolarHBondContact O-N 2.69Å
98	P	44.6	Very low	59.3	Low	130 Å²	130	99 Å²	99	84%	0.844	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-63.7	124.9	-176.6	25.8	-34.3	0	0	0	111.6
99	A	47.3	Very low	62.6	Low	97 Å²	97	92.4 Å²	92.4	80%	0.802	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-62.4	140	178	0	0	0	0	0	111.4	P97 A101	P97-A99 PolarHBondContact O-N 2.69Å; A99-A101 PolarHBondContact O-N 2.97Å
100	A	55.3	Low	65.6	Low	94 Å²	94	88.5 Å²	88.5	78%	0.777	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-58.5	125.9	179.2	0	0	0	0	0	111.1	K102	A100-K102 PolarHBondContact O-N 3.18Å
101	A	64	Low	68.7	Low	58 Å²	58	86 Å²	86	48%	0.479	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-59.9	119.3	-173.2	0	0	0	0	0	111.7	A99 P104	A99-A101 PolarHBondContact O-N 2.97Å; A101-P104 WeakPolarHBondContact O-CD 3.38Å
102	K	84.1	Confident	71.3	Confident	114 Å²	114	88.1 Å²	88.1	50%	0.496	54%	0.544	S	S	.	.	S	Bend	trans	-62.3	150.3	176.8	-65.7	-81.9	-170.5	155.1	0	111	A100 R135	A100-K102 PolarHBondContact O-N 3.18Å; K102-R135 WeakPolarHBondContact O-CD 3.27Å; K102-R135 PolarHBondContact O-NH1 2.94Å; K102-R135 VanDerWaalsContact O-NH1 3.11Å
103	N	91.7	Very high	74.4	Confident	21 Å²	21	85.3 Å²	85.3	11%	0.112	51%	0.513	C	S	.	.	S	Bend	trans	42.2	59.6	-173.6	-166	7	0	0	0	113.9	S105 C106 K107 M109 G132 R135	N103-S105 PolarHBondContact O-N 3.33Å; N103-S105 VanDerWaalsContact O-N 3.16Å; N103-C106 PolarHBondContact O-N 2.95Å; N103-C106 PolarHBondContact OD1-N 3.19Å; N103-K107 PolarHBondContact ND2-N 3.31Å; N103-K107 PolarHBondContact ND2-O 3.45Å; N103-K107 PolarHBondContact OD1-N 2.96Å; N103-M109 HydrophobicContact CB-SD 4.25Å; N103-G132 VanDerWaalsContact CB-O 3.24Å; N103-G132 WeakPolarHBondContact CB-O 3.39Å; N103-G132 PolarHBondContact ND2-O 3.15Å; N103-R135 PolarHBondContact O-NH1 2.88Å
104	P	90.7	Very high	77	Confident	102 Å²	102	82.6 Å²	82.6	66%	0.662	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.2	-175	29.1	-35.8	0	0	0	113.9	A101	A101-P104 WeakPolarHBondContact O-CD 3.38Å
105	S	91.9	Very high	79.3	Confident	80 Å²	80	79.9 Å²	79.9	56%	0.559	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-1.1	176.1	51.5	0	0	0	0	114	N103 K107	N103-S105 PolarHBondContact O-N 3.33Å; N103-S105 VanDerWaalsContact O-N 3.16Å; S105-K107 PolarHBondContact O-N 3.24Å
106	C	94.8	Very high	81.8	Confident	12 Å²	12	79.8 Å²	79.8	8%	0.081	46%	0.461	C	S	.	.			trans	49.5	42.6	-179.8	-50.4	0	0	0	0	113.2	N103 R135 A136 P306 E308	N103-C106 PolarHBondContact O-N 2.95Å; N103-C106 PolarHBondContact OD1-N 3.19Å; C106-R135 HydrophobicContact CB-CB 4.35Å; C106-R135 VanDerWaalsContact SG-CZ 3.58Å; C106-R135 PolarHBondContact SG-NH2 2.78Å; C106-A136 WeakPolarHBondContact O-CA 3.44Å; C106-P306 HydrophobicContact CB-CB 4.2Å; C106-P306 HydrophobicContact CB-CG 3.78Å; C106-E308 PolarHBondContact SG-OE2 3.48Å
107	K	97.1	Very high	84.6	Confident	98 Å²	98	76 Å²	76	43%	0.426	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-88.8	146.7	-177.9	-77.7	-61.8	-170	-173.1	0	112.3	N103 S105 M109 A136 D352	N103-K107 PolarHBondContact ND2-N 3.31Å; N103-K107 PolarHBondContact ND2-O 3.45Å; N103-K107 PolarHBondContact OD1-N 2.96Å; S105-K107 PolarHBondContact O-N 3.24Å; K107-M109 PolarHBondContact O-N 2.94Å; K107-A136 WeakPolarHBondContact O-CB 3.37Å; K107-D352 HydrophobicContact CD-CB 4.49Å; K107-D352 VanDerWaalsContact CD-CG 3.5Å; K107-D352 WeakPolarHBondContact CD-OD2 3.46Å; K107-D352 VanDerWaalsContact NZ-CG 3.32Å; K107-D352 IonicContact NZ-OD1 3.87Å; K107-D352 PolarHBondContact NZ-OD1 3.32Å; K107-D352 IonicContact NZ-OD2 2.79Å
108	I	98.4	Very high	87.2	Confident	23 Å²	23	70.9 Å²	70.9	12%	0.118	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-60.8	120.6	177.2	-63	163.7	0	0	0	108.7	A136 L138 T304 D352 I354	I108-A136 HydrophobicContact CG1-CB 4.4Å; I108-L138 HydrophobicContact CD1-CD2 4.15Å; I108-L138 HydrophobicContact CG1-CB 4.46Å; I108-T304 HydrophobicContact CD1-CG2 3.91Å; I108-T304 HydrophobicContact CG1-CG2 3.85Å; I108-D352 HydrophobicContact CD1-CB 3.76Å; I108-D352 HydrophobicContact CG1-CB 3.91Å; I108-D352 WeakPolarHBondContact CG1-OD2 3.22Å; I108-D352 PolarHBondContact N-OD2 2.92Å; I108-I354 HydrophobicContact CD1-CB 3.91Å; I108-I354 HydrophobicContact CD1-CG2 3.88Å; I108-I354 HydrophobicContact CG2-CB 4.26Å; I108-I354 HydrophobicContact CG2-CD1 3.63Å; I108-I354 HydrophobicContact CG2-CG2 4.15Å
109	M	98.4	Very high	89.5	Confident	51 Å²	51	70 Å²	70	25%	0.251	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	145.9	177.5	-62.1	-175.2	70.8	0	0	110.3	N103 K107 F111 Q131 A133 A139 K140	N103-M109 HydrophobicContact CB-SD 4.25Å; K107-M109 PolarHBondContact O-N 2.94Å; M109-F111 HydrophobicContact CB-CD2 4.3Å; M109-F111 HydrophobicContact CB-CE2 3.53Å; M109-F111 HydrophobicContact CB-CZ 4.01Å; M109-F111 HydrophobicContact CE-CZ 3.96Å; M109-F111 HydrophobicContact SD-CZ 4.26Å; M109-Q131 HydrophobicContact CE-CB 3.92Å; M109-A133 HydrophobicContact CB-CB 4.41Å; M109-A133 HydrophobicContact SD-CB 4.17Å; M109-A139 WeakPolarHBondContact O-CA 3.36Å; M109-K140 PolarHBondContact O-N 3.35Å
110	T	98.6	Very high	91.7	Very high	69 Å²	69	69.2 Å²	69.2	42%	0.423	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.5	173.4	-63.5	0	0	0	0	109.1	K140 I142	T110-K140 WeakPolarHBondContact CA-O 3.44Å; T110-K140 HydrophobicContact CG2-CB 4.25Å; T110-K140 HydrophobicContact CG2-CD 3.79Å; T110-K140 HydrophobicContact CG2-CG 4.13Å; T110-I142 HydrophobicContact CG2-CD1 3.73Å; T110-I142 HydrophobicContact CG2-CG1 4.13Å
111	F	98.6	Very high	93.6	Very high	15 Å²	15	65.3 Å²	65.3	7%	0.066	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	153.7	-178.1	-66.7	-92.1	0	0	0	111.5	M109 Y124 Y127 M128 Q131 A133 A139 K140 V141 I142	M109-F111 HydrophobicContact CB-CD2 4.3Å; M109-F111 HydrophobicContact CB-CE2 3.53Å; M109-F111 HydrophobicContact CB-CZ 4.01Å; M109-F111 HydrophobicContact CE-CZ 3.96Å; M109-F111 HydrophobicContact SD-CZ 4.26Å; F111-Y124 HydrophobicContact CB-CE1 4.01Å; F111-Y124 HydrophobicContact CD1-CE1 4.45Å; F111-Y124 HydrophobicContact CG-CE1 4.38Å; F111-Y127 HydrophobicContact CD1-CE1 4.03Å; F111-Y127 HydrophobicContact CE1-CE1 4.07Å; F111-M128 HydrophobicContact CD1-CG 4.02Å; F111-M128 HydrophobicContact CD2-CE 3.78Å; F111-M128 HydrophobicContact CD2-CG 3.88Å; F111-M128 HydrophobicContact CD2-SD 4.29Å; F111-M128 HydrophobicContact CE1-CB 4.41Å; F111-M128 HydrophobicContact CE1-CG 3.96Å; F111-M128 HydrophobicContact CE2-CB 4.11Å; F111-M128 HydrophobicContact CE2-CE 3.94Å; F111-M128 HydrophobicContact CE2-CG 3.81Å; F111-M128 HydrophobicContact CG-CG 3.98Å; F111-M128 HydrophobicContact CZ-CB 3.99Å; F111-M128 HydrophobicContact CZ-CG 3.86Å; F111-Q131 HydrophobicContact CE1-CB 4.43Å; F111-Q131 HydrophobicContact CE1-CG 4.45Å; F111-Q131 HydrophobicContact CZ-CB 4.37Å; F111-A133 HydrophobicContact CE2-CB 3.7Å; F111-A133 HydrophobicContact CZ-CB 3.9Å; F111-A139 HydrophobicContact CE2-CB 4.34Å; F111-K140 PolarHBondContact N-O 3.07Å; F111-V141 HydrophobicContact CB-CG1 4.31Å; F111-V141 HydrophobicContact CB-CG2 4.3Å; F111-I142 PolarHBondContact O-N 3.19Å
112	R	98.4	Very high	95	Very high	180 Å²	180	64.2 Å²	64.2	68%	0.679	33%	0.327	S	S	*	.			trans	-141.8	74.2	-178.3	-65.3	-179.4	-179.7	-83.7	1.5	109.4	I142	R112-I142 HydrophobicContact CG-CB 4.35Å
113	P	97.8	Very high	95.4	Very high	8 Å²	8	63.2 Å²	63.2	5%	0.052	32%	0.324	C	S	.	.			trans	-60.5	152.7	-179.1	20.5	-31.9	0	0	0	113.6	E117 F118 Y124 V141 I142	P113-E117 VanDerWaalsContact CA-OE2 3.27Å; P113-E117 WeakPolarHBondContact CA-OE2 3.45Å; P113-E117 HydrophobicContact CB-CB 3.85Å; P113-F118 HydrophobicContact CB-CB 4.13Å; P113-F118 HydrophobicContact CB-CD2 4.43Å; P113-F118 HydrophobicContact CG-CB 4.26Å; P113-F118 HydrophobicContact CG-CD2 3.69Å; P113-F118 HydrophobicContact CG-CG 4.41Å; P113-Y124 HydrophobicContact CB-CD2 4.31Å; P113-Y124 HydrophobicContact CB-CE1 4.26Å; P113-Y124 HydrophobicContact CB-CE2 3.68Å; P113-Y124 HydrophobicContact CG-CE1 4.2Å; P113-Y124 HydrophobicContact CG-CE2 4.49Å; P113-V141 HydrophobicContact CG-CG1 3.85Å; P113-I142 WeakPolarHBondContact CD-O 3.4Å
114	T	97.1	Very high	95.7	Very high	67 Å²	67	62.7 Å²	62.7	41%	0.411	32%	0.321	S	S	.	.			trans	-73	169	158.2	89	0	0	0	0	110.7	E116 E117 F118	T114-E116 WeakPolarHBondContact CB-OE2 3.47Å; T114-E116 PolarHBondContact O-N 3.17Å; T114-E116 PolarHBondContact OG1-N 3.15Å; T114-E116 VanDerWaalsContact OG1-N 3.17Å; T114-E116 PolarHBondContact OG1-OE2 3.39Å; T114-E117 HydrophobicContact CG2-CG 4.5Å; T114-E117 PolarHBondContact N-OE2 3.37Å; T114-E117 PolarHBondContact O-N 3.38Å; T114-E117 PolarHBondContact OG1-N 3.43Å; T114-F118 VanDerWaalsContact O-CB 3.25Å; T114-F118 WeakPolarHBondContact O-CB 3.49Å; T114-F118 PolarHBondContact O-N 3.34Å
115	M	95.5	Very high	96	Very high	62 Å²	62	57.9 Å²	57.9	31%	0.305	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-26.1	176	-172.4	62.5	82.2	0	0	112.7	K119 P144 W147	M115-K119 WeakPolarHBondContact O-CD 3.47Å; M115-K119 WeakPolarHBondContact O-CE 3.45Å; M115-K119 VanDerWaalsContact O-CG 3.3Å; M115-K119 WeakPolarHBondContact O-CG 3.44Å; M115-K119 PolarHBondContact O-N 3.02Å; M115-P144 HydrophobicContact CB-CB 4.42Å; M115-P144 HydrophobicContact CB-CG 4.42Å; M115-P144 HydrophobicContact CE-CB 4.19Å; M115-P144 HydrophobicContact SD-CG 4.33Å; M115-W147 HydrophobicContact CE-CB 4.06Å
116	E	94.8	Very high	96.2	Very high	126 Å²	126	55.4 Å²	55.4	59%	0.589	27%	0.271	S	S	*	.	H	α-helix	trans	-74.1	-45.2	176.8	-63.4	57	-120.5	0	0	110.4	T114 F118 K119	T114-E116 WeakPolarHBondContact CB-OE2 3.47Å; T114-E116 PolarHBondContact O-N 3.17Å; T114-E116 PolarHBondContact OG1-N 3.15Å; T114-E116 VanDerWaalsContact OG1-N 3.17Å; T114-E116 PolarHBondContact OG1-OE2 3.39Å; E116-F118 VanDerWaalsContact C-N 3.31Å; E116-K119 IonicContact OE1-NZ 2.74Å
117	E	95.6	Very high	96.4	Very high	81 Å²	81	59.1 Å²	59.1	38%	0.379	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-31.6	175.8	-62.2	-178.1	130.6	0	0	112.4	P113 T114 Y124	P113-E117 VanDerWaalsContact CA-OE2 3.27Å; P113-E117 WeakPolarHBondContact CA-OE2 3.45Å; P113-E117 HydrophobicContact CB-CB 3.85Å; T114-E117 HydrophobicContact CG2-CG 4.5Å; T114-E117 PolarHBondContact N-OE2 3.37Å; T114-E117 PolarHBondContact O-N 3.38Å; T114-E117 PolarHBondContact OG1-N 3.43Å; E117-Y124 HydrophobicContact CB-CD2 3.9Å; E117-Y124 HydrophobicContact CB-CE2 3.79Å
118	F	96.1	Very high	96.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-76	-21.1	-178.5	-166.4	-108.9	0	0	0	113.4	P113 T114 E116 D120 P143 P144 W147 E241 W242 F361	P113-F118 HydrophobicContact CB-CB 4.13Å; P113-F118 HydrophobicContact CB-CD2 4.43Å; P113-F118 HydrophobicContact CG-CB 4.26Å; P113-F118 HydrophobicContact CG-CD2 3.69Å; P113-F118 HydrophobicContact CG-CG 4.41Å; T114-F118 VanDerWaalsContact O-CB 3.25Å; T114-F118 WeakPolarHBondContact O-CB 3.49Å; T114-F118 PolarHBondContact O-N 3.34Å; E116-F118 VanDerWaalsContact C-N 3.31Å; F118-D120 PolarHBondContact O-N 3.47Å; F118-P143 HydrophobicContact CE1-CB 4.46Å; F118-P143 HydrophobicContact CE2-CB 3.9Å; F118-P143 HydrophobicContact CZ-CB 3.84Å; F118-P144 HydrophobicContact CB-CG 3.65Å; F118-P144 HydrophobicContact CD1-CG 4.15Å; F118-P144 HydrophobicContact CD2-CG 4.45Å; F118-P144 HydrophobicContact CG-CG 3.85Å; F118-W147 HydrophobicContact CD1-CG 4.46Å; F118-W147 AromaticContact CE1-CD1 3.89Å; F118-W147 AromaticContact CE1-CD2 3.68Å; F118-W147 HydrophobicContact CE1-CD2 3.68Å; F118-W147 AromaticContact CE1-CE2 3.56Å; F118-W147 HydrophobicContact CE1-CE3 4.25Å; F118-W147 AromaticContact CE1-CG 3.92Å; F118-W147 HydrophobicContact CE1-CG 3.92Å; F118-W147 HydrophobicContact CE1-CZ2 4.03Å; F118-W147 AromaticContact CE1-NE1 3.69Å; F118-W147 HydrophobicContact CZ-CD2 4.11Å; F118-W147 HydrophobicContact CZ-CE3 4.22Å; F118-W147 HydrophobicContact CZ-CH2 4.34Å; F118-W147 HydrophobicContact CZ-CZ2 4.25Å; F118-W147 HydrophobicContact CZ-CZ3 4.33Å; F118-E241 HydrophobicContact CD1-CB 3.81Å; F118-E241 HydrophobicContact CD1-CG 4.43Å; F118-E241 HydrophobicContact CE1-CB 3.79Å; F118-W242 AromaticContact CD1-CD1 3.95Å; F118-W242 AromaticContact CD2-CD1 3.69Å; F118-W242 HydrophobicContact CD2-CD2 4.02Å; F118-W242 AromaticContact CD2-CE2 3.62Å; F118-W242 HydrophobicContact CD2-CG 4.1Å; F118-W242 HydrophobicContact CD2-CZ2 4.17Å; F118-W242 AromaticContact CD2-NE1 3.4Å; F118-W242 HydrophobicContact CE1-CB 4.11Å; F118-W242 AromaticContact CE1-CD1 3.74Å; F118-W242 AromaticContact CE1-CG 3.95Å; F118-W242 HydrophobicContact CE1-CG 3.95Å; F118-W242 HydrophobicContact CE2-CB 4.18Å; F118-W242 AromaticContact CE2-CD1 3.5Å; F118-W242 VanDerWaalsContact CE2-CD1 3.5Å; F118-W242 AromaticContact CE2-CD2 3.37Å; F118-W242 HydrophobicContact CE2-CD2 3.37Å; F118-W242 AromaticContact CE2-CE2 3.49Å; F118-W242 VanDerWaalsContact CE2-CE2 3.49Å; F118-W242 AromaticContact CE2-CE3 3.96Å; F118-W242 HydrophobicContact CE2-CE3 3.96Å; F118-W242 AromaticContact CE2-CG 3.44Å; F118-W242 HydrophobicContact CE2-CG 3.44Å; F118-W242 VanDerWaalsContact CE2-CG 3.44Å; F118-W242 HydrophobicContact CE2-CZ2 4.19Å; F118-W242 AromaticContact CE2-NE1 3.54Å; F118-W242 AromaticContact CG-CD1 3.92Å; F118-W242 AromaticContact CG-NE1 3.84Å; F118-W242 HydrophobicContact CZ-CB 3.6Å; F118-W242 AromaticContact CZ-CD1 3.52Å; F118-W242 AromaticContact CZ-CD2 3.79Å; F118-W242 HydrophobicContact CZ-CD2 3.79Å; F118-W242 HydrophobicContact CZ-CE3 4.46Å; F118-W242 AromaticContact CZ-CG 3.35Å; F118-W242 HydrophobicContact CZ-CG 3.35Å; F118-W242 PolarHBondContact O-NE1 3.12Å; F118-F361 HydrophobicContact CE2-CD2 4.49Å; F118-F361 HydrophobicContact CE2-CE2 4.04Å; F118-F361 AromaticContact CZ-CE2 3.71Å; F118-F361 HydrophobicContact CZ-CE2 3.71Å; F118-F361 HydrophobicContact CZ-CZ 4.17Å
119	K	94	Very high	96.4	Very high	112 Å²	112	53.4 Å²	53.4	49%	0.487	26%	0.258	S	S	.	.	S	Bend	trans	-63	-36.1	-178.1	-82	156.4	-172.3	157.5	0	114.3	M115 E116 E241	M115-K119 WeakPolarHBondContact O-CD 3.47Å; M115-K119 WeakPolarHBondContact O-CE 3.45Å; M115-K119 VanDerWaalsContact O-CG 3.3Å; M115-K119 WeakPolarHBondContact O-CG 3.44Å; M115-K119 PolarHBondContact O-N 3.02Å; E116-K119 IonicContact OE1-NZ 2.74Å; K119-E241 HydrophobicContact CG-CG 4Å
120	D	92.6	Very high	96.2	Very high	80 Å²	80	53.4 Å²	53.4	43%	0.428	26%	0.263	S	S	.	.			trans	-107.7	98.3	179.1	-172.1	-26.6	0	0	0	110.9	F118 A122 Q123 Y124	F118-D120 PolarHBondContact O-N 3.47Å; D120-A122 VanDerWaalsContact C-N 3.34Å; D120-A122 PolarHBondContact O-N 2.92Å; D120-A122 PolarHBondContact OD1-N 3.27Å; D120-Q123 HydrophobicContact CB-CB 3.85Å; D120-Q123 VanDerWaalsContact CG-CB 3.4Å; D120-Q123 PolarHBondContact O-N 3.46Å; D120-Q123 PolarHBondContact OD1-N 3.04Å; D120-Y124 WeakPolarHBondContact O-CB 3.45Å; D120-Y124 PolarHBondContact O-N 3.45Å
121	F	95.2	Very high	96.2	Very high	12 Å²	12	52.6 Å²	52.6	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-55.8	-44.6	176.1	173.4	-112.7	0	0	0	112.8	Y124 I125 W242 L247 T249 I291 I363 F385	F121-Y124 PolarHBondContact O-N 3.06Å; F121-I125 HydrophobicContact CD2-CG1 4.18Å; F121-I125 HydrophobicContact CE1-CG1 4.31Å; F121-I125 HydrophobicContact CE2-CD1 3.87Å; F121-I125 HydrophobicContact CE2-CG1 3.74Å; F121-I125 HydrophobicContact CZ-CD1 4.11Å; F121-I125 HydrophobicContact CZ-CG1 3.83Å; F121-I125 WeakPolarHBondContact O-CG1 3.36Å; F121-I125 PolarHBondContact O-N 3.02Å; F121-W242 AromaticContact CD2-CD2 3.66Å; F121-W242 HydrophobicContact CD2-CD2 3.66Å; F121-W242 AromaticContact CD2-CE2 3.69Å; F121-W242 AromaticContact CD2-CE3 3.87Å; F121-W242 HydrophobicContact CD2-CE3 3.87Å; F121-W242 HydrophobicContact CD2-CG 4.2Å; F121-W242 HydrophobicContact CD2-CH2 4.04Å; F121-W242 AromaticContact CD2-CZ2 3.9Å; F121-W242 HydrophobicContact CD2-CZ2 3.9Å; F121-W242 HydrophobicContact CD2-CZ3 4.04Å; F121-W242 HydrophobicContact CE2-CD2 4.34Å; F121-W242 HydrophobicContact CE2-CE3 4.08Å; F121-W242 HydrophobicContact CE2-CH2 4.23Å; F121-W242 HydrophobicContact CE2-CZ3 4.01Å; F121-L247 HydrophobicContact CD1-CB 4.12Å; F121-L247 HydrophobicContact CD1-CD2 4.09Å; F121-L247 HydrophobicContact CE1-CB 4.04Å; F121-L247 HydrophobicContact CE1-CD1 4.36Å; F121-L247 HydrophobicContact CE1-CD2 4.01Å; F121-L247 HydrophobicContact CE1-CG 4.37Å; F121-L247 HydrophobicContact CE2-CD2 4.48Å; F121-L247 HydrophobicContact CG-CD2 4.35Å; F121-L247 HydrophobicContact CZ-CD2 4.21Å; F121-T249 HydrophobicContact CD1-CG2 4.22Å; F121-T249 HydrophobicContact CE1-CG2 3.94Å; F121-I291 HydrophobicContact CE2-CD1 3.86Å; F121-I291 HydrophobicContact CZ-CD1 4.32Å; F121-I363 HydrophobicContact CE2-CD1 4.28Å; F121-F385 HydrophobicContact CE1-CD1 4.44Å; F121-F385 AromaticContact CE1-CD2 3.9Å; F121-F385 HydrophobicContact CE1-CD2 3.9Å; F121-F385 HydrophobicContact CE1-CE2 4.04Å; F121-F385 HydrophobicContact CE1-CG 4.11Å; F121-F385 HydrophobicContact CE1-CZ 4.37Å; F121-F385 AromaticContact CZ-CD1 3.99Å; F121-F385 HydrophobicContact CZ-CD1 3.99Å; F121-F385 AromaticContact CZ-CD2 3.98Å; F121-F385 HydrophobicContact CZ-CD2 3.98Å; F121-F385 AromaticContact CZ-CE1 3.76Å; F121-F385 HydrophobicContact CZ-CE1 3.76Å; F121-F385 AromaticContact CZ-CE2 3.76Å; F121-F385 HydrophobicContact CZ-CE2 3.76Å; F121-F385 HydrophobicContact CZ-CG 4.1Å; F121-F385 AromaticContact CZ-CZ 3.64Å; F121-F385 HydrophobicContact CZ-CZ 3.64Å
122	A	92.9	Very high	96.1	Very high	35 Å²	35	52 Å²	52	29%	0.289	25%	0.252	S	S	.	.	H	α-helix	trans	-69.2	-42.7	-175.2	0	0	0	0	0	111.3	D120 Y124 I125 V126 L443	D120-A122 VanDerWaalsContact C-N 3.34Å; D120-A122 PolarHBondContact O-N 2.92Å; D120-A122 PolarHBondContact OD1-N 3.27Å; A122-Y124 VanDerWaalsContact C-N 3.35Å; A122-I125 PolarHBondContact O-N 2.9Å; A122-V126 WeakPolarHBondContact O-CG2 3.37Å; A122-V126 PolarHBondContact O-N 3.24Å; A122-V126 VanDerWaalsContact O-N 3.12Å; A122-L443 HydrophobicContact CB-CD1 3.87Å
123	Q	94.2	Very high	96	Very high	94 Å²	94	43.4 Å²	43.4	44%	0.439	22%	0.22	S	C	.	.	H	α-helix	trans	-64.3	-37.9	174	-179.7	60.1	13.3	0	0	111.9	D120 V126 Y127 L443	D120-Q123 HydrophobicContact CB-CB 3.85Å; D120-Q123 VanDerWaalsContact CG-CB 3.4Å; D120-Q123 PolarHBondContact O-N 3.46Å; D120-Q123 PolarHBondContact OD1-N 3.04Å; Q123-V126 WeakPolarHBondContact O-CB 3.43Å; Q123-V126 PolarHBondContact O-N 3.21Å; Q123-Y127 PolarHBondContact O-N 2.9Å; Q123-L443 HydrophobicContact CB-CD1 4.39Å
124	Y	97.4	Very high	96.1	Very high	10 Å²	10	43.2 Å²	43.2	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-35.5	177.7	-154.8	-99.8	0	0	0	112.8	F111 P113 E117 D120 F121 A122 Y127 M128 V141 W242	F111-Y124 HydrophobicContact CB-CE1 4.01Å; F111-Y124 HydrophobicContact CD1-CE1 4.45Å; F111-Y124 HydrophobicContact CG-CE1 4.38Å; P113-Y124 HydrophobicContact CB-CD2 4.31Å; P113-Y124 HydrophobicContact CB-CE1 4.26Å; P113-Y124 HydrophobicContact CB-CE2 3.68Å; P113-Y124 HydrophobicContact CG-CE1 4.2Å; P113-Y124 HydrophobicContact CG-CE2 4.49Å; E117-Y124 HydrophobicContact CB-CD2 3.9Å; E117-Y124 HydrophobicContact CB-CE2 3.79Å; D120-Y124 WeakPolarHBondContact O-CB 3.45Å; D120-Y124 PolarHBondContact O-N 3.45Å; F121-Y124 PolarHBondContact O-N 3.06Å; A122-Y124 VanDerWaalsContact C-N 3.35Å; Y124-Y127 HydrophobicContact CD2-CD1 4.03Å; Y124-Y127 HydrophobicContact CE1-CD1 4.41Å; Y124-Y127 AromaticContact CE2-CD1 3.57Å; Y124-Y127 HydrophobicContact CE2-CD1 3.57Å; Y124-Y127 AromaticContact CE2-CE1 3.94Å; Y124-Y127 HydrophobicContact CE2-CE1 3.94Å; Y124-Y127 AromaticContact CZ-CD1 3.8Å; Y124-Y127 AromaticContact CZ-CE1 3.96Å; Y124-Y127 WeakPolarHBondContact O-CB 3.29Å; Y124-Y127 PolarHBondContact O-N 2.75Å; Y124-M128 HydrophobicContact CD1-CG 3.9Å; Y124-M128 HydrophobicContact CD1-SD 3.66Å; Y124-M128 HydrophobicContact CE1-CG 3.84Å; Y124-M128 HydrophobicContact CE1-SD 3.84Å; Y124-M128 VanDerWaalsContact O-CG 3.31Å; Y124-M128 WeakPolarHBondContact O-CG 3.44Å; Y124-M128 PolarHBondContact O-N 3.47Å; Y124-V141 HydrophobicContact CE1-CG1 4.17Å; Y124-W242 AromaticContact CD1-CH2 3.99Å; Y124-W242 HydrophobicContact CD1-CH2 3.99Å; Y124-W242 AromaticContact CD1-CZ2 3.71Å; Y124-W242 HydrophobicContact CD1-CZ2 3.71Å; Y124-W242 HydrophobicContact CG-CZ2 4.09Å
125	I	97.5	Very high	96.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-43.8	171.2	-68	-65.5	0	0	0	111	F121 A122 Y127 M128 E129 Y289 I363 F385 T387	F121-I125 HydrophobicContact CD2-CG1 4.18Å; F121-I125 HydrophobicContact CE1-CG1 4.31Å; F121-I125 HydrophobicContact CE2-CD1 3.87Å; F121-I125 HydrophobicContact CE2-CG1 3.74Å; F121-I125 HydrophobicContact CZ-CD1 4.11Å; F121-I125 HydrophobicContact CZ-CG1 3.83Å; F121-I125 WeakPolarHBondContact O-CG1 3.36Å; F121-I125 PolarHBondContact O-N 3.02Å; A122-I125 PolarHBondContact O-N 2.9Å; I125-Y127 VanDerWaalsContact C-N 3.32Å; I125-Y127 PolarHBondContact O-N 2.88Å; I125-M128 HydrophobicContact CD1-SD 4.25Å; I125-M128 PolarHBondContact O-N 2.82Å; I125-E129 WeakPolarHBondContact O-CG 3.42Å; I125-E129 PolarHBondContact O-N 3.49Å; I125-Y289 HydrophobicContact CG2-CE1 4.48Å; I125-I363 HydrophobicContact CD1-CD1 4.13Å; I125-I363 HydrophobicContact CD1-CG1 4.1Å; I125-I363 HydrophobicContact CD1-CG2 4.01Å; I125-F385 HydrophobicContact CD1-CE2 4.22Å; I125-F385 HydrophobicContact CD1-CZ 3.84Å; I125-F385 HydrophobicContact CG1-CE2 4.11Å; I125-F385 HydrophobicContact CG1-CZ 4.22Å; I125-F385 HydrophobicContact CG2-CE2 4.33Å; I125-T387 HydrophobicContact CG2-CG2 3.98Å
126	V	96.1	Very high	96.2	Very high	27 Å²	27	38.1 Å²	38.1	16%	0.164	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-44.3	173.7	171	0	0	0	0	110.9	A122 Q123 E129 S130 T441 L443	A122-V126 WeakPolarHBondContact O-CG2 3.37Å; A122-V126 PolarHBondContact O-N 3.24Å; A122-V126 VanDerWaalsContact O-N 3.12Å; Q123-V126 WeakPolarHBondContact O-CB 3.43Å; Q123-V126 PolarHBondContact O-N 3.21Å; V126-E129 PolarHBondContact O-N 3.36Å; V126-S130 PolarHBondContact O-N 3.36Å; V126-T441 HydrophobicContact CG2-CG2 3.94Å; V126-L443 HydrophobicContact CG2-CB 3.98Å; V126-L443 HydrophobicContact CG2-CD1 4.1Å
127	Y	97.5	Very high	96.3	Very high	90 Å²	90	32.1 Å²	32.1	35%	0.353	16%	0.16	S	C	.	.	H	α-helix	trans	-61.3	-46.1	175	169.5	-110.5	0	0	0	112.5	F111 Q123 Y124 I125 E129 S130 Q131	F111-Y127 HydrophobicContact CD1-CE1 4.03Å; F111-Y127 HydrophobicContact CE1-CE1 4.07Å; Q123-Y127 PolarHBondContact O-N 2.9Å; Y124-Y127 HydrophobicContact CD2-CD1 4.03Å; Y124-Y127 HydrophobicContact CE1-CD1 4.41Å; Y124-Y127 AromaticContact CE2-CD1 3.57Å; Y124-Y127 HydrophobicContact CE2-CD1 3.57Å; Y124-Y127 AromaticContact CE2-CE1 3.94Å; Y124-Y127 HydrophobicContact CE2-CE1 3.94Å; Y124-Y127 AromaticContact CZ-CD1 3.8Å; Y124-Y127 AromaticContact CZ-CE1 3.96Å; Y124-Y127 WeakPolarHBondContact O-CB 3.29Å; Y124-Y127 PolarHBondContact O-N 2.75Å; I125-Y127 VanDerWaalsContact C-N 3.32Å; I125-Y127 PolarHBondContact O-N 2.88Å; Y127-E129 VanDerWaalsContact C-N 3.34Å; Y127-E129 PolarHBondContact O-N 3.27Å; Y127-S130 WeakPolarHBondContact O-CB 3.49Å; Y127-S130 PolarHBondContact O-N 3.49Å; Y127-S130 VanDerWaalsContact O-N 3.12Å; Y127-S130 PolarHBondContact O-OG 3.1Å; Y127-Q131 HydrophobicContact CE2-CG 4.03Å; Y127-Q131 PolarHBondContact O-N 2.96Å
128	M	97.9	Very high	96.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-42.6	177.4	-71.1	171.3	62.5	0	0	112.1	F111 Y124 I125 Q131 G132 A133 A139 V141 I363 F365	F111-M128 HydrophobicContact CD1-CG 4.02Å; F111-M128 HydrophobicContact CD2-CE 3.78Å; F111-M128 HydrophobicContact CD2-CG 3.88Å; F111-M128 HydrophobicContact CD2-SD 4.29Å; F111-M128 HydrophobicContact CE1-CB 4.41Å; F111-M128 HydrophobicContact CE1-CG 3.96Å; F111-M128 HydrophobicContact CE2-CB 4.11Å; F111-M128 HydrophobicContact CE2-CE 3.94Å; F111-M128 HydrophobicContact CE2-CG 3.81Å; F111-M128 HydrophobicContact CG-CG 3.98Å; F111-M128 HydrophobicContact CZ-CB 3.99Å; F111-M128 HydrophobicContact CZ-CG 3.86Å; Y124-M128 HydrophobicContact CD1-CG 3.9Å; Y124-M128 HydrophobicContact CD1-SD 3.66Å; Y124-M128 HydrophobicContact CE1-CG 3.84Å; Y124-M128 HydrophobicContact CE1-SD 3.84Å; Y124-M128 VanDerWaalsContact O-CG 3.31Å; Y124-M128 WeakPolarHBondContact O-CG 3.44Å; Y124-M128 PolarHBondContact O-N 3.47Å; I125-M128 HydrophobicContact CD1-SD 4.25Å; I125-M128 PolarHBondContact O-N 2.82Å; M128-Q131 PolarHBondContact O-N 3.22Å; M128-G132 PolarHBondContact O-N 2.93Å; M128-A133 HydrophobicContact CB-CB 4.1Å; M128-A133 WeakPolarHBondContact O-CB 3.44Å; M128-A133 PolarHBondContact O-N 3.4Å; M128-A133 VanDerWaalsContact O-N 3.11Å; M128-A139 HydrophobicContact CE-CB 3.65Å; M128-V141 HydrophobicContact CE-CG2 3.53Å; M128-V141 HydrophobicContact SD-CG2 3.58Å; M128-V141 VanDerWaalsContact SD-CG2 3.58Å; M128-I363 HydrophobicContact CE-CB 4.32Å; M128-I363 HydrophobicContact CE-CG1 4.1Å; M128-F365 HydrophobicContact CE-CZ 4.28Å
129	E	97.6	Very high	96.6	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-68.8	-33.9	175.2	-60.5	-148.8	152.5	0	0	112.6	I125 V126 Y127 Q131 G132 H134 Y289 F365 R389 A440 T441	I125-E129 WeakPolarHBondContact O-CG 3.42Å; I125-E129 PolarHBondContact O-N 3.49Å; V126-E129 PolarHBondContact O-N 3.36Å; Y127-E129 VanDerWaalsContact C-N 3.34Å; Y127-E129 PolarHBondContact O-N 3.27Å; E129-Q131 PolarHBondContact O-N 3.33Å; E129-G132 PolarHBondContact O-N 3Å; E129-H134 HydrophobicContact CG-CB 4Å; E129-H134 PolarHBondContact O-CE1 3.39Å; E129-H134 PolarHBondContact O-ND1 3.4Å; E129-H134 WeakPolarHBondContact OE1-CB 3.43Å; E129-H134 IonicContact OE1-CG 3.23Å; E129-Y289 WeakPolarHBondContact OE1-CE1 3.42Å; E129-Y289 PolarHBondContact OE1-OH 2.92Å; E129-Y289 VanDerWaalsContact OE1-OH 3.06Å; E129-F365 HydrophobicContact CG-CD1 4.46Å; E129-F365 HydrophobicContact CG-CE1 3.87Å; E129-F365 VanDerWaalsContact OE1-CD1 3.23Å; E129-F365 WeakPolarHBondContact OE1-CD1 3.41Å; E129-F365 WeakPolarHBondContact OE1-CE1 3.36Å; E129-R389 IonicContact OE1-CZ 2.7Å; E129-R389 VanDerWaalsContact OE1-CZ 3.28Å; E129-R389 IonicContact OE1-NE 3.64Å; E129-R389 PolarHBondContact OE1-NE 2.83Å; E129-R389 VanDerWaalsContact OE1-NE 3.11Å; E129-R389 IonicContact OE1-NH2 2.65Å; E129-R389 PolarHBondContact OE1-NH2 3.43Å; E129-R389 WeakPolarHBondContact OE2-CD 3.38Å; E129-R389 IonicContact OE2-CZ 2.92Å; E129-R389 IonicContact OE2-NE 3.78Å; E129-R389 PolarHBondContact OE2-NE 3.2Å; E129-R389 IonicContact OE2-NH2 3.76Å; E129-A440 HydrophobicContact CB-CB 3.67Å; E129-T441 HydrophobicContact CG-CG2 4.28Å; E129-T441 VanDerWaalsContact OE2-CB 3.29Å; E129-T441 WeakPolarHBondContact OE2-CB 3.27Å; E129-T441 WeakPolarHBondContact OE2-CG2 3.41Å; E129-T441 PolarHBondContact OE2-N 3.2Å
130	S	95.7	Very high	96.8	Very high	51 Å²	51	23.6 Å²	23.6	36%	0.357	12%	0.122	S	C	.	.	H	α-helix	trans	-60.7	-24.9	173.6	82.4	0	0	0	0	113.4	V126 Y127	V126-S130 PolarHBondContact O-N 3.36Å; Y127-S130 WeakPolarHBondContact O-CB 3.49Å; Y127-S130 PolarHBondContact O-N 3.49Å; Y127-S130 VanDerWaalsContact O-N 3.12Å; Y127-S130 PolarHBondContact O-OG 3.1Å
131	Q	97.2	Very high	97.1	Very high	52 Å²	52	19.8 Å²	19.8	24%	0.243	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	0.8	173.4	-53.9	-45.7	-48.2	0	0	113.8	M109 F111 Y127 M128 E129	M109-Q131 HydrophobicContact CE-CB 3.92Å; F111-Q131 HydrophobicContact CE1-CB 4.43Å; F111-Q131 HydrophobicContact CE1-CG 4.45Å; F111-Q131 HydrophobicContact CZ-CB 4.37Å; Y127-Q131 HydrophobicContact CE2-CG 4.03Å; Y127-Q131 PolarHBondContact O-N 2.96Å; M128-Q131 PolarHBondContact O-N 3.22Å; E129-Q131 PolarHBondContact O-N 3.33Å
132	G	96.6	Very high	97.2	Very high	2 Å²	2	20.7 Å²	20.7	2%	0.021	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	19.4	177.7	0	0	0	0	0	114.9	N103 M128 E129 H134 R135	N103-G132 VanDerWaalsContact CB-O 3.24Å; N103-G132 WeakPolarHBondContact CB-O 3.39Å; N103-G132 PolarHBondContact ND2-O 3.15Å; M128-G132 PolarHBondContact O-N 2.93Å; E129-G132 PolarHBondContact O-N 3Å; G132-H134 VanDerWaalsContact C-N 3.29Å; G132-H134 PolarHBondContact O-N 3.2Å; G132-R135 WeakPolarHBondContact O-CB 3.12Å; G132-R135 PolarHBondContact O-N 2.74Å
133	A	97.8	Very high	97.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-60.2	-38.7	-179.2	0	0	0	0	0	112.8	M109 F111 M128 R135 A136 A139 F365	M109-A133 HydrophobicContact CB-CB 4.41Å; M109-A133 HydrophobicContact SD-CB 4.17Å; F111-A133 HydrophobicContact CE2-CB 3.7Å; F111-A133 HydrophobicContact CZ-CB 3.9Å; M128-A133 HydrophobicContact CB-CB 4.1Å; M128-A133 WeakPolarHBondContact O-CB 3.44Å; M128-A133 PolarHBondContact O-N 3.4Å; M128-A133 VanDerWaalsContact O-N 3.11Å; A133-R135 PolarHBondContact O-N 3.07Å; A133-A136 PolarHBondContact O-N 3.32Å; A133-A136 VanDerWaalsContact O-N 3.16Å; A133-A139 HydrophobicContact CB-CB 4.12Å; A133-F365 HydrophobicContact CB-CE2 4.4Å; A133-F365 HydrophobicContact CB-CZ 3.96Å
134	H	97.9	Very high	97.6	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.019	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-59	-29.2	-178.3	58	-62	0	0	0	114.2	E129 G132 A136 G137 F365 H437 L438 K439	E129-H134 HydrophobicContact CG-CB 4Å; E129-H134 PolarHBondContact O-CE1 3.39Å; E129-H134 PolarHBondContact O-ND1 3.4Å; E129-H134 WeakPolarHBondContact OE1-CB 3.43Å; E129-H134 IonicContact OE1-CG 3.23Å; G132-H134 VanDerWaalsContact C-N 3.29Å; G132-H134 PolarHBondContact O-N 3.2Å; H134-A136 PolarHBondContact O-N 3.42Å; H134-G137 PolarHBondContact O-N 3.25Å; H134-F365 VanDerWaalsContact CA-CD1 3.49Å; H134-F365 HydrophobicContact CB-CB 4.33Å; H134-F365 HydrophobicContact CB-CD1 3.4Å; H134-F365 HydrophobicContact CB-CE1 3.75Å; H134-F365 HydrophobicContact CB-CG 3.88Å; H134-F365 HydrophobicContact CB-CZ 4.47Å; H134-H437 PolarHBondContact CD2-O 3.4Å; H134-L438 PolarHBondContact NE2-O 3.46Å; H134-K439 PolarHBondContact NE2-O 2.81Å
135	R	97.2	Very high	97.4	Very high	21 Å²	21	25.2 Å²	25.2	8%	0.079	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-62.8	-27.7	179.2	-63.4	-168.7	62.6	-170.3	-1.4	113.5	K102 N103 C106 G132 A133 G137 P306 P307 E308 L438	K102-R135 WeakPolarHBondContact O-CD 3.27Å; K102-R135 PolarHBondContact O-NH1 2.94Å; K102-R135 VanDerWaalsContact O-NH1 3.11Å; N103-R135 PolarHBondContact O-NH1 2.88Å; C106-R135 HydrophobicContact CB-CB 4.35Å; C106-R135 VanDerWaalsContact SG-CZ 3.58Å; C106-R135 PolarHBondContact SG-NH2 2.78Å; G132-R135 WeakPolarHBondContact O-CB 3.12Å; G132-R135 PolarHBondContact O-N 2.74Å; A133-R135 PolarHBondContact O-N 3.07Å; R135-G137 VanDerWaalsContact C-N 3.28Å; R135-P306 VanDerWaalsContact O-CB 3.27Å; R135-P306 WeakPolarHBondContact O-CB 3.34Å; R135-P307 WeakPolarHBondContact O-CD 3.49Å; R135-E308 IonicContact CZ-OE2 3.71Å; R135-E308 IonicContact NE-OE2 2.63Å; R135-E308 PolarHBondContact NE-OE2 3.04Å; R135-E308 IonicContact NH2-OE1 3.91Å; R135-E308 PolarHBondContact NH2-OE1 2.89Å; R135-E308 IonicContact NH2-OE2 2.72Å; R135-E308 PolarHBondContact NH2-OE2 2.89Å; R135-L438 VanDerWaalsContact NE-CD2 3.26Å
136	A	97.6	Very high	96.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-72.6	-22.6	175.1	0	0	0	0	0	112.9	C106 K107 I108 A133 H134 L138 T304	C106-A136 WeakPolarHBondContact O-CA 3.44Å; K107-A136 WeakPolarHBondContact O-CB 3.37Å; I108-A136 HydrophobicContact CG1-CB 4.4Å; A133-A136 PolarHBondContact O-N 3.32Å; A133-A136 VanDerWaalsContact O-N 3.16Å; H134-A136 PolarHBondContact O-N 3.42Å; A136-L138 WeakPolarHBondContact CB-O 3.25Å; A136-L138 PolarHBondContact O-N 3.17Å; A136-T304 WeakPolarHBondContact O-CG2 2.99Å; A136-T304 PolarHBondContact O-OG1 2.88Å
137	G	97.4	Very high	96.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	83.4	-14.8	-169.1	0	0	0	0	0	114	H134 R135 F365	H134-G137 PolarHBondContact O-N 3.25Å; R135-G137 VanDerWaalsContact C-N 3.28Å; G137-F365 PolarHBondContact O-N 3.25Å
138	L	98.6	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	140.4	-177.4	-174.3	72	0	0	0	110.8	I108 A136 W302 T304 I354 M362 I363 T364	I108-L138 HydrophobicContact CD1-CD2 4.15Å; I108-L138 HydrophobicContact CG1-CB 4.46Å; A136-L138 WeakPolarHBondContact CB-O 3.25Å; A136-L138 PolarHBondContact O-N 3.17Å; L138-W302 HydrophobicContact CD1-CD2 4.43Å; L138-W302 HydrophobicContact CD1-CE3 3.95Å; L138-W302 HydrophobicContact CD1-CZ3 4.31Å; L138-W302 HydrophobicContact CD2-CB 3.63Å; L138-W302 HydrophobicContact CD2-CD2 4.4Å; L138-W302 HydrophobicContact CD2-CE3 4.33Å; L138-W302 HydrophobicContact CD2-CG 4.17Å; L138-T304 HydrophobicContact CB-CG2 3.84Å; L138-T304 HydrophobicContact CD2-CG2 4.44Å; L138-I354 HydrophobicContact CD2-CG2 3.96Å; L138-M362 HydrophobicContact CD1-CB 4.45Å; L138-M362 HydrophobicContact CD1-CE 3.72Å; L138-M362 HydrophobicContact CD2-CE 3.71Å; L138-M362 HydrophobicContact CG-CE 3.54Å; L138-I363 CarbonylContact C-O 3.59Å; L138-I363 WeakPolarHBondContact CA-O 3.44Å; L138-T364 HydrophobicContact CD1-CG2 3.89Å
139	A	98.8	Very high	96.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	156.5	169.7	0	0	0	0	0	111.5	M109 F111 M128 A133 M362 I363 F365	M109-A139 WeakPolarHBondContact O-CA 3.36Å; F111-A139 HydrophobicContact CE2-CB 4.34Å; M128-A139 HydrophobicContact CE-CB 3.65Å; A133-A139 HydrophobicContact CB-CB 4.12Å; A139-M362 WeakPolarHBondContact O-CA 3.3Å; A139-M362 WeakPolarHBondContact O-CE 3.35Å; A139-I363 PolarHBondContact N-O 3.01Å; A139-I363 PolarHBondContact O-N 2.58Å; A139-F365 HydrophobicContact CB-CE2 3.7Å; A139-F365 HydrophobicContact CB-CZ 4.18Å
140	K	98.8	Very high	96.3	Very high	15 Å²	15	32.7 Å²	32.7	7%	0.065	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142	171.8	178.4	-174.9	-70.9	-163.7	0	110	M109 T110 F111 I142 I354 T355 E360 F361 M362	M109-K140 PolarHBondContact O-N 3.35Å; T110-K140 WeakPolarHBondContact CA-O 3.44Å; T110-K140 HydrophobicContact CG2-CB 4.25Å; T110-K140 HydrophobicContact CG2-CD 3.79Å; T110-K140 HydrophobicContact CG2-CG 4.13Å; F111-K140 PolarHBondContact N-O 3.07Å; K140-I142 HydrophobicContact CD-CD1 4.06Å; K140-I142 HydrophobicContact CD-CG1 3.84Å; K140-I142 HydrophobicContact CG-CG1 4.14Å; K140-I354 HydrophobicContact CB-CD1 4.06Å; K140-I354 HydrophobicContact CD-CD1 4.36Å; K140-T355 WeakPolarHBondContact CE-O 3.23Å; K140-T355 PolarHBondContact NZ-O 3.18Å; K140-E360 HydrophobicContact CD-CG 4.5Å; K140-E360 WeakPolarHBondContact CD-OE2 3.47Å; K140-E360 WeakPolarHBondContact CE-OE2 3.2Å; K140-E360 IonicContact NZ-OE1 3.44Å; K140-E360 PolarHBondContact NZ-OE1 3.42Å; K140-E360 IonicContact NZ-OE2 3.39Å; K140-E360 PolarHBondContact NZ-OE2 3.38Å; K140-F361 WeakPolarHBondContact CA-O 3.29Å; K140-M362 HydrophobicContact CB-CE 4.18Å; K140-M362 HydrophobicContact CB-SD 3.67Å; K140-M362 HydrophobicContact CG-SD 3.91Å
141	V	98.8	Very high	96	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	125.4	165.7	-169	0	0	0	0	108.5	F111 P113 Y124 M128 W242 F361 I363	F111-V141 HydrophobicContact CB-CG1 4.31Å; F111-V141 HydrophobicContact CB-CG2 4.3Å; P113-V141 HydrophobicContact CG-CG1 3.85Å; Y124-V141 HydrophobicContact CE1-CG1 4.17Å; M128-V141 HydrophobicContact CE-CG2 3.53Å; M128-V141 HydrophobicContact SD-CG2 3.58Å; M128-V141 VanDerWaalsContact SD-CG2 3.58Å; V141-W242 HydrophobicContact CB-CH2 4.18Å; V141-W242 HydrophobicContact CB-CZ3 4.17Å; V141-W242 HydrophobicContact CG1-CH2 3.97Å; V141-W242 HydrophobicContact CG1-CZ3 4.28Å; V141-W242 HydrophobicContact CG2-CH2 3.91Å; V141-W242 HydrophobicContact CG2-CZ3 4.13Å; V141-F361 HydrophobicContact CB-CB 4.17Å; V141-F361 PolarHBondContact N-O 3.46Å; V141-F361 WeakPolarHBondContact O-CB 3.39Å; V141-F361 PolarHBondContact O-N 2.72Å; V141-I363 HydrophobicContact CG2-CG1 4.33Å
142	I	98.5	Very high	95.6	Very high	30 Å²	30	38.8 Å²	38.8	15%	0.154	21%	0.205	C	C	.	.			trans	-101.3	115.1	174.7	-56.5	173.9	0	0	0	105.8	T110 F111 R112 P113 K140 E360	T110-I142 HydrophobicContact CG2-CD1 3.73Å; T110-I142 HydrophobicContact CG2-CG1 4.13Å; F111-I142 PolarHBondContact O-N 3.19Å; R112-I142 HydrophobicContact CG-CB 4.35Å; P113-I142 WeakPolarHBondContact CD-O 3.4Å; K140-I142 HydrophobicContact CD-CD1 4.06Å; K140-I142 HydrophobicContact CD-CG1 3.84Å; K140-I142 HydrophobicContact CG-CG1 4.14Å; I142-E360 HydrophobicContact CG1-CG 4.16Å
143	P	97.9	Very high	95.5	Very high	20 Å²	20	41 Å²	41	13%	0.13	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-66.4	166.9	-173.5	28.7	-34.8	0	0	0	112.2	F118 W147 G359 F361	F118-P143 HydrophobicContact CE1-CB 4.46Å; F118-P143 HydrophobicContact CE2-CB 3.9Å; F118-P143 HydrophobicContact CZ-CB 3.84Å; P143-W147 HydrophobicContact CB-CD2 4.33Å; P143-W147 HydrophobicContact CB-CE3 3.63Å; P143-W147 HydrophobicContact CB-CZ3 4.21Å; P143-W147 HydrophobicContact CG-CE3 3.83Å; P143-W147 HydrophobicContact CG-CZ3 4.19Å; P143-G359 WeakPolarHBondContact CD-O 3.4Å; P143-G359 VanDerWaalsContact CG-O 3.23Å; P143-G359 WeakPolarHBondContact CG-O 3.22Å; P143-F361 HydrophobicContact CB-CE2 4.21Å; P143-F361 HydrophobicContact CG-CD2 4.43Å; P143-F361 HydrophobicContact CG-CE2 4.31Å
144	P	97.3	Very high	94.9	Very high	14 Å²	14	47 Å²	47	9%	0.091	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-57.2	144.1	177.5	-21.4	31.9	0	0	0	112.1	M115 F118 G146 W147	M115-P144 HydrophobicContact CB-CB 4.42Å; M115-P144 HydrophobicContact CB-CG 4.42Å; M115-P144 HydrophobicContact CE-CB 4.19Å; M115-P144 HydrophobicContact SD-CG 4.33Å; F118-P144 HydrophobicContact CB-CG 3.65Å; F118-P144 HydrophobicContact CD1-CG 4.15Å; F118-P144 HydrophobicContact CD2-CG 4.45Å; F118-P144 HydrophobicContact CG-CG 3.85Å; P144-G146 PolarHBondContact O-N 3.03Å; P144-W147 WeakPolarHBondContact O-CB 3.38Å; P144-W147 PolarHBondContact O-N 3.46Å
145	E	91.8	Very high	94.2	Very high	201 Å²	201	52.2 Å²	52.2	94%	0.939	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	134.2	176.5	-172.5	167.3	-166.4	0	0	110.9	W147	E145-W147 VanDerWaalsContact C-N 3.33Å
146	G	88	Confident	93.9	Very high	73 Å²	73	51.9 Å²	51.9	75%	0.753	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-17.4	-173.6	0	0	0	0	0	115.2	P144	P144-G146 PolarHBondContact O-N 3.03Å
147	W	95.2	Very high	93.6	Very high	22 Å²	22	54.3 Å²	54.3	8%	0.083	29%	0.288	C	S	.	.			trans	-70.4	134.3	170.8	-175.6	85.6	0	0	0	110.8	M115 F118 P143 P144 E145 P149 Y235 I239 E241 Y293 F361	M115-W147 HydrophobicContact CE-CB 4.06Å; F118-W147 HydrophobicContact CD1-CG 4.46Å; F118-W147 AromaticContact CE1-CD1 3.89Å; F118-W147 AromaticContact CE1-CD2 3.68Å; F118-W147 HydrophobicContact CE1-CD2 3.68Å; F118-W147 AromaticContact CE1-CE2 3.56Å; F118-W147 HydrophobicContact CE1-CE3 4.25Å; F118-W147 AromaticContact CE1-CG 3.92Å; F118-W147 HydrophobicContact CE1-CG 3.92Å; F118-W147 HydrophobicContact CE1-CZ2 4.03Å; F118-W147 AromaticContact CE1-NE1 3.69Å; F118-W147 HydrophobicContact CZ-CD2 4.11Å; F118-W147 HydrophobicContact CZ-CE3 4.22Å; F118-W147 HydrophobicContact CZ-CH2 4.34Å; F118-W147 HydrophobicContact CZ-CZ2 4.25Å; F118-W147 HydrophobicContact CZ-CZ3 4.33Å; P143-W147 HydrophobicContact CB-CD2 4.33Å; P143-W147 HydrophobicContact CB-CE3 3.63Å; P143-W147 HydrophobicContact CB-CZ3 4.21Å; P143-W147 HydrophobicContact CG-CE3 3.83Å; P143-W147 HydrophobicContact CG-CZ3 4.19Å; P144-W147 WeakPolarHBondContact O-CB 3.38Å; P144-W147 PolarHBondContact O-N 3.46Å; E145-W147 VanDerWaalsContact C-N 3.33Å; W147-P149 HydrophobicContact CH2-CB 3.63Å; W147-P149 HydrophobicContact CH2-CG 3.84Å; W147-P149 HydrophobicContact CZ2-CB 3.95Å; W147-P149 HydrophobicContact CZ3-CB 4.36Å; W147-P149 HydrophobicContact CZ3-CG 4.11Å; W147-Y235 HydrophobicContact CH2-CE1 4.07Å; W147-Y235 HydrophobicContact CZ2-CE1 4.16Å; W147-I239 HydrophobicContact CZ2-CG2 4.15Å; W147-E241 WeakPolarHBondContact CZ2-O 3.35Å; W147-Y293 AromaticContact CZ3-CE2 3.81Å; W147-Y293 HydrophobicContact CZ3-CE2 3.81Å; W147-Y293 AromaticContact CZ3-CZ 3.97Å; W147-F361 HydrophobicContact CE3-CE2 4.49Å; W147-F361 AromaticContact CH2-CE2 3.87Å; W147-F361 HydrophobicContact CH2-CE2 3.87Å; W147-F361 AromaticContact CH2-CZ 3.58Å; W147-F361 HydrophobicContact CH2-CZ 3.58Å; W147-F361 AromaticContact CZ3-CE2 3.64Å; W147-F361 HydrophobicContact CZ3-CE2 3.64Å; W147-F361 AromaticContact CZ3-CZ 3.84Å; W147-F361 HydrophobicContact CZ3-CZ 3.84Å
148	K	92.4	Very high	93.3	Very high	138 Å²	138	60 Å²	60	60%	0.6	32%	0.318	S	S	*	.			trans	-144	142.7	170.1	-65.9	-173.4	178.2	-175.4	0	109.2	R150	K148-R150 VanDerWaalsContact C-N 3.32Å
149	P	94.2	Very high	93.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-82	-12.7	175.3	32.2	-31.8	0	0	0	113.2	W147 Y235 D236 Y293	W147-P149 HydrophobicContact CH2-CB 3.63Å; W147-P149 HydrophobicContact CH2-CG 3.84Å; W147-P149 HydrophobicContact CZ2-CB 3.95Å; W147-P149 HydrophobicContact CZ3-CB 4.36Å; W147-P149 HydrophobicContact CZ3-CG 4.11Å; P149-Y235 HydrophobicContact CB-CD1 3.37Å; P149-Y235 HydrophobicContact CB-CD2 4.13Å; P149-Y235 HydrophobicContact CB-CE1 3.29Å; P149-Y235 HydrophobicContact CB-CE2 4.05Å; P149-Y235 HydrophobicContact CB-CG 3.78Å; P149-Y235 HydrophobicContact CG-CE1 4.35Å; P149-Y235 CarbonylContact O-C 3.55Å; P149-Y235 WeakPolarHBondContact O-CA 3.44Å; P149-D236 PolarHBondContact O-N 3.32Å; P149-Y293 VanDerWaalsContact CD-OH 3.31Å; P149-Y293 WeakPolarHBondContact CD-OH 3.19Å; P149-Y293 HydrophobicContact CG-CD1 4.18Å; P149-Y293 HydrophobicContact CG-CE1 3.42Å; P149-Y293 VanDerWaalsContact CG-CE1 3.42Å
150	R	94.2	Very high	92.9	Very high	44 Å²	44	66 Å²	66	17%	0.166	35%	0.352	C	S	.	.			trans	-149.8	141.8	179	170.1	155.5	-72.8	-177.7	9.3	111.3	K148 S152 Y153 I234 Y235 D236	K148-R150 VanDerWaalsContact C-N 3.32Å; R150-S152 WeakPolarHBondContact CD-O 3.44Å; R150-S152 WeakPolarHBondContact CG-O 3.5Å; R150-Y153 HydrophobicContact CB-CD1 4.46Å; R150-Y153 HydrophobicContact CB-CE1 3.76Å; R150-Y153 HydrophobicContact CG-CD1 4Å; R150-Y153 HydrophobicContact CG-CE1 3.81Å; R150-I234 WeakPolarHBondContact CB-O 3.5Å; R150-I234 WeakPolarHBondContact CD-O 3.03Å; R150-I234 PolarHBondContact NE-O 3.16Å; R150-I234 VanDerWaalsContact NE-O 3.12Å; R150-Y235 PolarHBondContact NH2-O 3.35Å; R150-D236 VanDerWaalsContact CA-OD2 3.26Å; R150-D236 WeakPolarHBondContact CA-OD2 3.35Å; R150-D236 WeakPolarHBondContact CG-OD1 3.45Å; R150-D236 IonicContact CZ-OD1 3.91Å; R150-D236 IonicContact NE-OD1 3.4Å; R150-D236 PolarHBondContact NE-OD1 2.65Å; R150-D236 IonicContact NH2-OD1 2.65Å; R150-D236 PolarHBondContact NH2-OD1 2.91Å
151	Q	89.2	Confident	92.8	Very high	178 Å²	178	65.3 Å²	65.3	83%	0.832	35%	0.349	S	S	*	.	S	Bend	trans	-74.8	-49.5	-177.7	-64.5	-174.1	31	0	0	112.9	D236	Q151-D236 PolarHBondContact N-OD2 2.93Å
152	S	90.3	Very high	92.6	Very high	53 Å²	53	68.9 Å²	68.9	37%	0.371	37%	0.372	S	S	.	.			trans	-135.9	147.9	172.3	-179.2	0	0	0	0	111.9	R150 D154	R150-S152 WeakPolarHBondContact CD-O 3.44Å; R150-S152 WeakPolarHBondContact CG-O 3.5Å; S152-D154 PolarHBondContact OG-N 2.92Å; S152-D154 VanDerWaalsContact OG-N 3.14Å; S152-D154 PolarHBondContact OG-OD2 3.39Å
153	Y	93.1	Very high	92.4	Very high	48 Å²	48	69.3 Å²	69.3	19%	0.188	38%	0.38	C	S	.	.			trans	-100.1	5.4	175	-67.4	-60.7	0	0	0	113.5	R150 T155 I156 I234 H295 F296	R150-Y153 HydrophobicContact CB-CD1 4.46Å; R150-Y153 HydrophobicContact CB-CE1 3.76Å; R150-Y153 HydrophobicContact CG-CD1 4Å; R150-Y153 HydrophobicContact CG-CE1 3.81Å; Y153-T155 VanDerWaalsContact C-N 3.33Å; Y153-T155 PolarHBondContact O-N 3.4Å; Y153-I156 WeakPolarHBondContact O-CD1 3.27Å; Y153-I156 WeakPolarHBondContact O-CG1 3.48Å; Y153-I156 PolarHBondContact O-N 3.14Å; Y153-I234 HydrophobicContact CD1-CD1 4.46Å; Y153-I234 HydrophobicContact CE1-CD1 4.22Å; Y153-H295 HydrophobicContact CE1-CB 3.95Å; Y153-H295 AromaticContact CE1-ND1 3.63Å; Y153-H295 VanDerWaalsContact CE2-O 3.32Å; Y153-H295 WeakPolarHBondContact CE2-O 3.37Å; Y153-H295 AromaticContact CZ-ND1 3.65Å; Y153-H295 PolarHBondContact OH-ND1 3Å; Y153-H295 PolarHBondContact OH-O 3.11Å; Y153-F296 AromaticContact CD1-CD1 3.82Å; Y153-F296 HydrophobicContact CD1-CD1 3.82Å; Y153-F296 HydrophobicContact CD1-CE1 4.08Å; Y153-F296 HydrophobicContact CD2-CB 4.11Å; Y153-F296 AromaticContact CD2-CD1 3.73Å; Y153-F296 HydrophobicContact CD2-CD1 3.73Å; Y153-F296 HydrophobicContact CD2-CG 4.26Å; Y153-F296 HydrophobicContact CE1-CD1 4.18Å; Y153-F296 HydrophobicContact CE2-CB 4.27Å; Y153-F296 HydrophobicContact CE2-CD1 4.08Å; Y153-F296 AromaticContact CG-CD1 3.6Å; Y153-F296 HydrophobicContact CG-CD1 3.6Å; Y153-F296 HydrophobicContact CG-CE1 4.13Å; Y153-F296 HydrophobicContact CG-CG 4.45Å
154	D	85.1	Confident	92.4	Very high	126 Å²	126	68.3 Å²	68.3	67%	0.674	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-62.7	-37.1	-172.6	-57.8	-43.3	0	0	0	113	S152 I156	S152-D154 PolarHBondContact OG-N 2.92Å; S152-D154 VanDerWaalsContact OG-N 3.14Å; S152-D154 PolarHBondContact OG-OD2 3.39Å; D154-I156 PolarHBondContact O-N 3.41Å
155	T	83.3	Confident	92.3	Very high	114 Å²	114	68.9 Å²	68.9	70%	0.699	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-72.5	-3.6	-177.4	53.9	0	0	0	0	115.1	Y153 E157	Y153-T155 VanDerWaalsContact C-N 3.33Å; Y153-T155 PolarHBondContact O-N 3.4Å; T155-E157 VanDerWaalsContact C-N 3.34Å
156	I	91.6	Very high	92.6	Very high	13 Å²	13	60.8 Å²	60.8	7%	0.067	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-83.2	-10.1	-177.6	78.1	-169.1	0	0	0	113.3	Y153 D154 D158 M159 V188 F296	Y153-I156 WeakPolarHBondContact O-CD1 3.27Å; Y153-I156 WeakPolarHBondContact O-CG1 3.48Å; Y153-I156 PolarHBondContact O-N 3.14Å; D154-I156 PolarHBondContact O-N 3.41Å; I156-D158 PolarHBondContact O-N 3.45Å; I156-M159 WeakPolarHBondContact O-CB 3.42Å; I156-M159 PolarHBondContact O-N 3.39Å; I156-M159 VanDerWaalsContact O-N 3.13Å; I156-V188 HydrophobicContact CG1-CG1 4.25Å; I156-V188 WeakPolarHBondContact O-CB 3.47Å; I156-F296 HydrophobicContact CD1-CD1 4.2Å; I156-F296 HydrophobicContact CD1-CE1 3.14Å; I156-F296 HydrophobicContact CD1-CE2 4.19Å; I156-F296 HydrophobicContact CD1-CZ 3.13Å
157	E	90.6	Very high	93.1	Very high	51 Å²	51	57.5 Å²	57.5	24%	0.238	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.7	-173	-71.4	-149.8	-145.3	0	0	112.8	T155 M159 T187 V188 G189 R192	T155-E157 VanDerWaalsContact C-N 3.34Å; E157-M159 VanDerWaalsContact C-N 3.32Å; E157-T187 VanDerWaalsContact O-CB 3.25Å; E157-T187 WeakPolarHBondContact O-CB 3.45Å; E157-T187 PolarHBondContact O-OG1 2.88Å; E157-V188 PolarHBondContact O-N 3.37Å; E157-G189 PolarHBondContact O-N 3.42Å; E157-R192 IonicContact OE1-CZ 3.42Å; E157-R192 IonicContact OE1-NH1 2.89Å; E157-R192 PolarHBondContact OE1-NH1 3.43Å; E157-R192 IonicContact OE1-NH2 3.08Å; E157-R192 PolarHBondContact OE1-NH2 2.97Å; E157-R192 IonicContact OE2-CZ 3.43Å; E157-R192 IonicContact OE2-NE 3.22Å; E157-R192 IonicContact OE2-NH1 3.17Å; E157-R192 IonicContact OE2-NH2 3.98Å; E157-R192 PolarHBondContact OE2-NH2 3.25Å
158	D	91.8	Very high	93.1	Very high	119 Å²	119	58.4 Å²	58.4	64%	0.636	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-9.8	-176.5	-51.9	-66.7	0	0	0	112.4	I156 V160	I156-D158 PolarHBondContact O-N 3.45Å; D158-V160 PolarHBondContact O-N 3.24Å
159	M	93.9	Very high	93.3	Very high	54 Å²	54	52.3 Å²	52.3	27%	0.266	29%	0.286	S	S	.	.			trans	-59.2	130	176	-157.5	-166.4	81.8	0	0	110.6	I156 E157 T187 V188 V230 I234 L270 F272	I156-M159 WeakPolarHBondContact O-CB 3.42Å; I156-M159 PolarHBondContact O-N 3.39Å; I156-M159 VanDerWaalsContact O-N 3.13Å; E157-M159 VanDerWaalsContact C-N 3.32Å; M159-T187 CarbonylContact O-C 3.54Å; M159-T187 WeakPolarHBondContact O-CA 3.41Å; M159-V188 HydrophobicContact CB-CG2 4.2Å; M159-V188 HydrophobicContact CE-CG2 4.22Å; M159-V188 WeakPolarHBondContact O-CG2 3.16Å; M159-V188 PolarHBondContact O-N 3.07Å; M159-V230 HydrophobicContact CE-CG1 4.28Å; M159-I234 HydrophobicContact SD-CG2 4.48Å; M159-L270 HydrophobicContact CE-CD1 3.77Å; M159-L270 HydrophobicContact SD-CD1 3.98Å; M159-F272 HydrophobicContact CE-CE2 3.43Å; M159-F272 VanDerWaalsContact CE-CE2 3.43Å; M159-F272 HydrophobicContact CE-CZ 3.44Å; M159-F272 VanDerWaalsContact CE-CZ 3.44Å
160	V	95.5	Very high	93.2	Very high	73 Å²	73	55.7 Å²	55.7	44%	0.442	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.7	-173.8	-179.9	0	0	0	0	111	D158 P162	D158-V160 PolarHBondContact O-N 3.24Å; V160-P162 VanDerWaalsContact O-CD 3.3Å; V160-P162 WeakPolarHBondContact O-CD 3.47Å
161	I	96.6	Very high	93.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	105.7	164.3	-53.6	176.1	0	0	0	106.8	P164 S185 M186 V188 Y191 V230 F272	I161-P164 HydrophobicContact CG2-CB 3.9Å; I161-P164 HydrophobicContact CG2-CG 4.23Å; I161-P164 WeakPolarHBondContact O-CD 3.5Å; I161-S185 VanDerWaalsContact O-CA 3.24Å; I161-S185 WeakPolarHBondContact O-CA 3.43Å; I161-M186 WeakPolarHBondContact CB-O 3.41Å; I161-M186 PolarHBondContact N-O 3.2Å; I161-M186 PolarHBondContact O-N 2.99Å; I161-V188 HydrophobicContact CD1-CG2 4.22Å; I161-V188 HydrophobicContact CG1-CG2 4.09Å; I161-Y191 HydrophobicContact CD1-CD1 4.19Å; I161-Y191 HydrophobicContact CD1-CD2 3.95Å; I161-Y191 HydrophobicContact CD1-CG 3.67Å; I161-V230 HydrophobicContact CG2-CG2 4.02Å; I161-F272 HydrophobicContact CD1-CB 3.86Å; I161-F272 HydrophobicContact CD1-CD2 3.89Å; I161-F272 HydrophobicContact CD1-CG 3.84Å; I161-F272 HydrophobicContact CG1-CD2 4.01Å; I161-F272 HydrophobicContact CG1-CE2 4.47Å; I161-F272 HydrophobicContact CG1-CG 4.44Å
162	P	94.3	Very high	93.3	Very high	75 Å²	75	54.6 Å²	54.6	49%	0.487	32%	0.315	S	S	.	.	S	Bend	trans	-76.9	-32.6	-167.5	28.2	-35.7	0	0	0	114.1	V160	V160-P162 VanDerWaalsContact O-CD 3.3Å; V160-P162 WeakPolarHBondContact O-CD 3.47Å
163	A	94.5	Very high	93.3	Very high	39 Å²	39	57 Å²	57	32%	0.322	33%	0.333	S	S	.	.	S	Bend	trans	-135.4	49.7	-171.7	0	0	0	0	0	114.4	I165 Q182	A163-I165 PolarHBondContact O-N 3.48Å; A163-Q182 HydrophobicContact CB-CG 4.31Å
164	P	96.7	Very high	93.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.328	C	S	.	.			trans	-60.8	132.6	-175.7	24.6	-31.5	0	0	0	112	I161 K183 K184 M186 I225	I161-P164 HydrophobicContact CG2-CB 3.9Å; I161-P164 HydrophobicContact CG2-CG 4.23Å; I161-P164 WeakPolarHBondContact O-CD 3.5Å; P164-K183 HydrophobicContact CG-CB 4.29Å; P164-K183 WeakPolarHBondContact O-CB 3.46Å; P164-K183 PolarHBondContact O-N 3.31Å; P164-K184 WeakPolarHBondContact CD-O 3.42Å; P164-K184 WeakPolarHBondContact CG-O 3.28Å; P164-M186 HydrophobicContact CG-CE 3.86Å; P164-M186 HydrophobicContact CG-CG 4.19Å; P164-M186 HydrophobicContact CG-SD 4.27Å; P164-I225 HydrophobicContact CB-CG2 3.81Å
165	I	97.1	Very high	93.7	Very high	25 Å²	25	50.8 Å²	50.8	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	120.1	-171.1	45.7	160.6	0	0	0	112.4	A163 Q167 N180 I225 Y226 A228	A163-I165 PolarHBondContact O-N 3.48Å; I165-Q167 PolarHBondContact O-N 3.29Å; I165-N180 HydrophobicContact CB-CB 4.15Å; I165-N180 HydrophobicContact CD1-CB 4.29Å; I165-N180 WeakPolarHBondContact CD1-ND2 3.36Å; I165-N180 HydrophobicContact CG2-CB 4.17Å; I165-I225 CarbonylContact O-C 3.58Å; I165-I225 WeakPolarHBondContact O-CA 3.24Å; I165-Y226 VanDerWaalsContact CG1-O 3.25Å; I165-Y226 WeakPolarHBondContact CG1-O 3.36Å; I165-Y226 PolarHBondContact N-O 3.18Å; I165-Y226 PolarHBondContact O-N 3.24Å; I165-A228 HydrophobicContact CD1-CB 4.19Å; I165-A228 HydrophobicContact CG1-CB 4.45Å
166	M	97.5	Very high	94.3	Very high	31 Å²	31	45.9 Å²	45.9	15%	0.153	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.3	168.8	177.3	169.6	-87	0	0	110.5	V168 I181 K183 P224 I225	M166-V168 HydrophobicContact CG-CG2 4.32Å; M166-V168 PolarHBondContact O-N 2.97Å; M166-I181 HydrophobicContact CB-CB 4.4Å; M166-I181 WeakPolarHBondContact CB-O 3.26Å; M166-I181 PolarHBondContact N-O 2.93Å; M166-I181 PolarHBondContact O-N 3.43Å; M166-K183 HydrophobicContact CB-CD 4.42Å; M166-K183 HydrophobicContact CB-CG 4.31Å; M166-K183 WeakPolarHBondContact SD-CE 3.34Å; M166-K183 PolarHBondContact SD-NZ 2.93Å; M166-P224 CarbonylContact C-O 3.57Å; M166-P224 VanDerWaalsContact CA-O 3.31Å; M166-P224 WeakPolarHBondContact CA-O 3.31Å; M166-I225 HydrophobicContact CB-CG1 4.04Å; M166-I225 HydrophobicContact CE-CD1 3.92Å; M166-I225 HydrophobicContact CE-CG1 3.75Å; M166-I225 HydrophobicContact CG-CG1 4.41Å
167	Q	97.4	Very high	94.4	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.019	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	99.6	-175.1	-62.1	-178	-34.9	0	0	109.8	I165 Q178 S223 P224 T278	I165-Q167 PolarHBondContact O-N 3.29Å; Q167-Q178 HydrophobicContact CB-CG 4.15Å; Q167-Q178 VanDerWaalsContact CD-NE2 3.34Å; Q167-S223 WeakPolarHBondContact O-CB 3.3Å; Q167-P224 HydrophobicContact CB-CG 4.32Å; Q167-P224 PolarHBondContact N-O 3.27Å; Q167-T278 PolarHBondContact NE2-O 2.97Å
168	V	96.8	Very high	94.6	Very high	41 Å²	41	44.1 Å²	44.1	25%	0.248	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.9	176.6	-178.6	0	0	0	0	108.5	M166 Q178 Y179 I181	M166-V168 HydrophobicContact CG-CG2 4.32Å; M166-V168 PolarHBondContact O-N 2.97Å; V168-Q178 CarbonylContact O-C 3.58Å; V168-Y179 PolarHBondContact N-O 2.99Å; V168-Y179 PolarHBondContact O-N 3.26Å; V168-I181 HydrophobicContact CG2-CD1 3.66Å; V168-I181 HydrophobicContact CG2-CG1 4.21Å
169	V	95.8	Very high	94.6	Very high	11 Å²	11	43.8 Å²	43.8	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	-177.9	-175.7	0	0	0	0	110.4	F176 Q178 L219 T220 L338	V169-F176 HydrophobicContact CG1-CB 3.47Å; V169-F176 VanDerWaalsContact CG1-CB 3.47Å; V169-F176 HydrophobicContact CG1-CD1 4.18Å; V169-F176 HydrophobicContact CG1-CG 4.02Å; V169-Q178 HydrophobicContact CG2-CB 4.17Å; V169-Q178 HydrophobicContact CG2-CG 4.11Å; V169-L219 HydrophobicContact CB-CG 4.25Å; V169-L219 HydrophobicContact CG1-CD2 4.04Å; V169-L219 HydrophobicContact CG1-CG 3.9Å; V169-L219 HydrophobicContact CG2-CD1 4.25Å; V169-L219 HydrophobicContact CG2-CG 4.3Å; V169-T220 HydrophobicContact CG1-CG2 4.32Å; V169-L338 HydrophobicContact CG1-CD1 3.96Å; V169-L338 HydrophobicContact CG2-CD1 4.14Å
170	T	93.1	Very high	94.6	Very high	70 Å²	70	45.2 Å²	45.2	43%	0.429	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.3	175.8	61.7	0	0	0	0	110.6	F176 T177	T170-F176 CarbonylContact O-C 3.59Å; T170-F176 WeakPolarHBondContact O-CA 3.48Å; T170-F176 WeakPolarHBondContact O-CB 3.27Å; T170-T177 PolarHBondContact N-O 2.83Å; T170-T177 PolarHBondContact O-N 3.05Å
171	G	92.6	Very high	94.5	Very high	45 Å²	45	45.8 Å²	45.8	46%	0.464	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	144.7	-172.6	-178.3	0	0	0	0	0	111.8	L175	G171-L175 CarbonylContact C-O 3.35Å; G171-L175 WeakPolarHBondContact CA-O 3.37Å
172	Q	91.8	Very high	94.4	Very high	154 Å²	154	52 Å²	52	72%	0.72	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.4	168.3	-177.7	58	-177.8	-12.7	0	0	111.7	G174 L175	Q172-G174 PolarHBondContact O-N 3.29Å; Q172-L175 PolarHBondContact N-O 2.98Å; Q172-L175 PolarHBondContact O-N 3.29Å; Q172-L175 VanDerWaalsContact O-O 3.09Å
173	S	91.3	Very high	94.5	Very high	105 Å²	105	52.1 Å²	52.1	73%	0.734	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	27.9	170.5	-55.8	0	0	0	0	115.8
174	G	90.3	Very high	94.5	Very high	9 Å²	9	59 Å²	59	9%	0.093	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	6.7	180	0	0	0	0	0	115.5	Q172 I339 S340	Q172-G174 PolarHBondContact O-N 3.29Å; G174-I339 WeakPolarHBondContact O-CA 3.39Å; G174-S340 WeakPolarHBondContact CA-OG 3.37Å; G174-S340 PolarHBondContact O-N 3.37Å
175	L	95.4	Very high	94.4	Very high	34 Å²	34	62.4 Å²	62.4	18%	0.178	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.1	175.6	-67.9	167.7	0	0	0	109.4	G171 Q172 F320 F321 I339 I343	G171-L175 CarbonylContact C-O 3.35Å; G171-L175 WeakPolarHBondContact CA-O 3.37Å; Q172-L175 PolarHBondContact N-O 2.98Å; Q172-L175 PolarHBondContact O-N 3.29Å; Q172-L175 VanDerWaalsContact O-O 3.09Å; L175-F320 HydrophobicContact CD1-CB 4.15Å; L175-F320 HydrophobicContact CD1-CD1 3.41Å; L175-F320 VanDerWaalsContact CD1-CD1 3.41Å; L175-F320 HydrophobicContact CD1-CD2 3.91Å; L175-F320 HydrophobicContact CD1-CE1 3.62Å; L175-F320 HydrophobicContact CD1-CE2 4.07Å; L175-F320 HydrophobicContact CD1-CG 3.58Å; L175-F320 HydrophobicContact CD1-CZ 3.93Å; L175-F320 HydrophobicContact CD2-CB 4.12Å; L175-F320 HydrophobicContact CD2-CD2 3.71Å; L175-F320 HydrophobicContact CD2-CE2 4.2Å; L175-F320 HydrophobicContact CD2-CG 3.93Å; L175-F320 HydrophobicContact CG-CD2 4.47Å; L175-F320 HydrophobicContact CG-CG 4.42Å; L175-F321 HydrophobicContact CB-CZ 4.25Å; L175-F321 HydrophobicContact CD2-CE2 3.96Å; L175-F321 HydrophobicContact CD2-CZ 4.16Å; L175-I339 HydrophobicContact CD2-CG1 4.12Å; L175-I339 HydrophobicContact CD2-CG2 4.16Å; L175-I343 HydrophobicContact CD2-CG2 4.16Å; L175-I343 HydrophobicContact CG-CG1 4.38Å
176	F	95.9	Very high	94.4	Very high	11 Å²	11	62.6 Å²	62.6	5%	0.048	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.2	-177.2	-39.7	-99.7	0	0	0	113.1	V169 T170 W216 L219 T220 L338	V169-F176 HydrophobicContact CG1-CB 3.47Å; V169-F176 VanDerWaalsContact CG1-CB 3.47Å; V169-F176 HydrophobicContact CG1-CD1 4.18Å; V169-F176 HydrophobicContact CG1-CG 4.02Å; T170-F176 CarbonylContact O-C 3.59Å; T170-F176 WeakPolarHBondContact O-CA 3.48Å; T170-F176 WeakPolarHBondContact O-CB 3.27Å; F176-W216 HydrophobicContact CD2-CZ3 4.27Å; F176-W216 AromaticContact CE2-CE3 3.95Å; F176-W216 HydrophobicContact CE2-CE3 3.95Å; F176-W216 HydrophobicContact CE2-CZ3 4.1Å; F176-L219 HydrophobicContact CD1-CD2 4.42Å; F176-L219 HydrophobicContact CD2-CD2 3.7Å; F176-L219 HydrophobicContact CE2-CD2 3.85Å; F176-L219 HydrophobicContact CG-CD2 4.01Å; F176-L219 HydrophobicContact CZ-CD2 4.28Å; F176-T220 HydrophobicContact CD1-CG2 3.58Å; F176-T220 HydrophobicContact CE1-CG2 3.69Å; F176-L338 HydrophobicContact CB-CB 4.15Å; F176-L338 HydrophobicContact CB-CD1 4.49Å; F176-L338 HydrophobicContact CD2-CB 4.38Å; F176-L338 PolarHBondContact N-O 3.25Å; F176-L338 PolarHBondContact O-N 2.93Å
177	T	94.8	Very high	94.4	Very high	22 Å²	22	62.9 Å²	62.9	14%	0.135	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.9	169.6	-50	0	0	0	0	109.1	T170 Y179 M336	T170-T177 PolarHBondContact N-O 2.83Å; T170-T177 PolarHBondContact O-N 3.05Å; T177-Y179 HydrophobicContact CG2-CD2 4.42Å; T177-Y179 HydrophobicContact CG2-CE1 4.35Å; T177-Y179 HydrophobicContact CG2-CE2 3.67Å; T177-M336 CarbonylContact C-O 3.52Å; T177-M336 WeakPolarHBondContact CA-O 3.15Å; T177-M336 HydrophobicContact CG2-CB 4.37Å; T177-M336 HydrophobicContact CG2-CE 4.29Å
178	Q	93.8	Very high	94.4	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.019	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	142.1	174.1	-178.2	177.9	-55.1	0	0	110.8	Q167 V168 V169 N180 M336 L338	Q167-Q178 HydrophobicContact CB-CG 4.15Å; Q167-Q178 VanDerWaalsContact CD-NE2 3.34Å; V168-Q178 CarbonylContact O-C 3.58Å; V169-Q178 HydrophobicContact CG2-CB 4.17Å; V169-Q178 HydrophobicContact CG2-CG 4.11Å; Q178-N180 PolarHBondContact NE2-OD1 2.94Å; Q178-M336 PolarHBondContact N-O 2.87Å; Q178-M336 WeakPolarHBondContact O-CB 3.36Å; Q178-M336 WeakPolarHBondContact O-CE 3.19Å; Q178-M336 VanDerWaalsContact O-CG 3.31Å; Q178-M336 WeakPolarHBondContact O-CG 3.18Å; Q178-L338 HydrophobicContact CB-CD1 4.26Å
179	Y	92.1	Very high	94.4	Very high	113 Å²	113	61 Å²	61	44%	0.443	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.6	173	-59.2	-93.3	0	0	0	109.2	V168 T177 M336	V168-Y179 PolarHBondContact N-O 2.99Å; V168-Y179 PolarHBondContact O-N 3.26Å; T177-Y179 HydrophobicContact CG2-CD2 4.42Å; T177-Y179 HydrophobicContact CG2-CE1 4.35Å; T177-Y179 HydrophobicContact CG2-CE2 3.67Å; Y179-M336 HydrophobicContact CD1-CE 3.45Å; Y179-M336 VanDerWaalsContact CD1-CE 3.45Å; Y179-M336 HydrophobicContact CE1-CE 3.57Å; Y179-M336 HydrophobicContact CG-CE 4.16Å
180	N	93.6	Very high	94.5	Very high	83 Å²	83	65.4 Å²	65.4	44%	0.444	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128	-178.1	-63.4	-10.3	0	0	0	109.9	I165 Q178	I165-N180 HydrophobicContact CB-CB 4.15Å; I165-N180 HydrophobicContact CD1-CB 4.29Å; I165-N180 WeakPolarHBondContact CD1-ND2 3.36Å; I165-N180 HydrophobicContact CG2-CB 4.17Å; Q178-N180 PolarHBondContact NE2-OD1 2.94Å
181	I	93.3	Very high	94.7	Very high	85 Å²	85	62 Å²	62	44%	0.436	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	104.1	174.9	-56.5	-178.7	0	0	0	108.5	M166 V168	M166-I181 HydrophobicContact CB-CB 4.4Å; M166-I181 WeakPolarHBondContact CB-O 3.26Å; M166-I181 PolarHBondContact N-O 2.93Å; M166-I181 PolarHBondContact O-N 3.43Å; V168-I181 HydrophobicContact CG2-CD1 3.66Å; V168-I181 HydrophobicContact CG2-CG1 4.21Å
182	Q	94.8	Very high	94.9	Very high	131 Å²	131	64 Å²	64	61%	0.612	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	140.8	176.5	-170.6	179.5	-0.3	0	0	111.6	A163	A163-Q182 HydrophobicContact CB-CG 4.31Å
183	K	95.7	Very high	95.2	Very high	77 Å²	77	63.7 Å²	63.7	34%	0.335	32%	0.316	S	S	.	.			trans	-110	176.8	173.6	-59.8	-60.3	177.5	-178.6	0	110.2	P164 M166	P164-K183 HydrophobicContact CG-CB 4.29Å; P164-K183 WeakPolarHBondContact O-CB 3.46Å; P164-K183 PolarHBondContact O-N 3.31Å; M166-K183 HydrophobicContact CB-CD 4.42Å; M166-K183 HydrophobicContact CB-CG 4.31Å; M166-K183 WeakPolarHBondContact SD-CE 3.34Å; M166-K183 PolarHBondContact SD-NZ 2.93Å
184	K	94.2	Very high	95.5	Very high	183 Å²	183	61 Å²	61	80%	0.796	29%	0.294	S	S	*	.			trans	-59.6	154.8	165.8	-68.3	-171.6	172.4	-167.8	0	109.6	P164	P164-K184 WeakPolarHBondContact CD-O 3.42Å; P164-K184 WeakPolarHBondContact CG-O 3.28Å
185	S	96.2	Very high	95.9	Very high	72 Å²	72	60.7 Å²	60.7	50%	0.503	29%	0.29	S	S	.	.			trans	-54.4	155.1	163.3	44.4	0	0	0	0	111.6	I161	I161-S185 VanDerWaalsContact O-CA 3.24Å; I161-S185 WeakPolarHBondContact O-CA 3.43Å
186	M	97.2	Very high	95.9	Very high	29 Å²	29	63.7 Å²	63.7	14%	0.143	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	157.1	175	61.8	-167.9	60.5	0	0	109.1	I161 P164 E190 Y191 L194	I161-M186 WeakPolarHBondContact CB-O 3.41Å; I161-M186 PolarHBondContact N-O 3.2Å; I161-M186 PolarHBondContact O-N 2.99Å; P164-M186 HydrophobicContact CG-CE 3.86Å; P164-M186 HydrophobicContact CG-CG 4.19Å; P164-M186 HydrophobicContact CG-SD 4.27Å; M186-E190 WeakPolarHBondContact CA-OE2 3.38Å; M186-E190 HydrophobicContact CB-CB 4.09Å; M186-E190 VanDerWaalsContact CB-OE2 3.27Å; M186-E190 WeakPolarHBondContact CB-OE2 3.49Å; M186-Y191 HydrophobicContact SD-CD2 3.83Å; M186-Y191 HydrophobicContact SD-CG 4.44Å; M186-L194 HydrophobicContact SD-CD2 4.29Å
187	T	97.3	Very high	96	Very high	38 Å²	38	65 Å²	65	23%	0.233	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	164.7	174.4	77.7	0	0	0	0	111.8	E157 M159 G189 E190 Y191	E157-T187 VanDerWaalsContact O-CB 3.25Å; E157-T187 WeakPolarHBondContact O-CB 3.45Å; E157-T187 PolarHBondContact O-OG1 2.88Å; M159-T187 CarbonylContact O-C 3.54Å; M159-T187 WeakPolarHBondContact O-CA 3.41Å; T187-G189 PolarHBondContact O-N 2.99Å; T187-G189 PolarHBondContact OG1-N 3.3Å; T187-E190 PolarHBondContact N-OE2 3.05Å; T187-E190 PolarHBondContact O-N 2.96Å; T187-E190 PolarHBondContact OG1-N 2.86Å; T187-E190 VanDerWaalsContact OG1-N 3.1Å; T187-Y191 WeakPolarHBondContact O-CB 3.12Å; T187-Y191 PolarHBondContact O-N 3.47Å
188	V	96.7	Very high	96	Very high	3 Å²	3	74 Å²	74	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-36.3	171.5	174.3	0	0	0	0	110.9	I156 E157 M159 I161 Y191 R192 F272 F377	I156-V188 HydrophobicContact CG1-CG1 4.25Å; I156-V188 WeakPolarHBondContact O-CB 3.47Å; E157-V188 PolarHBondContact O-N 3.37Å; M159-V188 HydrophobicContact CB-CG2 4.2Å; M159-V188 HydrophobicContact CE-CG2 4.22Å; M159-V188 WeakPolarHBondContact O-CG2 3.16Å; M159-V188 PolarHBondContact O-N 3.07Å; I161-V188 HydrophobicContact CD1-CG2 4.22Å; I161-V188 HydrophobicContact CG1-CG2 4.09Å; V188-Y191 PolarHBondContact O-N 3.24Å; V188-R192 VanDerWaalsContact O-CB 3.22Å; V188-R192 WeakPolarHBondContact O-CB 3.46Å; V188-R192 PolarHBondContact O-N 2.89Å; V188-F272 HydrophobicContact CB-CE1 4.25Å; V188-F272 HydrophobicContact CG1-CD1 3.89Å; V188-F272 HydrophobicContact CG1-CE1 3.71Å; V188-F272 HydrophobicContact CG2-CD1 3.85Å; V188-F272 HydrophobicContact CG2-CD2 4.42Å; V188-F272 HydrophobicContact CG2-CE1 3.4Å; V188-F272 HydrophobicContact CG2-CE2 4.05Å; V188-F272 HydrophobicContact CG2-CG 4.34Å; V188-F272 HydrophobicContact CG2-CZ 3.52Å; V188-F377 HydrophobicContact CG1-CE2 4.36Å; V188-F377 HydrophobicContact CG1-CZ 4.04Å
189	G	96.5	Very high	96.1	Very high	2 Å²	2	80 Å²	80	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-63.5	-44.9	175.4	0	0	0	0	0	112.6	E157 T187 R192 K193	E157-G189 PolarHBondContact O-N 3.42Å; T187-G189 PolarHBondContact O-N 2.99Å; T187-G189 PolarHBondContact OG1-N 3.3Å; G189-R192 PolarHBondContact O-N 3.11Å; G189-K193 WeakPolarHBondContact O-CB 3.34Å; G189-K193 WeakPolarHBondContact O-CD 3.48Å; G189-K193 WeakPolarHBondContact O-CG 3.29Å; G189-K193 PolarHBondContact O-N 3.41Å
190	E	97.4	Very high	96.3	Very high	103 Å²	103	75.6 Å²	75.6	48%	0.481	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-46.9	170.7	-72.2	-173.1	107.2	0	0	111.9	M186 T187 R192 K193 L194	M186-E190 WeakPolarHBondContact CA-OE2 3.38Å; M186-E190 HydrophobicContact CB-CB 4.09Å; M186-E190 VanDerWaalsContact CB-OE2 3.27Å; M186-E190 WeakPolarHBondContact CB-OE2 3.49Å; T187-E190 PolarHBondContact N-OE2 3.05Å; T187-E190 PolarHBondContact O-N 2.96Å; T187-E190 PolarHBondContact OG1-N 2.86Å; T187-E190 VanDerWaalsContact OG1-N 3.1Å; E190-R192 VanDerWaalsContact C-N 3.31Å; E190-R192 PolarHBondContact O-N 3.29Å; E190-K193 PolarHBondContact O-N 3.32Å; E190-L194 WeakPolarHBondContact O-CB 3.42Å; E190-L194 PolarHBondContact O-N 2.96Å
191	Y	98	Very high	96.5	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-37.6	179.5	-179.2	-88	0	0	0	111.9	I161 M186 T187 V188 L194 A195 I225 F272 G273 M274 F377	I161-Y191 HydrophobicContact CD1-CD1 4.19Å; I161-Y191 HydrophobicContact CD1-CD2 3.95Å; I161-Y191 HydrophobicContact CD1-CG 3.67Å; M186-Y191 HydrophobicContact SD-CD2 3.83Å; M186-Y191 HydrophobicContact SD-CG 4.44Å; T187-Y191 WeakPolarHBondContact O-CB 3.12Å; T187-Y191 PolarHBondContact O-N 3.47Å; V188-Y191 PolarHBondContact O-N 3.24Å; Y191-L194 WeakPolarHBondContact O-CB 3.31Å; Y191-L194 PolarHBondContact O-N 2.98Å; Y191-A195 VanDerWaalsContact O-CB 3.26Å; Y191-A195 WeakPolarHBondContact O-CB 3.34Å; Y191-A195 PolarHBondContact O-N 3.25Å; Y191-I225 HydrophobicContact CE2-CG2 4.25Å; Y191-I225 WeakPolarHBondContact CE2-O 3.44Å; Y191-I225 PolarHBondContact OH-O 3.5Å; Y191-F272 HydrophobicContact CD1-CB 4.05Å; Y191-F272 HydrophobicContact CE1-CB 3.77Å; Y191-F272 VanDerWaalsContact CZ-O 3.28Å; Y191-F272 PolarHBondContact OH-O 3.17Å; Y191-G273 WeakPolarHBondContact CE1-O 3.23Å; Y191-G273 PolarHBondContact OH-O 2.82Å; Y191-M274 HydrophobicContact CD2-CE 4.21Å; Y191-M274 HydrophobicContact CE1-CE 4.39Å; Y191-M274 HydrophobicContact CE2-CE 3.58Å; Y191-M274 PolarHBondContact OH-N 3.22Å; Y191-M274 VanDerWaalsContact OH-N 3.14Å; Y191-F377 HydrophobicContact CD1-CD2 4.04Å; Y191-F377 AromaticContact CD1-CE2 3.91Å; Y191-F377 HydrophobicContact CD1-CE2 3.91Å; Y191-F377 HydrophobicContact CE1-CD2 4.08Å; Y191-F377 HydrophobicContact CE1-CE2 4.27Å
192	R	97.4	Very high	96.7	Very high	85 Å²	85	72 Å²	72	32%	0.321	35%	0.349	S	S	.	.	H	α-helix	trans	-66.3	-46.7	174.2	-173.3	178.2	75.6	-178.5	4.2	111.7	E157 V188 G189 E190 L194 A195 N196 F377	E157-R192 IonicContact OE1-CZ 3.42Å; E157-R192 IonicContact OE1-NH1 2.89Å; E157-R192 PolarHBondContact OE1-NH1 3.43Å; E157-R192 IonicContact OE1-NH2 3.08Å; E157-R192 PolarHBondContact OE1-NH2 2.97Å; E157-R192 IonicContact OE2-CZ 3.43Å; E157-R192 IonicContact OE2-NE 3.22Å; E157-R192 IonicContact OE2-NH1 3.17Å; E157-R192 IonicContact OE2-NH2 3.98Å; E157-R192 PolarHBondContact OE2-NH2 3.25Å; V188-R192 VanDerWaalsContact O-CB 3.22Å; V188-R192 WeakPolarHBondContact O-CB 3.46Å; V188-R192 PolarHBondContact O-N 2.89Å; G189-R192 PolarHBondContact O-N 3.11Å; E190-R192 VanDerWaalsContact C-N 3.31Å; E190-R192 PolarHBondContact O-N 3.29Å; R192-L194 PolarHBondContact O-N 2.61Å; R192-A195 PolarHBondContact O-N 3.39Å; R192-N196 WeakPolarHBondContact O-CB 3.26Å; R192-N196 PolarHBondContact O-N 3.49Å; R192-F377 HydrophobicContact CB-CD1 4.46Å; R192-F377 HydrophobicContact CB-CD2 4.08Å; R192-F377 HydrophobicContact CB-CE1 4.11Å; R192-F377 HydrophobicContact CB-CE2 3.72Å; R192-F377 HydrophobicContact CB-CG 4.43Å; R192-F377 HydrophobicContact CB-CZ 3.73Å; R192-F377 VanDerWaalsContact CD-CE1 3.46Å; R192-F377 HydrophobicContact CG-CD1 3.7Å; R192-F377 HydrophobicContact CG-CD2 4.14Å; R192-F377 HydrophobicContact CG-CE1 3.55Å; R192-F377 HydrophobicContact CG-CE2 4.02Å; R192-F377 HydrophobicContact CG-CG 3.98Å; R192-F377 HydrophobicContact CG-CZ 3.72Å
193	K	97.4	Very high	96.8	Very high	148 Å²	148	67.7 Å²	67.7	64%	0.643	33%	0.333	S	S	*	.	H	α-helix	trans	-57.1	-39.3	173	-71	162	-173.7	168.6	0	110.7	G189 E190 S197	G189-K193 WeakPolarHBondContact O-CB 3.34Å; G189-K193 WeakPolarHBondContact O-CD 3.48Å; G189-K193 WeakPolarHBondContact O-CG 3.29Å; G189-K193 PolarHBondContact O-N 3.41Å; E190-K193 PolarHBondContact O-N 3.32Å; K193-S197 PolarHBondContact O-N 3.13Å
194	L	97.6	Very high	96.8	Very high	50 Å²	50	75.5 Å²	75.5	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-70.3	-48.1	176.7	-172.8	62.2	0	0	0	112.8	M186 E190 Y191 R192 N196 S197 Y200 I225 M274	M186-L194 HydrophobicContact SD-CD2 4.29Å; E190-L194 WeakPolarHBondContact O-CB 3.42Å; E190-L194 PolarHBondContact O-N 2.96Å; Y191-L194 WeakPolarHBondContact O-CB 3.31Å; Y191-L194 PolarHBondContact O-N 2.98Å; R192-L194 PolarHBondContact O-N 2.61Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 3.42Å; L194-S197 VanDerWaalsContact O-CB 3.28Å; L194-S197 WeakPolarHBondContact O-CB 3.19Å; L194-S197 PolarHBondContact O-N 2.62Å; L194-S197 PolarHBondContact O-OG 2.87Å; L194-Y200 HydrophobicContact CD1-CD2 3.91Å; L194-Y200 HydrophobicContact CD1-CE2 3.63Å; L194-Y200 HydrophobicContact CG-CD2 4.1Å; L194-Y200 HydrophobicContact CG-CE2 4.1Å; L194-Y200 WeakPolarHBondContact O-CD2 3.44Å; L194-I225 HydrophobicContact CD2-CD1 3.8Å; L194-M274 HydrophobicContact CD2-CE 4.43Å; L194-M274 HydrophobicContact CG-CE 4.38Å
195	A	97.8	Very high	96.9	Very high	2 Å²	2	70 Å²	70	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-60.2	-40.5	179.4	0	0	0	0	0	112.4	Y191 R192 S197 Y200 C201 M274 F377	Y191-A195 VanDerWaalsContact O-CB 3.26Å; Y191-A195 WeakPolarHBondContact O-CB 3.34Å; Y191-A195 PolarHBondContact O-N 3.25Å; R192-A195 PolarHBondContact O-N 3.39Å; A195-S197 VanDerWaalsContact C-N 3.33Å; A195-Y200 CarbonylContact O-C 3.56Å; A195-Y200 VanDerWaalsContact O-C 3.25Å; A195-C201 VanDerWaalsContact O-CA 3.3Å; A195-C201 WeakPolarHBondContact O-CA 3.31Å; A195-C201 PolarHBondContact O-N 3.29Å; A195-C201 VanDerWaalsContact O-N 3.16Å; A195-M274 HydrophobicContact CB-CB 3.59Å; A195-M274 HydrophobicContact CB-CE 4.08Å; A195-F377 HydrophobicContact CB-CB 3.98Å; A195-F377 HydrophobicContact CB-CD2 4.18Å; A195-F377 HydrophobicContact CB-CG 4.49Å
196	N	97.2	Very high	96.7	Very high	97 Å²	97	75.5 Å²	75.5	52%	0.519	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4	-179.9	-66.2	-20.9	0	0	0	113.4	R192 L194	R192-N196 WeakPolarHBondContact O-CB 3.26Å; R192-N196 PolarHBondContact O-N 3.49Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 3.42Å
197	S	97.8	Very high	96.5	Very high	38 Å²	38	77.4 Å²	77.4	27%	0.266	36%	0.362	S	S	.	.	S	Bend	trans	-65.1	152	176.2	75.1	0	0	0	0	112.2	K193 L194 A195 K199 Y200 C201	K193-S197 PolarHBondContact O-N 3.13Å; L194-S197 VanDerWaalsContact O-CB 3.28Å; L194-S197 WeakPolarHBondContact O-CB 3.19Å; L194-S197 PolarHBondContact O-N 2.62Å; L194-S197 PolarHBondContact O-OG 2.87Å; A195-S197 VanDerWaalsContact C-N 3.33Å; S197-K199 PolarHBondContact O-N 3.46Å; S197-Y200 PolarHBondContact O-N 3.06Å; S197-C201 WeakPolarHBondContact O-CB 3.46Å; S197-C201 PolarHBondContact O-N 2.93Å
198	K	94.9	Very high	96.3	Very high	211 Å²	211	80.3 Å²	80.3	92%	0.917	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-14.6	179.8	-64.5	179.9	-178.8	174.9	0	115.3
199	K	95.4	Very high	96.1	Very high	129 Å²	129	83.3 Å²	83.3	56%	0.561	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-33.2	178.7	-175.9	-179.3	177.3	-161.7	0	113.3	S197 V222	S197-K199 PolarHBondContact O-N 3.46Å; K199-V222 HydrophobicContact CG-CG1 4.2Å
200	Y	96.8	Very high	96.1	Very high	22 Å²	22	84.5 Å²	84.5	9%	0.086	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-8	-173	-57.3	-71.9	0	0	0	113.6	L194 A195 S197 V222 M274 W275	L194-Y200 HydrophobicContact CD1-CD2 3.91Å; L194-Y200 HydrophobicContact CD1-CE2 3.63Å; L194-Y200 HydrophobicContact CG-CD2 4.1Å; L194-Y200 HydrophobicContact CG-CE2 4.1Å; L194-Y200 WeakPolarHBondContact O-CD2 3.44Å; A195-Y200 CarbonylContact O-C 3.56Å; A195-Y200 VanDerWaalsContact O-C 3.25Å; S197-Y200 PolarHBondContact O-N 3.06Å; Y200-V222 HydrophobicContact CD1-CG1 3.74Å; Y200-V222 HydrophobicContact CE1-CG1 3.5Å; Y200-M274 HydrophobicContact CD1-SD 4.08Å; Y200-M274 HydrophobicContact CG-SD 3.98Å; Y200-W275 WeakPolarHBondContact O-CB 3.33Å
201	C	96.3	Very high	96.1	Very high	52 Å²	52	79.6 Å²	79.6	35%	0.351	37%	0.371	S	S	.	.	S	Bend	trans	-59.4	150.8	179.3	63.1	0	0	0	0	113.1	A195 S197	A195-C201 VanDerWaalsContact O-CA 3.3Å; A195-C201 WeakPolarHBondContact O-CA 3.31Å; A195-C201 PolarHBondContact O-N 3.29Å; A195-C201 VanDerWaalsContact O-N 3.16Å; S197-C201 WeakPolarHBondContact O-CB 3.46Å; S197-C201 PolarHBondContact O-N 2.93Å
202	T	97.7	Very high	96.1	Very high	39 Å²	39	80.8 Å²	80.8	24%	0.239	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-55.5	128.5	174.1	-49.6	0	0	0	0	111.1	L211 H375 G376	T202-L211 HydrophobicContact CG2-CD1 4.04Å; T202-L211 HydrophobicContact CG2-CD2 4.39Å; T202-H375 WeakPolarHBondContact CB-O 3.33Å; T202-H375 WeakPolarHBondContact CG2-O 3.4Å; T202-H375 PolarHBondContact OG1-O 3.11Å; T202-G376 VanDerWaalsContact OG1-CA 3.28Å; T202-G376 WeakPolarHBondContact OG1-CA 3.02Å
203	P	96.8	Very high	96	Very high	42 Å²	42	82.9 Å²	82.9	27%	0.273	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-71.2	147.6	179	29.4	-35.5	0	0	0	110.2	H205 L211 K214 W275	P203-H205 PolarHBondContact O-N 3Å; P203-H205 PolarHBondContact O-ND1 3.07Å; P203-L211 HydrophobicContact CG-CD1 4Å; P203-K214 HydrophobicContact CG-CD 4.44Å; P203-W275 VanDerWaalsContact CD-NE1 3.28Å; P203-W275 HydrophobicContact CG-CH2 4.36Å; P203-W275 HydrophobicContact CG-CZ2 3.65Å
204	R	95.5	Very high	96	Very high	240 Å²	240	78.4 Å²	78.4	91%	0.906	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-53.2	126.6	170.2	-66.1	-178	179.1	179.9	-1.7	109.8	K214	R204-K214 PolarHBondContact O-NZ 2.63Å
205	H	96.3	Very high	96	Very high	69 Å²	69	76.1 Å²	76.1	32%	0.319	35%	0.353	S	S	.	.			trans	-141.1	161.3	-178.1	57.9	-82.9	0	0	0	109.7	P203 D210 L211 K214	P203-H205 PolarHBondContact O-N 3Å; P203-H205 PolarHBondContact O-ND1 3.07Å; H205-D210 WeakPolarHBondContact CA-OD2 3.23Å; H205-D210 HydrophobicContact CB-CB 4.33Å; H205-L211 HydrophobicContact CB-CB 4.24Å; H205-L211 HydrophobicContact CB-CD1 4.3Å; H205-K214 HydrophobicContact CB-CD 4.43Å
206	K	93.1	Very high	96	Very high	186 Å²	186	77.8 Å²	77.8	81%	0.809	36%	0.359	S	S	*	.	S	Bend	trans	-87.6	-40.3	178.4	-67.3	-173.1	177.1	-171.5	0	113	D210	K206-D210 HydrophobicContact CB-CB 4.38Å; K206-D210 PolarHBondContact N-OD2 3.4Å
207	D	93.1	Very high	95.9	Very high	69 Å²	69	80.9 Å²	80.9	37%	0.369	37%	0.368	S	S	.	.	S	Bend	trans	-159.3	171.3	-166	51.2	66.8	0	0	0	109.1	D209 D210 L211	D207-D209 VanDerWaalsContact C-N 3.28Å; D207-D209 PolarHBondContact O-N 2.83Å; D207-D209 WeakPolarHBondContact OD1-CA 3.46Å; D207-D209 WeakPolarHBondContact OD1-CB 3.32Å; D207-D209 PolarHBondContact OD1-N 3.38Å; D207-D209 VanDerWaalsContact OD1-N 3.15Å; D207-D210 WeakPolarHBondContact O-CB 3.37Å; D207-D210 PolarHBondContact O-N 3.31Å; D207-D210 WeakPolarHBondContact OD1-CB 3.29Å; D207-D210 PolarHBondContact OD1-N 2.92Å; D207-L211 PolarHBondContact O-N 3.41Å; D207-L211 VanDerWaalsContact O-N 3.08Å
208	F	91.9	Very high	95.6	Very high	99 Å²	99	81.9 Å²	81.9	43%	0.434	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-31.6	179.9	-64.3	-46.1	0	0	0	113.1	D210 L211 E212 P299 T355 H375	F208-D210 VanDerWaalsContact C-N 3.34Å; F208-L211 PolarHBondContact O-N 2.88Å; F208-E212 WeakPolarHBondContact O-CB 3.35Å; F208-E212 PolarHBondContact O-N 2.99Å; F208-P299 HydrophobicContact CE1-CG 4.31Å; F208-T355 HydrophobicContact CE1-CG2 4.19Å; F208-T355 HydrophobicContact CE2-CG2 4.33Å; F208-T355 HydrophobicContact CZ-CG2 4.06Å; F208-H375 AromaticContact CD1-CE1 3.43Å; F208-H375 VanDerWaalsContact CD1-CE1 3.43Å; F208-H375 WeakPolarHBondContact CD1-CE1 3.41Å; F208-H375 AromaticContact CD1-ND1 3.8Å; F208-H375 AromaticContact CE1-CE1 3.65Å; F208-H375 AromaticContact CE1-ND1 3.74Å
209	D	93.1	Very high	95.4	Very high	67 Å²	67	72 Å²	72	36%	0.358	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	-36.2	175.7	-83.3	-52.5	0	0	0	111.6	D207 E212 R213 R353	D207-D209 VanDerWaalsContact C-N 3.28Å; D207-D209 PolarHBondContact O-N 2.83Å; D207-D209 WeakPolarHBondContact OD1-CA 3.46Å; D207-D209 WeakPolarHBondContact OD1-CB 3.32Å; D207-D209 PolarHBondContact OD1-N 3.38Å; D207-D209 VanDerWaalsContact OD1-N 3.15Å; D209-E212 PolarHBondContact O-N 3.43Å; D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 VanDerWaalsContact O-CG 3.22Å; D209-R213 WeakPolarHBondContact O-CG 3.41Å; D209-R213 PolarHBondContact O-N 2.95Å; D209-R353 IonicContact OD1-CZ 2.77Å; D209-R353 IonicContact OD1-NH1 3.82Å; D209-R353 PolarHBondContact OD1-NH1 3.01Å; D209-R353 IonicContact OD1-NH2 2.65Å; D209-R353 PolarHBondContact OD1-NH2 3.27Å; D209-R353 IonicContact OD2-NH2 2.84Å; D209-R353 PolarHBondContact OD2-NH2 2.88Å
210	D	96.9	Very high	95.2	Very high	26 Å²	26	68.7 Å²	68.7	14%	0.139	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-37.5	174.3	-162.8	50.7	0	0	0	112.3	H205 K206 D207 F208 R213 K214	H205-D210 WeakPolarHBondContact CA-OD2 3.23Å; H205-D210 HydrophobicContact CB-CB 4.33Å; K206-D210 HydrophobicContact CB-CB 4.38Å; K206-D210 PolarHBondContact N-OD2 3.4Å; D207-D210 WeakPolarHBondContact O-CB 3.37Å; D207-D210 PolarHBondContact O-N 3.31Å; D207-D210 WeakPolarHBondContact OD1-CB 3.29Å; D207-D210 PolarHBondContact OD1-N 2.92Å; F208-D210 VanDerWaalsContact C-N 3.34Å; D210-R213 VanDerWaalsContact CA-CZ 3.49Å; D210-R213 IonicContact OD1-CZ 2.91Å; D210-R213 IonicContact OD1-NE 2.77Å; D210-R213 IonicContact OD1-NH2 3.34Å; D210-R213 PolarHBondContact OD1-NH2 3.37Å; D210-K214 WeakPolarHBondContact O-CB 3.24Å; D210-K214 WeakPolarHBondContact O-CD 3.5Å; D210-K214 WeakPolarHBondContact O-CG 3.35Å; D210-K214 PolarHBondContact O-N 2.91Å; D210-K214 IonicContact OD1-NZ 2.91Å; D210-K214 WeakPolarHBondContact OD2-CE 3.23Å; D210-K214 IonicContact OD2-NZ 3.06Å; D210-K214 PolarHBondContact OD2-NZ 3.23Å
211	L	97.3	Very high	94.9	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-70.4	-40.6	173.2	-166.4	62.3	0	0	0	111.9	T202 P203 H205 D207 F208 K214 Y215 W275 H375	T202-L211 HydrophobicContact CG2-CD1 4.04Å; T202-L211 HydrophobicContact CG2-CD2 4.39Å; P203-L211 HydrophobicContact CG-CD1 4Å; H205-L211 HydrophobicContact CB-CB 4.24Å; H205-L211 HydrophobicContact CB-CD1 4.3Å; D207-L211 PolarHBondContact O-N 3.41Å; D207-L211 VanDerWaalsContact O-N 3.08Å; F208-L211 PolarHBondContact O-N 2.88Å; L211-K214 CarbonylContact O-C 3.46Å; L211-K214 PolarHBondContact O-N 2.89Å; L211-K214 VanDerWaalsContact O-N 3.17Å; L211-Y215 WeakPolarHBondContact O-CB 3.2Å; L211-Y215 PolarHBondContact O-N 3.1Å; L211-W275 HydrophobicContact CD1-CE3 4.05Å; L211-W275 HydrophobicContact CD1-CH2 3.41Å; L211-W275 VanDerWaalsContact CD1-CH2 3.41Å; L211-W275 HydrophobicContact CD1-CZ2 4.13Å; L211-W275 HydrophobicContact CD1-CZ3 3.38Å; L211-W275 HydrophobicContact CD2-CZ3 4.13Å; L211-W275 HydrophobicContact CG-CE3 4.46Å; L211-W275 HydrophobicContact CG-CH2 3.89Å; L211-W275 HydrophobicContact CG-CZ3 3.59Å; L211-H375 HydrophobicContact CD2-CB 3.8Å; L211-H375 WeakPolarHBondContact CD2-ND1 3.1Å
212	E	97.3	Very high	94.8	Very high	26 Å²	26	74.9 Å²	74.9	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-46.3	175.4	-163.9	-152.6	-111.9	0	0	111.6	F208 D209 K214 Y215 W216 Y303 R353 F373	F208-E212 WeakPolarHBondContact O-CB 3.35Å; F208-E212 PolarHBondContact O-N 2.99Å; D209-E212 PolarHBondContact O-N 3.43Å; E212-K214 VanDerWaalsContact C-N 3.3Å; E212-K214 PolarHBondContact O-N 3.29Å; E212-Y215 WeakPolarHBondContact O-CB 3.36Å; E212-Y215 PolarHBondContact O-N 3.41Å; E212-W216 PolarHBondContact O-N 2.84Å; E212-Y303 WeakPolarHBondContact CG-OH 3.28Å; E212-R353 WeakPolarHBondContact OE1-CD 3.41Å; E212-R353 IonicContact OE1-CZ 3.52Å; E212-R353 IonicContact OE1-NE 3.31Å; E212-R353 IonicContact OE1-NH1 2.67Å; E212-R353 PolarHBondContact OE1-NH1 3.25Å; E212-R353 IonicContact OE2-NH1 3.18Å; E212-R353 PolarHBondContact OE2-NH1 3.44Å; E212-F373 HydrophobicContact CB-CZ 4.39Å; E212-F373 HydrophobicContact CG-CE1 4.27Å; E212-F373 HydrophobicContact CG-CZ 4.39Å
213	R	96.6	Very high	94.7	Very high	129 Å²	129	74.4 Å²	74.4	49%	0.487	34%	0.344	S	S	.	.	H	α-helix	trans	-58	-41.9	172	-73.3	-177.4	-54.3	-101.3	6.1	111.5	D209 D210 K217	D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 VanDerWaalsContact O-CG 3.22Å; D209-R213 WeakPolarHBondContact O-CG 3.41Å; D209-R213 PolarHBondContact O-N 2.95Å; D210-R213 VanDerWaalsContact CA-CZ 3.49Å; D210-R213 IonicContact OD1-CZ 2.91Å; D210-R213 IonicContact OD1-NE 2.77Å; D210-R213 IonicContact OD1-NH2 3.34Å; D210-R213 PolarHBondContact OD1-NH2 3.37Å; R213-K217 WeakPolarHBondContact O-CB 3.42Å; R213-K217 PolarHBondContact O-N 2.91Å
214	K	97.3	Very high	94.8	Very high	54 Å²	54	72.7 Å²	72.7	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-69.9	-33.3	177.6	-77.2	165.3	-179	167.1	0	112.7	P203 R204 H205 D210 L211 E212 N218 W275	P203-K214 HydrophobicContact CG-CD 4.44Å; R204-K214 PolarHBondContact O-NZ 2.63Å; H205-K214 HydrophobicContact CB-CD 4.43Å; D210-K214 WeakPolarHBondContact O-CB 3.24Å; D210-K214 WeakPolarHBondContact O-CD 3.5Å; D210-K214 WeakPolarHBondContact O-CG 3.35Å; D210-K214 PolarHBondContact O-N 2.91Å; D210-K214 IonicContact OD1-NZ 2.91Å; D210-K214 WeakPolarHBondContact OD2-CE 3.23Å; D210-K214 IonicContact OD2-NZ 3.06Å; D210-K214 PolarHBondContact OD2-NZ 3.23Å; L211-K214 CarbonylContact O-C 3.46Å; L211-K214 PolarHBondContact O-N 2.89Å; L211-K214 VanDerWaalsContact O-N 3.17Å; E212-K214 VanDerWaalsContact C-N 3.3Å; E212-K214 PolarHBondContact O-N 3.29Å; K214-N218 VanDerWaalsContact O-CB 3.32Å; K214-N218 WeakPolarHBondContact O-CB 3.26Å; K214-N218 PolarHBondContact O-N 3.01Å; K214-N218 VanDerWaalsContact O-N 3.14Å; K214-N218 PolarHBondContact O-ND2 3.44Å; K214-W275 HydrophobicContact CB-CH2 4.44Å; K214-W275 HydrophobicContact CB-CZ2 4.45Å
215	Y	97.7	Very high	94.9	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-59.1	173.6	165.7	-101.1	0	0	0	110	L211 E212 K217 N218 L219 K276 T278 F373	L211-Y215 WeakPolarHBondContact O-CB 3.2Å; L211-Y215 PolarHBondContact O-N 3.1Å; E212-Y215 WeakPolarHBondContact O-CB 3.36Å; E212-Y215 PolarHBondContact O-N 3.41Å; Y215-K217 VanDerWaalsContact C-N 3.34Å; Y215-K217 PolarHBondContact O-N 3.15Å; Y215-N218 PolarHBondContact O-N 3.12Å; Y215-L219 HydrophobicContact CD2-CD1 4.33Å; Y215-L219 HydrophobicContact CE2-CD1 3.56Å; Y215-L219 PolarHBondContact O-N 3.27Å; Y215-L219 VanDerWaalsContact O-N 3.09Å; Y215-K276 HydrophobicContact CD2-CB 4.33Å; Y215-K276 HydrophobicContact CD2-CG 4.41Å; Y215-K276 HydrophobicContact CE2-CB 4.49Å; Y215-T278 WeakPolarHBondContact CE2-OG1 3.4Å; Y215-T278 VanDerWaalsContact OH-CG2 3.26Å; Y215-T278 WeakPolarHBondContact OH-CG2 3.11Å; Y215-T278 PolarHBondContact OH-OG1 3.25Å; Y215-T278 VanDerWaalsContact OH-OG1 3.09Å; Y215-F373 AromaticContact CD1-CD1 3.64Å; Y215-F373 HydrophobicContact CD1-CD1 3.64Å; Y215-F373 AromaticContact CD1-CE1 3.9Å; Y215-F373 HydrophobicContact CD1-CE1 3.9Å; Y215-F373 AromaticContact CD1-CG 3.99Å; Y215-F373 HydrophobicContact CD1-CG 3.99Å; Y215-F373 HydrophobicContact CD1-CZ 4.44Å; Y215-F373 HydrophobicContact CD2-CB 3.77Å; Y215-F373 HydrophobicContact CD2-CD1 4.17Å; Y215-F373 AromaticContact CD2-CD2 3.79Å; Y215-F373 HydrophobicContact CD2-CD2 3.79Å; Y215-F373 HydrophobicContact CD2-CE2 4.47Å; Y215-F373 AromaticContact CD2-CG 3.62Å; Y215-F373 HydrophobicContact CD2-CG 3.62Å; Y215-F373 HydrophobicContact CE1-CB 4.32Å; Y215-F373 AromaticContact CE1-CD1 3.79Å; Y215-F373 HydrophobicContact CE1-CD1 3.79Å; Y215-F373 HydrophobicContact CE1-CE1 4.43Å; Y215-F373 HydrophobicContact CE1-CG 4.15Å; Y215-F373 HydrophobicContact CE2-CB 3.44Å; Y215-F373 VanDerWaalsContact CE2-CB 3.44Å; Y215-F373 HydrophobicContact CE2-CD1 4.3Å; Y215-F373 HydrophobicContact CE2-CD2 4.38Å; Y215-F373 AromaticContact CE2-CG 3.79Å; Y215-F373 HydrophobicContact CE2-CG 3.79Å; Y215-F373 HydrophobicContact CG-CB 4.34Å; Y215-F373 AromaticContact CG-CD1 3.85Å; Y215-F373 HydrophobicContact CG-CD1 3.85Å; Y215-F373 AromaticContact CG-CD2 3.88Å; Y215-F373 HydrophobicContact CG-CD2 3.88Å; Y215-F373 HydrophobicContact CG-CE1 4.12Å; Y215-F373 HydrophobicContact CG-CE2 4.15Å; Y215-F373 AromaticContact CG-CG 3.74Å; Y215-F373 HydrophobicContact CG-CG 3.74Å; Y215-F373 HydrophobicContact CG-CZ 4.26Å
216	W	96.8	Very high	95	Very high	37 Å²	37	59.2 Å²	59.2	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-34.3	-177.8	-71.6	114.4	0	0	0	113.6	F176 E212 L219 Y303 P341	F176-W216 HydrophobicContact CD2-CZ3 4.27Å; F176-W216 AromaticContact CE2-CE3 3.95Å; F176-W216 HydrophobicContact CE2-CE3 3.95Å; F176-W216 HydrophobicContact CE2-CZ3 4.1Å; E212-W216 PolarHBondContact O-N 2.84Å; W216-L219 HydrophobicContact CE3-CD2 4.07Å; W216-L219 HydrophobicContact CZ3-CD2 4.02Å; W216-Y303 AromaticContact CZ2-CE2 3.84Å; W216-Y303 HydrophobicContact CZ2-CE2 3.84Å; W216-Y303 AromaticContact NE1-CZ 3.72Å; W216-Y303 PolarHBondContact NE1-OH 2.75Å; W216-P341 VanDerWaalsContact CE2-CD 3.42Å; W216-P341 VanDerWaalsContact CZ2-CD 3.47Å; W216-P341 HydrophobicContact CZ2-CG 4.49Å
217	K	94.6	Very high	95.1	Very high	162 Å²	162	50.4 Å²	50.4	70%	0.704	24%	0.241	S	C	*	.	H	α-helix	trans	-68.5	-37.6	176.5	-178.4	174.5	178.2	177.6	0	113.1	R213 Y215	R213-K217 WeakPolarHBondContact O-CB 3.42Å; R213-K217 PolarHBondContact O-N 2.91Å; Y215-K217 VanDerWaalsContact C-N 3.34Å; Y215-K217 PolarHBondContact O-N 3.15Å
218	N	92.6	Very high	95.1	Very high	58 Å²	58	47.7 Å²	47.7	31%	0.31	23%	0.228	S	C	.	.	H	α-helix	trans	-108.6	13.6	-169.9	-55.7	-65.4	0	0	0	113.7	K214 Y215 T220 F221 K276	K214-N218 VanDerWaalsContact O-CB 3.32Å; K214-N218 WeakPolarHBondContact O-CB 3.26Å; K214-N218 PolarHBondContact O-N 3.01Å; K214-N218 VanDerWaalsContact O-N 3.14Å; K214-N218 PolarHBondContact O-ND2 3.44Å; Y215-N218 PolarHBondContact O-N 3.12Å; N218-T220 PolarHBondContact O-N 3.09Å; N218-F221 HydrophobicContact CB-CD2 4.27Å; N218-F221 PolarHBondContact O-N 3.39Å; N218-K276 WeakPolarHBondContact O-CE 3.24Å; N218-K276 PolarHBondContact O-NZ 3.28Å
219	L	90.3	Very high	95	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-46.3	-171.2	-173.2	56.4	0	0	0	113.6	V169 F176 Y215 W216 F221 K276 L338	V169-L219 HydrophobicContact CB-CG 4.25Å; V169-L219 HydrophobicContact CG1-CD2 4.04Å; V169-L219 HydrophobicContact CG1-CG 3.9Å; V169-L219 HydrophobicContact CG2-CD1 4.25Å; V169-L219 HydrophobicContact CG2-CG 4.3Å; F176-L219 HydrophobicContact CD1-CD2 4.42Å; F176-L219 HydrophobicContact CD2-CD2 3.7Å; F176-L219 HydrophobicContact CE2-CD2 3.85Å; F176-L219 HydrophobicContact CG-CD2 4.01Å; F176-L219 HydrophobicContact CZ-CD2 4.28Å; Y215-L219 HydrophobicContact CD2-CD1 4.33Å; Y215-L219 HydrophobicContact CE2-CD1 3.56Å; Y215-L219 PolarHBondContact O-N 3.27Å; Y215-L219 VanDerWaalsContact O-N 3.09Å; W216-L219 HydrophobicContact CE3-CD2 4.07Å; W216-L219 HydrophobicContact CZ3-CD2 4.02Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.18Å; L219-K276 WeakPolarHBondContact O-CE 3.29Å; L219-K276 PolarHBondContact O-NZ 3.44Å; L219-L338 HydrophobicContact CD2-CD1 3.92Å
220	T	91.5	Very high	95	Very high	59 Å²	59	44.5 Å²	44.5	36%	0.362	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1	-176.1	51.7	0	0	0	0	115.3	V169 F176 N218	V169-T220 HydrophobicContact CG1-CG2 4.32Å; F176-T220 HydrophobicContact CD1-CG2 3.58Å; F176-T220 HydrophobicContact CE1-CG2 3.69Å; N218-T220 PolarHBondContact O-N 3.09Å
221	F	91.1	Very high	94.6	Very high	136 Å²	136	46.8 Å²	46.8	60%	0.596	23%	0.234	S	C	*	.	S	Bend	trans	-82.3	-132.4	177.3	-65.2	-99.8	0	0	0	110.6	N218 L219 S223	N218-F221 HydrophobicContact CB-CD2 4.27Å; N218-F221 PolarHBondContact O-N 3.39Å; L219-F221 VanDerWaalsContact C-N 3.33Å; L219-F221 PolarHBondContact O-N 3.18Å; F221-S223 PolarHBondContact O-N 2.9Å
222	V	92.8	Very high	94.2	Very high	68 Å²	68	48.2 Å²	48.2	41%	0.412	25%	0.249	S	C	.	.	S	Bend	trans	-48.8	112.8	-178.6	179.6	0	0	0	0	111	K199 Y200 P224 K276	K199-V222 HydrophobicContact CG-CG1 4.2Å; Y200-V222 HydrophobicContact CD1-CG1 3.74Å; Y200-V222 HydrophobicContact CE1-CG1 3.5Å; V222-P224 WeakPolarHBondContact O-CD 3.35Å; V222-K276 PolarHBondContact O-NZ 2.68Å
223	S	96.8	Very high	94	Very high	30 Å²	30	49.2 Å²	49.2	21%	0.21	26%	0.258	C	S	.	.			trans	-69.5	116.8	178.7	-49.4	0	0	0	0	109.9	Q167 F221	Q167-S223 WeakPolarHBondContact O-CB 3.3Å; F221-S223 PolarHBondContact O-N 2.9Å
224	P	97.7	Very high	93.9	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.032	24%	0.236	C	C	.	.			trans	-73.4	169.8	176.6	35.2	-38	0	0	0	110.7	M166 Q167 V222 M274 W275 K276 T277	M166-P224 CarbonylContact C-O 3.57Å; M166-P224 VanDerWaalsContact CA-O 3.31Å; M166-P224 WeakPolarHBondContact CA-O 3.31Å; Q167-P224 HydrophobicContact CB-CG 4.32Å; Q167-P224 PolarHBondContact N-O 3.27Å; V222-P224 WeakPolarHBondContact O-CD 3.35Å; P224-M274 HydrophobicContact CB-CG 4.1Å; P224-M274 HydrophobicContact CB-SD 4.21Å; P224-W275 WeakPolarHBondContact CB-O 3.09Å; P224-K276 HydrophobicContact CB-CB 4.39Å; P224-K276 HydrophobicContact CG-CB 4Å; P224-T277 HydrophobicContact CB-CG2 3.82Å; P224-T277 HydrophobicContact CG-CG2 4.23Å
225	I	98.1	Very high	93.8	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.051	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.4	174.5	-62.1	158.6	0	0	0	107	P164 I165 M166 Y191 L194 M274 T277	P164-I225 HydrophobicContact CB-CG2 3.81Å; I165-I225 CarbonylContact O-C 3.58Å; I165-I225 WeakPolarHBondContact O-CA 3.24Å; M166-I225 HydrophobicContact CB-CG1 4.04Å; M166-I225 HydrophobicContact CE-CD1 3.92Å; M166-I225 HydrophobicContact CE-CG1 3.75Å; M166-I225 HydrophobicContact CG-CG1 4.41Å; Y191-I225 HydrophobicContact CE2-CG2 4.25Å; Y191-I225 WeakPolarHBondContact CE2-O 3.44Å; Y191-I225 PolarHBondContact OH-O 3.5Å; L194-I225 HydrophobicContact CD2-CD1 3.8Å; I225-M274 HydrophobicContact CB-CE 4.06Å; I225-M274 HydrophobicContact CB-SD 4.47Å; I225-M274 WeakPolarHBondContact O-CE 3.38Å; I225-M274 VanDerWaalsContact O-CG 3.29Å; I225-M274 WeakPolarHBondContact O-CG 3.41Å; I225-T277 WeakPolarHBondContact O-CG2 3.35Å
226	Y	98.3	Very high	93.6	Very high	17 Å²	17	43.1 Å²	43.1	7%	0.067	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.7	-178.9	-166.6	-151.1	0	0	0	109.6	I165 A228 Y271 F272 T277 N374	I165-Y226 VanDerWaalsContact CG1-O 3.25Å; I165-Y226 WeakPolarHBondContact CG1-O 3.36Å; I165-Y226 PolarHBondContact N-O 3.18Å; I165-Y226 PolarHBondContact O-N 3.24Å; Y226-A228 VanDerWaalsContact C-N 3.28Å; Y226-A228 HydrophobicContact CD1-CB 3.63Å; Y226-A228 HydrophobicContact CE1-CB 3.85Å; Y226-A228 HydrophobicContact CG-CB 4.16Å; Y226-A228 PolarHBondContact O-N 3.11Å; Y226-Y271 HydrophobicContact CE1-CD1 4.09Å; Y226-Y271 AromaticContact CZ-CD1 3.87Å; Y226-F272 WeakPolarHBondContact CD2-O 3.32Å; Y226-T277 HydrophobicContact CD2-CG2 3.88Å; Y226-T277 HydrophobicContact CG-CG2 4.02Å; Y226-N374 WeakPolarHBondContact CE2-ND2 3.43Å
227	G	96.4	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	69.7	172.9	0	0	0	0	0	110.3	Y271 F272	G227-Y271 CarbonylContact O-C 3.4Å; G227-Y271 WeakPolarHBondContact O-CA 3.49Å; G227-F272 PolarHBondContact N-O 3.37Å; G227-F272 PolarHBondContact O-N 2.9Å
228	A	91.7	Very high	92.6	Very high	12 Å²	12	46 Å²	46	10%	0.099	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	161.1	-175.4	0	0	0	0	0	112.9	I165 Y226 V230 Y271	I165-A228 HydrophobicContact CD1-CB 4.19Å; I165-A228 HydrophobicContact CG1-CB 4.45Å; Y226-A228 VanDerWaalsContact C-N 3.28Å; Y226-A228 HydrophobicContact CD1-CB 3.63Å; Y226-A228 HydrophobicContact CE1-CB 3.85Å; Y226-A228 HydrophobicContact CG-CB 4.16Å; Y226-A228 PolarHBondContact O-N 3.11Å; A228-V230 VanDerWaalsContact C-N 3.28Å; A228-V230 PolarHBondContact O-N 2.94Å; A228-Y271 HydrophobicContact CB-CD1 3.77Å; A228-Y271 HydrophobicContact CB-CE1 3.82Å
229	D	90.6	Very high	92.6	Very high	89 Å²	89	44.9 Å²	44.9	48%	0.476	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.8	40.3	167.4	-46.5	-46.6	0	0	0	112.5	Y269 Y271	D229-Y269 HydrophobicContact CB-CD2 3.99Å; D229-Y269 HydrophobicContact CB-CE2 3.93Å; D229-Y271 WeakPolarHBondContact OD1-CE1 3.13Å; D229-Y271 VanDerWaalsContact OD1-CZ 3.25Å; D229-Y271 PolarHBondContact OD1-OH 2.71Å
230	V	92.5	Very high	92.5	Very high	10 Å²	10	52 Å²	52	6%	0.061	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.6	178.9	-176.5	0	0	0	0	109.5	M159 I161 A228 G232 Y269 L270	M159-V230 HydrophobicContact CE-CG1 4.28Å; I161-V230 HydrophobicContact CG2-CG2 4.02Å; A228-V230 VanDerWaalsContact C-N 3.28Å; A228-V230 PolarHBondContact O-N 2.94Å; V230-G232 PolarHBondContact O-N 3.12Å; V230-Y269 WeakPolarHBondContact O-CA 3.28Å; V230-L270 HydrophobicContact CB-CB 4.21Å; V230-L270 PolarHBondContact N-O 2.68Å; V230-L270 PolarHBondContact O-N 3.23Å
231	S	89.4	Confident	92.7	Very high	74 Å²	74	51.5 Å²	51.5	52%	0.517	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	123.4	179.8	-51.1	0	0	0	0	112.8	Y269	S231-Y269 WeakPolarHBondContact OG-CE1 3.33Å
232	G	88.4	Confident	92.8	Very high	30 Å²	30	45.2 Å²	45.2	31%	0.309	26%	0.262	S	S	.	.			trans	151.5	172.4	176.5	0	0	0	0	0	113.2	V230 P268	V230-G232 PolarHBondContact O-N 3.12Å; G232-P268 PolarHBondContact N-O 2.79Å; G232-P268 CarbonylContact O-C 3.51Å; G232-P268 WeakPolarHBondContact O-CB 3.24Å; G232-P268 WeakPolarHBondContact O-CG 3.4Å
233	S	93.3	Very high	92.9	Very high	47 Å²	47	43 Å²	43	33%	0.329	25%	0.248	S	C	.	.			trans	-128.2	147.7	170.4	-173.7	0	0	0	0	110	Y235 E381	S233-Y235 WeakPolarHBondContact OG-CD2 3.46Å; S233-Y235 PolarHBondContact OG-N 3.35Å; S233-E381 VanDerWaalsContact CA-OE2 3.27Å; S233-E381 WeakPolarHBondContact CA-OE2 3.48Å; S233-E381 VanDerWaalsContact CB-OE1 3.27Å; S233-E381 WeakPolarHBondContact CB-OE1 3.42Å; S233-E381 VanDerWaalsContact OG-CD 3.25Å; S233-E381 PolarHBondContact OG-OE1 2.92Å; S233-E381 PolarHBondContact OG-OE2 2.92Å; S233-E381 VanDerWaalsContact OG-OE2 3.12Å
234	I	94.4	Very high	92.7	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	24%	0.238	C	C	.	.			trans	-117.8	34.4	171.5	61.4	176.6	0	0	0	111.9	R150 Y153 M159 L270 H295 F296 E381	R150-I234 WeakPolarHBondContact CB-O 3.5Å; R150-I234 WeakPolarHBondContact CD-O 3.03Å; R150-I234 PolarHBondContact NE-O 3.16Å; R150-I234 VanDerWaalsContact NE-O 3.12Å; Y153-I234 HydrophobicContact CD1-CD1 4.46Å; Y153-I234 HydrophobicContact CE1-CD1 4.22Å; M159-I234 HydrophobicContact SD-CG2 4.48Å; I234-L270 HydrophobicContact CD1-CD2 4.2Å; I234-L270 HydrophobicContact CG1-CD2 3.85Å; I234-L270 HydrophobicContact CG2-CD1 3.88Å; I234-L270 HydrophobicContact CG2-CD2 4.26Å; I234-H295 HydrophobicContact CD1-CB 4.01Å; I234-F296 HydrophobicContact CD1-CE1 4.33Å; I234-E381 PolarHBondContact N-OE2 2.88Å
235	Y	94.6	Very high	92.2	Very high	14 Å²	14	42.4 Å²	42.4	6%	0.055	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-81.5	152.7	161.2	-77.4	-120.1	0	0	0	110.2	W147 P149 R150 S233 I239 W242 N243 I244 H295	W147-Y235 HydrophobicContact CH2-CE1 4.07Å; W147-Y235 HydrophobicContact CZ2-CE1 4.16Å; P149-Y235 HydrophobicContact CB-CD1 3.37Å; P149-Y235 HydrophobicContact CB-CD2 4.13Å; P149-Y235 HydrophobicContact CB-CE1 3.29Å; P149-Y235 HydrophobicContact CB-CE2 4.05Å; P149-Y235 HydrophobicContact CB-CG 3.78Å; P149-Y235 HydrophobicContact CG-CE1 4.35Å; P149-Y235 CarbonylContact O-C 3.55Å; P149-Y235 WeakPolarHBondContact O-CA 3.44Å; R150-Y235 PolarHBondContact NH2-O 3.35Å; S233-Y235 WeakPolarHBondContact OG-CD2 3.46Å; S233-Y235 PolarHBondContact OG-N 3.35Å; Y235-I239 HydrophobicContact CD1-CB 4.41Å; Y235-I239 HydrophobicContact CD1-CG2 3.9Å; Y235-I239 HydrophobicContact CE1-CG2 4.37Å; Y235-W242 PolarHBondContact OH-O 3.01Å; Y235-N243 HydrophobicContact CD1-CB 4.15Å; Y235-N243 HydrophobicContact CE1-CB 4.44Å; Y235-I244 HydrophobicContact CE2-CB 4.29Å; Y235-I244 HydrophobicContact CE2-CD1 4.11Å; Y235-I244 HydrophobicContact CE2-CG1 4.07Å; Y235-H295 AromaticContact CD2-CE1 3.75Å; Y235-H295 AromaticContact CE2-CE1 3.49Å; Y235-H295 VanDerWaalsContact CE2-CE1 3.49Å; Y235-H295 WeakPolarHBondContact CE2-CE1 3.44Å; Y235-H295 AromaticContact CE2-NE2 3.62Å
236	D	93	Very high	91.6	Very high	39 Å²	39	48.6 Å²	48.6	21%	0.209	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-84.7	152.9	173.9	-72.1	-7.1	0	0	0	111.7	P149 R150 Q151 G238 I239	P149-D236 PolarHBondContact O-N 3.32Å; R150-D236 VanDerWaalsContact CA-OD2 3.26Å; R150-D236 WeakPolarHBondContact CA-OD2 3.35Å; R150-D236 WeakPolarHBondContact CG-OD1 3.45Å; R150-D236 IonicContact CZ-OD1 3.91Å; R150-D236 IonicContact NE-OD1 3.4Å; R150-D236 PolarHBondContact NE-OD1 2.65Å; R150-D236 IonicContact NH2-OD1 2.65Å; R150-D236 PolarHBondContact NH2-OD1 2.91Å; Q151-D236 PolarHBondContact N-OD2 2.93Å; D236-G238 PolarHBondContact O-N 2.87Å; D236-I239 HydrophobicContact CB-CG1 4.24Å; D236-I239 PolarHBondContact O-N 2.86Å
237	E	86.1	Confident	91	Very high	204 Å²	204	48.6 Å²	48.6	95%	0.953	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	133.7	174.6	-63.4	-166.6	168	0	0	110.9
238	G	85.5	Confident	90.2	Very high	55 Å²	55	54.8 Å²	54.8	57%	0.567	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	-7.3	-177.1	0	0	0	0	0	115.5	D236 H240	D236-G238 PolarHBondContact O-N 2.87Å; G238-H240 PolarHBondContact O-N 2.83Å
239	I	92.1	Very high	89.8	Confident	36 Å²	36	55.3 Å²	55.3	19%	0.185	31%	0.311	C	S	.	.			trans	-73.6	119.4	168.6	-57.5	-61.2	0	0	0	109.4	W147 Y235 D236 N243	W147-I239 HydrophobicContact CZ2-CG2 4.15Å; Y235-I239 HydrophobicContact CD1-CB 4.41Å; Y235-I239 HydrophobicContact CD1-CG2 3.9Å; Y235-I239 HydrophobicContact CE1-CG2 4.37Å; D236-I239 HydrophobicContact CB-CG1 4.24Å; D236-I239 PolarHBondContact O-N 2.86Å; I239-N243 PolarHBondContact O-ND2 3.24Å
240	H	89.3	Confident	89.4	Confident	153 Å²	153	51.7 Å²	51.7	71%	0.708	29%	0.292	S	S	*	.			trans	-110.2	-33.6	-177.5	-63.7	-40.7	0	0	0	112.6	G238 W242	G238-H240 PolarHBondContact O-N 2.83Å; H240-W242 PolarHBondContact O-N 2.72Å
241	E	93.7	Very high	88.8	Confident	48 Å²	48	51.4 Å²	51.4	22%	0.224	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	121.5	178.6	-57.6	81.8	176.8	0	0	110.7	F118 K119 W147 N243	F118-E241 HydrophobicContact CD1-CB 3.81Å; F118-E241 HydrophobicContact CD1-CG 4.43Å; F118-E241 HydrophobicContact CE1-CB 3.79Å; K119-E241 HydrophobicContact CG-CG 4Å; W147-E241 WeakPolarHBondContact CZ2-O 3.35Å; E241-N243 PolarHBondContact O-N 3.05Å
242	W	94.9	Very high	88	Confident	5 Å²	5	49.6 Å²	49.6	2%	0.019	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	25.2	175.2	-68	54.4	0	0	0	114.8	F118 F121 Y124 V141 Y235 H240 I244 I291 F361 I363	F118-W242 AromaticContact CD1-CD1 3.95Å; F118-W242 AromaticContact CD2-CD1 3.69Å; F118-W242 HydrophobicContact CD2-CD2 4.02Å; F118-W242 AromaticContact CD2-CE2 3.62Å; F118-W242 HydrophobicContact CD2-CG 4.1Å; F118-W242 HydrophobicContact CD2-CZ2 4.17Å; F118-W242 AromaticContact CD2-NE1 3.4Å; F118-W242 HydrophobicContact CE1-CB 4.11Å; F118-W242 AromaticContact CE1-CD1 3.74Å; F118-W242 AromaticContact CE1-CG 3.95Å; F118-W242 HydrophobicContact CE1-CG 3.95Å; F118-W242 HydrophobicContact CE2-CB 4.18Å; F118-W242 AromaticContact CE2-CD1 3.5Å; F118-W242 VanDerWaalsContact CE2-CD1 3.5Å; F118-W242 AromaticContact CE2-CD2 3.37Å; F118-W242 HydrophobicContact CE2-CD2 3.37Å; F118-W242 AromaticContact CE2-CE2 3.49Å; F118-W242 VanDerWaalsContact CE2-CE2 3.49Å; F118-W242 AromaticContact CE2-CE3 3.96Å; F118-W242 HydrophobicContact CE2-CE3 3.96Å; F118-W242 AromaticContact CE2-CG 3.44Å; F118-W242 HydrophobicContact CE2-CG 3.44Å; F118-W242 VanDerWaalsContact CE2-CG 3.44Å; F118-W242 HydrophobicContact CE2-CZ2 4.19Å; F118-W242 AromaticContact CE2-NE1 3.54Å; F118-W242 AromaticContact CG-CD1 3.92Å; F118-W242 AromaticContact CG-NE1 3.84Å; F118-W242 HydrophobicContact CZ-CB 3.6Å; F118-W242 AromaticContact CZ-CD1 3.52Å; F118-W242 AromaticContact CZ-CD2 3.79Å; F118-W242 HydrophobicContact CZ-CD2 3.79Å; F118-W242 HydrophobicContact CZ-CE3 4.46Å; F118-W242 AromaticContact CZ-CG 3.35Å; F118-W242 HydrophobicContact CZ-CG 3.35Å; F118-W242 PolarHBondContact O-NE1 3.12Å; F121-W242 AromaticContact CD2-CD2 3.66Å; F121-W242 HydrophobicContact CD2-CD2 3.66Å; F121-W242 AromaticContact CD2-CE2 3.69Å; F121-W242 AromaticContact CD2-CE3 3.87Å; F121-W242 HydrophobicContact CD2-CE3 3.87Å; F121-W242 HydrophobicContact CD2-CG 4.2Å; F121-W242 HydrophobicContact CD2-CH2 4.04Å; F121-W242 AromaticContact CD2-CZ2 3.9Å; F121-W242 HydrophobicContact CD2-CZ2 3.9Å; F121-W242 HydrophobicContact CD2-CZ3 4.04Å; F121-W242 HydrophobicContact CE2-CD2 4.34Å; F121-W242 HydrophobicContact CE2-CE3 4.08Å; F121-W242 HydrophobicContact CE2-CH2 4.23Å; F121-W242 HydrophobicContact CE2-CZ3 4.01Å; Y124-W242 AromaticContact CD1-CH2 3.99Å; Y124-W242 HydrophobicContact CD1-CH2 3.99Å; Y124-W242 AromaticContact CD1-CZ2 3.71Å; Y124-W242 HydrophobicContact CD1-CZ2 3.71Å; Y124-W242 HydrophobicContact CG-CZ2 4.09Å; V141-W242 HydrophobicContact CB-CH2 4.18Å; V141-W242 HydrophobicContact CB-CZ3 4.17Å; V141-W242 HydrophobicContact CG1-CH2 3.97Å; V141-W242 HydrophobicContact CG1-CZ3 4.28Å; V141-W242 HydrophobicContact CG2-CH2 3.91Å; V141-W242 HydrophobicContact CG2-CZ3 4.13Å; Y235-W242 PolarHBondContact OH-O 3.01Å; H240-W242 PolarHBondContact O-N 2.72Å; W242-I244 PolarHBondContact O-N 3.37Å; W242-I244 VanDerWaalsContact O-N 3.11Å; W242-I291 HydrophobicContact CE3-CD1 3.82Å; W242-I291 HydrophobicContact CZ3-CD1 4.25Å; W242-F361 HydrophobicContact CB-CE1 4.18Å; W242-F361 HydrophobicContact CB-CE2 4.44Å; W242-F361 HydrophobicContact CB-CZ 3.75Å; W242-F361 AromaticContact CE3-CD1 3.97Å; W242-F361 HydrophobicContact CE3-CD1 3.97Å; W242-F361 HydrophobicContact CE3-CD2 4.11Å; W242-F361 AromaticContact CE3-CE1 4Å; W242-F361 HydrophobicContact CE3-CE1 4Å; W242-F361 HydrophobicContact CE3-CE2 4.17Å; W242-F361 AromaticContact CE3-CG 4Å; W242-F361 HydrophobicContact CE3-CG 4Å; W242-F361 HydrophobicContact CE3-CZ 4.1Å; W242-F361 HydrophobicContact CG-CZ 4.46Å; W242-F361 HydrophobicContact CZ3-CB 4.42Å; W242-F361 HydrophobicContact CZ3-CD1 4.49Å; W242-F361 HydrophobicContact CZ3-CG 4.27Å; W242-I363 HydrophobicContact CZ3-CD1 4.2Å
243	N	94.3	Very high	87	Confident	21 Å²	21	48.4 Å²	48.4	11%	0.112	26%	0.261	C	S	.	.			trans	-62.8	112.5	176.2	-172.5	-41.2	0	0	0	110.3	Y235 I239 E241 G245 H246 L247	Y235-N243 HydrophobicContact CD1-CB 4.15Å; Y235-N243 HydrophobicContact CE1-CB 4.44Å; I239-N243 PolarHBondContact O-ND2 3.24Å; E241-N243 PolarHBondContact O-N 3.05Å; N243-G245 PolarHBondContact O-N 3.22Å; N243-G245 WeakPolarHBondContact OD1-CA 3.38Å; N243-G245 PolarHBondContact OD1-N 3.19Å; N243-H246 CarbonylContact O-C 3.6Å; N243-H246 VanDerWaalsContact O-C 3.25Å; N243-H246 PolarHBondContact O-N 2.97Å; N243-L247 WeakPolarHBondContact O-CD2 3.4Å; N243-L247 PolarHBondContact O-N 2.76Å
244	I	93.3	Very high	85.8	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25	-174.3	-62	179.2	0	0	0	111.5	Y235 W242 H246 P268 I291 F361 E381 T383	Y235-I244 HydrophobicContact CE2-CB 4.29Å; Y235-I244 HydrophobicContact CE2-CD1 4.11Å; Y235-I244 HydrophobicContact CE2-CG1 4.07Å; W242-I244 PolarHBondContact O-N 3.37Å; W242-I244 VanDerWaalsContact O-N 3.11Å; I244-H246 VanDerWaalsContact C-N 3.33Å; I244-P268 HydrophobicContact CG2-CB 4.12Å; I244-I291 HydrophobicContact CD1-CG1 4.41Å; I244-I291 HydrophobicContact CG1-CD1 4.35Å; I244-I291 HydrophobicContact CG1-CG2 4.3Å; I244-I291 HydrophobicContact CG2-CG2 4.26Å; I244-F361 HydrophobicContact CD1-CE1 4.35Å; I244-E381 HydrophobicContact CB-CG 4.37Å; I244-E381 HydrophobicContact CD1-CB 4.2Å; I244-E381 HydrophobicContact CD1-CG 4.26Å; I244-E381 HydrophobicContact CG2-CG 4.18Å; I244-T383 HydrophobicContact CG2-CG2 3.65Å; I244-T383 WeakPolarHBondContact O-CG2 3.48Å
245	G	86.9	Confident	84.5	Confident	21 Å²	21	51 Å²	51	22%	0.216	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.1	170	0	0	0	0	0	114.3	N243	N243-G245 PolarHBondContact O-N 3.22Å; N243-G245 WeakPolarHBondContact OD1-CA 3.38Å; N243-G245 PolarHBondContact OD1-N 3.19Å
246	H	85.1	Confident	83.2	Confident	140 Å²	140	53.9 Å²	53.9	65%	0.648	28%	0.283	S	S	*	.			trans	-142.4	58.3	-167.8	-63.7	-40.3	0	0	0	113.2	N243 I244 N248	N243-H246 CarbonylContact O-C 3.6Å; N243-H246 VanDerWaalsContact O-C 3.25Å; N243-H246 PolarHBondContact O-N 2.97Å; I244-H246 VanDerWaalsContact C-N 3.33Å; H246-N248 PolarHBondContact O-N 3.02Å; H246-N248 PolarHBondContact O-ND2 3.16Å
247	L	86.3	Confident	81.7	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.089	29%	0.29	C	S	.	.			trans	-71	-8.4	-178	-62.5	167.8	0	0	0	115.2	F121 N243 T249 I291 T383 F385	F121-L247 HydrophobicContact CD1-CB 4.12Å; F121-L247 HydrophobicContact CD1-CD2 4.09Å; F121-L247 HydrophobicContact CE1-CB 4.04Å; F121-L247 HydrophobicContact CE1-CD1 4.36Å; F121-L247 HydrophobicContact CE1-CD2 4.01Å; F121-L247 HydrophobicContact CE1-CG 4.37Å; F121-L247 HydrophobicContact CE2-CD2 4.48Å; F121-L247 HydrophobicContact CG-CD2 4.35Å; F121-L247 HydrophobicContact CZ-CD2 4.21Å; N243-L247 WeakPolarHBondContact O-CD2 3.4Å; N243-L247 PolarHBondContact O-N 2.76Å; L247-T249 HydrophobicContact CB-CG2 3.74Å; L247-T249 VanDerWaalsContact O-CG2 3.29Å; L247-T249 WeakPolarHBondContact O-CG2 3.42Å; L247-I291 HydrophobicContact CD1-CG2 3.58Å; L247-I291 HydrophobicContact CD2-CD1 4.26Å; L247-T383 HydrophobicContact CD1-CG2 3.56Å; L247-F385 HydrophobicContact CD1-CB 4.14Å; L247-F385 HydrophobicContact CD1-CD1 4.45Å
248	N	79.4	Confident	80.3	Confident	129 Å²	129	48.7 Å²	48.7	69%	0.69	26%	0.263	S	S	*	.			trans	54.8	53.5	176.2	-71.3	-78.4	0	0	0	114.5	H246 D252	H246-N248 PolarHBondContact O-N 3.02Å; H246-N248 PolarHBondContact O-ND2 3.16Å; N248-D252 WeakPolarHBondContact CA-OD2 3.37Å
249	T	82.8	Confident	79	Confident	23 Å²	23	49.2 Å²	49.2	14%	0.141	27%	0.268	C	S	.	.			trans	-112.8	-175.5	-170	76.6	0	0	0	0	114	F121 L247 L251 D252 F385	F121-T249 HydrophobicContact CD1-CG2 4.22Å; F121-T249 HydrophobicContact CE1-CG2 3.94Å; L247-T249 HydrophobicContact CB-CG2 3.74Å; L247-T249 VanDerWaalsContact O-CG2 3.29Å; L247-T249 WeakPolarHBondContact O-CG2 3.42Å; T249-L251 PolarHBondContact O-N 3.06Å; T249-L251 PolarHBondContact OG1-N 3.14Å; T249-D252 VanDerWaalsContact N-CG 3.32Å; T249-D252 PolarHBondContact N-OD1 3.5Å; T249-D252 PolarHBondContact N-OD2 3.23Å; T249-D252 VanDerWaalsContact N-OD2 3.16Å; T249-D252 WeakPolarHBondContact O-CB 3.23Å; T249-D252 PolarHBondContact O-N 3.35Å; T249-D252 PolarHBondContact OG1-OD1 3.11Å; T249-F385 HydrophobicContact CG2-CB 3.96Å; T249-F385 HydrophobicContact CG2-CD2 4.4Å
250	L	82.8	Confident	77.5	Confident	13 Å²	13	50.6 Å²	50.6	7%	0.068	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.4	174.5	-61.8	-173.1	0	0	0	113	D252 M253 A386 L388 F414 L418 L448	L250-D252 PolarHBondContact O-N 3.46Å; L250-M253 HydrophobicContact CD2-SD 4.42Å; L250-M253 VanDerWaalsContact O-CB 3.24Å; L250-M253 WeakPolarHBondContact O-CB 3.35Å; L250-M253 VanDerWaalsContact O-CG 3.28Å; L250-M253 WeakPolarHBondContact O-CG 3.41Å; L250-M253 PolarHBondContact O-N 3.24Å; L250-M253 VanDerWaalsContact O-N 3.11Å; L250-A386 HydrophobicContact CB-CB 4.08Å; L250-A386 WeakPolarHBondContact CB-O 3.33Å; L250-A386 PolarHBondContact N-O 2.84Å; L250-A386 VanDerWaalsContact N-O 3.14Å; L250-L388 HydrophobicContact CD1-CB 4.5Å; L250-L388 HydrophobicContact CD1-CD2 3.81Å; L250-L388 HydrophobicContact CD1-CG 4.04Å; L250-F414 HydrophobicContact CB-CE1 4.27Å; L250-F414 WeakPolarHBondContact O-CE1 3.34Å; L250-L418 HydrophobicContact CD1-CD1 3.95Å; L250-L448 HydrophobicContact CD2-CD1 3.5Å; L250-L448 HydrophobicContact CD2-CD2 3.83Å; L250-L448 HydrophobicContact CD2-CG 4.34Å
251	L	80	Confident	76.1	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-32.6	-178.1	-169.4	54.3	0	0	0	111.1	T249 M253 V254 V265 N266 L288 N384 A386 I409	T249-L251 PolarHBondContact O-N 3.06Å; T249-L251 PolarHBondContact OG1-N 3.14Å; L251-M253 PolarHBondContact O-N 2.92Å; L251-M253 VanDerWaalsContact O-N 3.11Å; L251-V254 HydrophobicContact CD1-CG2 4.19Å; L251-V254 WeakPolarHBondContact O-CB 3.47Å; L251-V254 WeakPolarHBondContact O-CG2 3.44Å; L251-V254 PolarHBondContact O-N 2.83Å; L251-V265 HydrophobicContact CD2-CG1 4.22Å; L251-V265 WeakPolarHBondContact CD2-O 3.4Å; L251-N266 HydrophobicContact CD2-CB 4.31Å; L251-N266 HydrophobicContact CG-CB 4.26Å; L251-L288 HydrophobicContact CD1-CD1 4.44Å; L251-L288 HydrophobicContact CD1-CD2 4.37Å; L251-L288 HydrophobicContact CD2-CD1 4.24Å; L251-L288 HydrophobicContact CD2-CD2 4.49Å; L251-N384 HydrophobicContact CD2-CB 4.3Å; L251-N384 WeakPolarHBondContact CD2-O 3.26Å; L251-A386 HydrophobicContact CB-CB 3.98Å; L251-I409 HydrophobicContact CD1-CD1 3.92Å
252	D	71.3	Confident	74.8	Confident	37 Å²	37	46.4 Å²	46.4	20%	0.198	26%	0.262	C	S	.	.	H	α-helix	trans	-55	-28.1	173.4	-46.3	20.9	0	0	0	111.8	N248 T249 L250 V254 E255 Q256	N248-D252 WeakPolarHBondContact CA-OD2 3.37Å; T249-D252 VanDerWaalsContact N-CG 3.32Å; T249-D252 PolarHBondContact N-OD1 3.5Å; T249-D252 PolarHBondContact N-OD2 3.23Å; T249-D252 VanDerWaalsContact N-OD2 3.16Å; T249-D252 WeakPolarHBondContact O-CB 3.23Å; T249-D252 PolarHBondContact O-N 3.35Å; T249-D252 PolarHBondContact OG1-OD1 3.11Å; L250-D252 PolarHBondContact O-N 3.46Å; D252-V254 PolarHBondContact O-N 3.29Å; D252-V254 VanDerWaalsContact O-N 3.16Å; D252-E255 PolarHBondContact O-N 2.92Å; D252-Q256 WeakPolarHBondContact O-CB 3.41Å; D252-Q256 VanDerWaalsContact O-CG 3.23Å; D252-Q256 WeakPolarHBondContact O-CG 3.47Å; D252-Q256 PolarHBondContact O-N 3.03Å
253	M	68.5	Low	73	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-26.8	174.2	-59.5	-159.2	-49.5	0	0	112.7	L250 L251 E257 F414 L418 L448 W451	L250-M253 HydrophobicContact CD2-SD 4.42Å; L250-M253 VanDerWaalsContact O-CB 3.24Å; L250-M253 WeakPolarHBondContact O-CB 3.35Å; L250-M253 VanDerWaalsContact O-CG 3.28Å; L250-M253 WeakPolarHBondContact O-CG 3.41Å; L250-M253 PolarHBondContact O-N 3.24Å; L250-M253 VanDerWaalsContact O-N 3.11Å; L251-M253 PolarHBondContact O-N 2.92Å; L251-M253 VanDerWaalsContact O-N 3.11Å; M253-E257 VanDerWaalsContact O-CB 3.24Å; M253-E257 WeakPolarHBondContact O-CB 3.47Å; M253-E257 WeakPolarHBondContact O-CG 3.49Å; M253-E257 PolarHBondContact O-N 3.3Å; M253-F414 HydrophobicContact CE-CD1 3.45Å; M253-F414 VanDerWaalsContact CE-CD1 3.45Å; M253-F414 HydrophobicContact CE-CE1 3.66Å; M253-F414 HydrophobicContact CE-CG 4.36Å; M253-L418 HydrophobicContact CE-CD1 3.68Å; M253-L418 HydrophobicContact CE-CD2 4.36Å; M253-L418 HydrophobicContact CE-CG 4.12Å; M253-L448 HydrophobicContact SD-CD1 4.24Å; M253-W451 HydrophobicContact CB-CH2 4.34Å; M253-W451 HydrophobicContact CB-CZ2 4.35Å; M253-W451 HydrophobicContact CG-CE3 4.48Å; M253-W451 HydrophobicContact CG-CH2 3.57Å; M253-W451 HydrophobicContact CG-CZ2 3.96Å; M253-W451 HydrophobicContact CG-CZ3 3.86Å; M253-W451 HydrophobicContact SD-CD2 3.96Å; M253-W451 HydrophobicContact SD-CE3 3.77Å; M253-W451 HydrophobicContact SD-CH2 3.92Å; M253-W451 HydrophobicContact SD-CZ2 4.07Å; M253-W451 HydrophobicContact SD-CZ3 3.76Å
254	V	67.3	Low	71.3	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-51.7	177.1	-178.4	0	0	0	0	110.5	L251 D252 Q256 C258 I260 I409 F414	L251-V254 HydrophobicContact CD1-CG2 4.19Å; L251-V254 WeakPolarHBondContact O-CB 3.47Å; L251-V254 WeakPolarHBondContact O-CG2 3.44Å; L251-V254 PolarHBondContact O-N 2.83Å; D252-V254 PolarHBondContact O-N 3.29Å; D252-V254 VanDerWaalsContact O-N 3.16Å; V254-Q256 VanDerWaalsContact C-N 3.32Å; V254-Q256 PolarHBondContact O-N 3.32Å; V254-C258 WeakPolarHBondContact O-CA 3.37Å; V254-C258 WeakPolarHBondContact O-CB 3.41Å; V254-C258 PolarHBondContact O-N 3.16Å; V254-I260 HydrophobicContact CG1-CB 4.29Å; V254-I409 HydrophobicContact CG2-CG2 3.94Å; V254-F414 HydrophobicContact CG2-CE2 3.56Å; V254-F414 HydrophobicContact CG2-CZ 3.46Å; V254-F414 VanDerWaalsContact CG2-CZ 3.46Å
255	E	67.3	Low	70.1	Confident	93 Å²	93	52.2 Å²	52.2	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-61.3	-45.4	173.9	-173.9	-174.3	151.9	0	0	110.4	D252 E257 G259 I260 V261 N266	D252-E255 PolarHBondContact O-N 2.92Å; E255-E257 PolarHBondContact O-N 3.11Å; E255-G259 WeakPolarHBondContact O-CA 3.4Å; E255-G259 PolarHBondContact O-N 3.05Å; E255-I260 WeakPolarHBondContact CA-O 3.49Å; E255-V261 HydrophobicContact CG-CG2 3.99Å; E255-N266 PolarHBondContact OE2-ND2 2.97Å
256	Q	66.6	Low	69.4	Low	73 Å²	73	52.6 Å²	52.6	34%	0.341	29%	0.289	S	S	.	.	H	α-helix	trans	-72.6	-27.2	-171.4	-79.4	-160.8	60	0	0	115.5	D252 V254 R455	D252-Q256 WeakPolarHBondContact O-CB 3.41Å; D252-Q256 VanDerWaalsContact O-CG 3.23Å; D252-Q256 WeakPolarHBondContact O-CG 3.47Å; D252-Q256 PolarHBondContact O-N 3.03Å; V254-Q256 VanDerWaalsContact C-N 3.32Å; V254-Q256 PolarHBondContact O-N 3.32Å; Q256-R455 VanDerWaalsContact O-CZ 3.3Å; Q256-R455 PolarHBondContact O-NH1 3.44Å; Q256-R455 PolarHBondContact O-NH2 3.05Å; Q256-R455 VanDerWaalsContact OE1-CZ 3.23Å
257	E	62.8	Low	69.2	Low	79 Å²	79	47.5 Å²	47.5	37%	0.369	27%	0.268	S	S	.	.	H	α-helix	trans	-109	-29.2	178.1	-62.6	-70.9	124.1	0	0	113.3	M253 E255 V413 W451 R455	M253-E257 VanDerWaalsContact O-CB 3.24Å; M253-E257 WeakPolarHBondContact O-CB 3.47Å; M253-E257 WeakPolarHBondContact O-CG 3.49Å; M253-E257 PolarHBondContact O-N 3.3Å; E255-E257 PolarHBondContact O-N 3.11Å; E257-V413 HydrophobicContact CB-CG1 4.26Å; E257-V413 HydrophobicContact CG-CG1 4.39Å; E257-W451 VanDerWaalsContact CD-NE1 3.32Å; E257-W451 HydrophobicContact CG-CZ2 3.81Å; E257-W451 WeakPolarHBondContact OE1-CZ2 3.37Å; E257-W451 PolarHBondContact OE1-NE1 3.17Å; E257-R455 IonicContact OE1-CZ 3.38Å; E257-R455 IonicContact OE1-NH1 2.72Å; E257-R455 PolarHBondContact OE1-NH1 3.34Å
258	C	57.3	Low	69.3	Low	56 Å²	56	47.4 Å²	47.4	38%	0.378	27%	0.268	S	S	.	.	H	α-helix	trans	-103.6	-17.4	-178.1	-49.3	0	0	0	0	113.6	V254 I260	V254-C258 WeakPolarHBondContact O-CA 3.37Å; V254-C258 WeakPolarHBondContact O-CB 3.41Å; V254-C258 PolarHBondContact O-N 3.16Å; C258-I260 VanDerWaalsContact C-N 3.27Å; C258-I260 HydrophobicContact CB-CB 4.3Å; C258-I260 HydrophobicContact CB-CD1 3.76Å; C258-I260 HydrophobicContact CB-CG1 3.78Å
259	G	57.9	Low	70	Confident	66 Å²	66	43.2 Å²	43.2	68%	0.68	24%	0.243	S	C	*	.			trans	68	25.8	-170.7	0	0	0	0	0	113.3	E255	E255-G259 WeakPolarHBondContact O-CA 3.4Å; E255-G259 PolarHBondContact O-N 3.05Å
260	I	59.7	Low	70.7	Confident	65 Å²	65	42.2 Å²	42.2	33%	0.333	24%	0.237	S	C	.	.			trans	-109.7	113.3	-176.7	-57	174.1	0	0	0	109.2	V254 E255 C258 I262	V254-I260 HydrophobicContact CG1-CB 4.29Å; E255-I260 WeakPolarHBondContact CA-O 3.49Å; C258-I260 VanDerWaalsContact C-N 3.27Å; C258-I260 HydrophobicContact CB-CB 4.3Å; C258-I260 HydrophobicContact CB-CD1 3.76Å; C258-I260 HydrophobicContact CB-CG1 3.78Å; I260-I262 HydrophobicContact CG2-CD1 4.34Å; I260-I262 HydrophobicContact CG2-CG1 3.81Å
261	V	59.7	Low	71.4	Confident	82 Å²	82	43.2 Å²	43.2	50%	0.497	24%	0.24	S	C	.	.			trans	-88.8	141.7	162.1	-179.6	0	0	0	0	108.3	E255 T267	E255-V261 HydrophobicContact CG-CG2 3.99Å; V261-T267 HydrophobicContact CG1-CG2 3.52Å
262	I	65.6	Low	72.3	Confident	31 Å²	31	43 Å²	43	16%	0.159	24%	0.239	C	C	.	.			trans	-129.4	103.7	180	-51.7	178.8	0	0	0	107.3	I260 G264 V265 N266 V407 I409	I260-I262 HydrophobicContact CG2-CD1 4.34Å; I260-I262 HydrophobicContact CG2-CG1 3.81Å; I262-G264 PolarHBondContact O-N 3.11Å; I262-V265 HydrophobicContact CB-CB 4Å; I262-V265 HydrophobicContact CG2-CB 3.7Å; I262-V265 HydrophobicContact CG2-CG1 4.31Å; I262-V265 HydrophobicContact CG2-CG2 3.71Å; I262-V265 PolarHBondContact O-N 3.24Å; I262-N266 PolarHBondContact N-OD1 3.07Å; I262-N266 PolarHBondContact O-N 2.8Å; I262-N266 PolarHBondContact O-OD1 3.47Å; I262-V407 HydrophobicContact CG2-CG1 4.23Å; I262-V407 HydrophobicContact CG2-CG2 4.42Å; I262-I409 HydrophobicContact CD1-CG1 3.91Å
263	E	58.7	Low	73.5	Confident	135 Å²	135	41.3 Å²	41.3	63%	0.631	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	132.8	-177.1	-62.1	177.2	168.7	0	0	111.7	V265 T267 Y269	E263-V265 PolarHBondContact O-N 2.83Å; E263-T267 WeakPolarHBondContact CA-OG1 3.43Å; E263-Y269 HydrophobicContact CB-CE1 4.25Å; E263-Y269 WeakPolarHBondContact CB-OH 3.32Å; E263-Y269 PolarHBondContact O-OH 2.84Å
264	G	58.2	Low	75	Confident	10 Å²	10	41.1 Å²	41.1	10%	0.103	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-11.8	-176.6	0	0	0	0	0	115.5	I262 T267 Y269	I262-G264 PolarHBondContact O-N 3.11Å; G264-T267 CarbonylContact C-O 3.2Å; G264-T267 VanDerWaalsContact CA-O 3.29Å; G264-T267 WeakPolarHBondContact CA-O 3.44Å; G264-T267 PolarHBondContact N-OG1 2.9Å; G264-Y269 VanDerWaalsContact CA-CD2 3.49Å; G264-Y269 VanDerWaalsContact CA-CZ 3.42Å
265	V	68.6	Low	76.4	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.03	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-44.9	-173.4	179.2	0	0	0	0	110.9	L251 I262 E263 L288 T383 N384 V407 I409	L251-V265 HydrophobicContact CD2-CG1 4.22Å; L251-V265 WeakPolarHBondContact CD2-O 3.4Å; I262-V265 HydrophobicContact CB-CB 4Å; I262-V265 HydrophobicContact CG2-CB 3.7Å; I262-V265 HydrophobicContact CG2-CG1 4.31Å; I262-V265 HydrophobicContact CG2-CG2 3.71Å; I262-V265 PolarHBondContact O-N 3.24Å; E263-V265 PolarHBondContact O-N 2.83Å; V265-L288 HydrophobicContact CG1-CD1 3.81Å; V265-T383 PolarHBondContact O-OG1 3.02Å; V265-N384 HydrophobicContact CG1-CB 4.26Å; V265-N384 CarbonylContact O-C 3.59Å; V265-N384 WeakPolarHBondContact O-CB 3.23Å; V265-N384 PolarHBondContact O-N 3.02Å; V265-N384 VanDerWaalsContact O-O 3.08Å; V265-V407 HydrophobicContact CG2-CG1 4.02Å; V265-V407 HydrophobicContact CG2-CG2 3.91Å; V265-I409 HydrophobicContact CG1-CD1 4.06Å
266	N	72.4	Confident	77.9	Confident	29 Å²	29	37.7 Å²	37.7	16%	0.155	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	16.1	163.2	82.5	-57.1	0	0	0	112.7	L251 E255 I262	L251-N266 HydrophobicContact CD2-CB 4.31Å; L251-N266 HydrophobicContact CG-CB 4.26Å; E255-N266 PolarHBondContact OE2-ND2 2.97Å; I262-N266 PolarHBondContact N-OD1 3.07Å; I262-N266 PolarHBondContact O-N 2.8Å; I262-N266 PolarHBondContact O-OD1 3.47Å
267	T	79.9	Confident	79.4	Confident	32 Å²	32	34.2 Å²	34.2	20%	0.196	19%	0.194	C	C	.	.	S	Bend	trans	-126.6	149.7	169.7	78.3	0	0	0	0	109.5	V261 E263 G264 T383	V261-T267 HydrophobicContact CG1-CG2 3.52Å; E263-T267 WeakPolarHBondContact CA-OG1 3.43Å; G264-T267 CarbonylContact C-O 3.2Å; G264-T267 VanDerWaalsContact CA-O 3.29Å; G264-T267 WeakPolarHBondContact CA-O 3.44Å; G264-T267 PolarHBondContact N-OG1 2.9Å; T267-T383 PolarHBondContact O-OG1 3.24Å
268	P	89.1	Confident	81	Confident	16 Å²	16	30.6 Å²	30.6	10%	0.104	18%	0.178	C	C	.	.			trans	-72.2	144.7	177.8	27.1	-31.2	0	0	0	112	G232 I244 E381	G232-P268 PolarHBondContact N-O 2.79Å; G232-P268 CarbonylContact O-C 3.51Å; G232-P268 WeakPolarHBondContact O-CB 3.24Å; G232-P268 WeakPolarHBondContact O-CG 3.4Å; I244-P268 HydrophobicContact CG2-CB 4.12Å; P268-E381 HydrophobicContact CB-CG 3.98Å; P268-E381 VanDerWaalsContact CB-OE1 3.32Å; P268-E381 WeakPolarHBondContact CB-OE1 3.43Å
269	Y	93.8	Very high	83	Confident	40 Å²	40	29.2 Å²	29.2	16%	0.157	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.2	171.6	-83.8	-6.6	0	0	0	110.7	D229 V230 S231 E263 G264 Y271 E381 S382	D229-Y269 HydrophobicContact CB-CD2 3.99Å; D229-Y269 HydrophobicContact CB-CE2 3.93Å; V230-Y269 WeakPolarHBondContact O-CA 3.28Å; S231-Y269 WeakPolarHBondContact OG-CE1 3.33Å; E263-Y269 HydrophobicContact CB-CE1 4.25Å; E263-Y269 WeakPolarHBondContact CB-OH 3.32Å; E263-Y269 PolarHBondContact O-OH 2.84Å; G264-Y269 VanDerWaalsContact CA-CD2 3.49Å; G264-Y269 VanDerWaalsContact CA-CZ 3.42Å; Y269-Y271 WeakPolarHBondContact CD2-OH 3.35Å; Y269-Y271 WeakPolarHBondContact O-CD2 3.36Å; Y269-Y271 WeakPolarHBondContact O-CE2 3.33Å; Y269-E381 WeakPolarHBondContact O-CA 3.23Å; Y269-S382 PolarHBondContact N-O 3.45Å; Y269-S382 PolarHBondContact O-N 3.38Å
270	L	96.7	Very high	84.9	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.2	176.7	-56.5	169.7	0	0	0	111.2	M159 V230 I234 F272 A380 E381	M159-L270 HydrophobicContact CE-CD1 3.77Å; M159-L270 HydrophobicContact SD-CD1 3.98Å; V230-L270 HydrophobicContact CB-CB 4.21Å; V230-L270 PolarHBondContact N-O 2.68Å; V230-L270 PolarHBondContact O-N 3.23Å; I234-L270 HydrophobicContact CD1-CD2 4.2Å; I234-L270 HydrophobicContact CG1-CD2 3.85Å; I234-L270 HydrophobicContact CG2-CD1 3.88Å; I234-L270 HydrophobicContact CG2-CD2 4.26Å; L270-F272 HydrophobicContact CB-CE2 3.91Å; L270-F272 HydrophobicContact CB-CZ 4.49Å; L270-A380 CarbonylContact C-O 3.58Å; L270-A380 WeakPolarHBondContact CA-O 3.12Å; L270-E381 HydrophobicContact CD2-CB 3.77Å; L270-E381 HydrophobicContact CD2-CG 3.76Å; L270-E381 WeakPolarHBondContact CD2-OE2 3.43Å
271	Y	97.7	Very high	86.7	Confident	35 Å²	35	23.1 Å²	23.1	14%	0.137	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	97.2	-172.2	-69.7	-86	0	0	0	111.3	Y226 G227 A228 D229 Y269 G273 C379 A380 S382	Y226-Y271 HydrophobicContact CE1-CD1 4.09Å; Y226-Y271 AromaticContact CZ-CD1 3.87Å; G227-Y271 CarbonylContact O-C 3.4Å; G227-Y271 WeakPolarHBondContact O-CA 3.49Å; A228-Y271 HydrophobicContact CB-CD1 3.77Å; A228-Y271 HydrophobicContact CB-CE1 3.82Å; D229-Y271 WeakPolarHBondContact OD1-CE1 3.13Å; D229-Y271 VanDerWaalsContact OD1-CZ 3.25Å; D229-Y271 PolarHBondContact OD1-OH 2.71Å; Y269-Y271 WeakPolarHBondContact CD2-OH 3.35Å; Y269-Y271 WeakPolarHBondContact O-CD2 3.36Å; Y269-Y271 WeakPolarHBondContact O-CE2 3.33Å; Y271-G273 PolarHBondContact O-N 3.43Å; Y271-C379 WeakPolarHBondContact O-CA 3.42Å; Y271-A380 PolarHBondContact N-O 3.45Å; Y271-A380 PolarHBondContact O-N 2.94Å; Y271-S382 WeakPolarHBondContact CD2-OG 3.37Å; Y271-S382 WeakPolarHBondContact CE2-OG 3.2Å
272	F	98.4	Very high	88.6	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	107.4	175.8	-62.9	-85.8	0	0	0	110.1	M159 I161 V188 Y191 Y226 G227 L270 F296 N378 C379	M159-F272 HydrophobicContact CE-CE2 3.43Å; M159-F272 VanDerWaalsContact CE-CE2 3.43Å; M159-F272 HydrophobicContact CE-CZ 3.44Å; M159-F272 VanDerWaalsContact CE-CZ 3.44Å; I161-F272 HydrophobicContact CD1-CB 3.86Å; I161-F272 HydrophobicContact CD1-CD2 3.89Å; I161-F272 HydrophobicContact CD1-CG 3.84Å; I161-F272 HydrophobicContact CG1-CD2 4.01Å; I161-F272 HydrophobicContact CG1-CE2 4.47Å; I161-F272 HydrophobicContact CG1-CG 4.44Å; V188-F272 HydrophobicContact CB-CE1 4.25Å; V188-F272 HydrophobicContact CG1-CD1 3.89Å; V188-F272 HydrophobicContact CG1-CE1 3.71Å; V188-F272 HydrophobicContact CG2-CD1 3.85Å; V188-F272 HydrophobicContact CG2-CD2 4.42Å; V188-F272 HydrophobicContact CG2-CE1 3.4Å; V188-F272 HydrophobicContact CG2-CE2 4.05Å; V188-F272 HydrophobicContact CG2-CG 4.34Å; V188-F272 HydrophobicContact CG2-CZ 3.52Å; Y191-F272 HydrophobicContact CD1-CB 4.05Å; Y191-F272 HydrophobicContact CE1-CB 3.77Å; Y191-F272 VanDerWaalsContact CZ-O 3.28Å; Y191-F272 PolarHBondContact OH-O 3.17Å; Y226-F272 WeakPolarHBondContact CD2-O 3.32Å; G227-F272 PolarHBondContact N-O 3.37Å; G227-F272 PolarHBondContact O-N 2.9Å; L270-F272 HydrophobicContact CB-CE2 3.91Å; L270-F272 HydrophobicContact CB-CZ 4.49Å; F272-F296 HydrophobicContact CE1-CZ 4.38Å; F272-N378 CarbonylContact C-O 3.6Å; F272-N378 VanDerWaalsContact CA-O 3.31Å; F272-N378 WeakPolarHBondContact CA-O 3.44Å; F272-C379 HydrophobicContact CD1-CB 3.82Å; F272-C379 HydrophobicContact CE1-CB 3.66Å; F272-C379 WeakPolarHBondContact CE1-SG 3.08Å; F272-C379 HydrophobicContact CZ-CB 4.39Å; F272-C379 WeakPolarHBondContact CZ-SG 3.37Å
273	G	97.9	Very high	90.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	153.6	179.4	0	0	0	0	0	113.5	Y191 Y271 T277 G376 F377 N378	Y191-G273 WeakPolarHBondContact CE1-O 3.23Å; Y191-G273 PolarHBondContact OH-O 2.82Å; Y271-G273 PolarHBondContact O-N 3.43Å; G273-T277 WeakPolarHBondContact CA-OG1 3.47Å; G273-G376 CarbonylContact C-O 3.6Å; G273-F377 VanDerWaalsContact O-CA 3.29Å; G273-F377 WeakPolarHBondContact O-CA 3.38Å; G273-N378 WeakPolarHBondContact CA-OD1 3.44Å; G273-N378 PolarHBondContact N-O 2.89Å; G273-N378 PolarHBondContact N-OD1 2.76Å; G273-N378 VanDerWaalsContact N-OD1 3.14Å; G273-N378 PolarHBondContact O-N 3.04Å
274	M	98.5	Very high	91.8	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.063	C	C	.	.			trans	-131.8	172.4	158.7	70.6	172.3	61.1	0	0	109.1	Y191 L194 A195 Y200 P224 I225 K276 T277 G376	Y191-M274 HydrophobicContact CD2-CE 4.21Å; Y191-M274 HydrophobicContact CE1-CE 4.39Å; Y191-M274 HydrophobicContact CE2-CE 3.58Å; Y191-M274 PolarHBondContact OH-N 3.22Å; Y191-M274 VanDerWaalsContact OH-N 3.14Å; L194-M274 HydrophobicContact CD2-CE 4.43Å; L194-M274 HydrophobicContact CG-CE 4.38Å; A195-M274 HydrophobicContact CB-CB 3.59Å; A195-M274 HydrophobicContact CB-CE 4.08Å; Y200-M274 HydrophobicContact CD1-SD 4.08Å; Y200-M274 HydrophobicContact CG-SD 3.98Å; P224-M274 HydrophobicContact CB-CG 4.1Å; P224-M274 HydrophobicContact CB-SD 4.21Å; I225-M274 HydrophobicContact CB-CE 4.06Å; I225-M274 HydrophobicContact CB-SD 4.47Å; I225-M274 WeakPolarHBondContact O-CE 3.38Å; I225-M274 VanDerWaalsContact O-CG 3.29Å; I225-M274 WeakPolarHBondContact O-CG 3.41Å; M274-K276 PolarHBondContact O-N 3.06Å; M274-T277 HydrophobicContact CB-CG2 4.38Å; M274-T277 HydrophobicContact CG-CG2 3.51Å; M274-T277 PolarHBondContact N-OG1 3.42Å; M274-T277 VanDerWaalsContact N-OG1 3.09Å; M274-T277 WeakPolarHBondContact O-CB 3.49Å; M274-T277 WeakPolarHBondContact O-CG2 3.42Å; M274-T277 PolarHBondContact O-N 3.43Å; M274-T277 PolarHBondContact O-OG1 2.99Å; M274-G376 CarbonylContact C-O 3.57Å; M274-G376 WeakPolarHBondContact CA-O 3.14Å
275	W	98.3	Very high	93.4	Very high	25 Å²	25	13.3 Å²	13.3	10%	0.095	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	135.1	179.3	162.7	-122	0	0	0	111.8	Y200 P203 L211 K214 P224 T277 F373	Y200-W275 WeakPolarHBondContact O-CB 3.33Å; P203-W275 VanDerWaalsContact CD-NE1 3.28Å; P203-W275 HydrophobicContact CG-CH2 4.36Å; P203-W275 HydrophobicContact CG-CZ2 3.65Å; L211-W275 HydrophobicContact CD1-CE3 4.05Å; L211-W275 HydrophobicContact CD1-CH2 3.41Å; L211-W275 VanDerWaalsContact CD1-CH2 3.41Å; L211-W275 HydrophobicContact CD1-CZ2 4.13Å; L211-W275 HydrophobicContact CD1-CZ3 3.38Å; L211-W275 HydrophobicContact CD2-CZ3 4.13Å; L211-W275 HydrophobicContact CG-CE3 4.46Å; L211-W275 HydrophobicContact CG-CH2 3.89Å; L211-W275 HydrophobicContact CG-CZ3 3.59Å; K214-W275 HydrophobicContact CB-CH2 4.44Å; K214-W275 HydrophobicContact CB-CZ2 4.45Å; P224-W275 WeakPolarHBondContact CB-O 3.09Å; W275-T277 PolarHBondContact O-N 3.25Å; W275-F373 HydrophobicContact CZ3-CD2 4.14Å; W275-F373 AromaticContact CZ3-CE2 3.99Å; W275-F373 HydrophobicContact CZ3-CE2 3.99Å
276	K	97.4	Very high	94.6	Very high	10 Å²	10	13.4 Å²	13.4	4%	0.043	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-1.8	-171.2	-51.1	171	49.1	-176.5	0	116.9	Y215 N218 L219 V222 P224 M274 T278 N374	Y215-K276 HydrophobicContact CD2-CB 4.33Å; Y215-K276 HydrophobicContact CD2-CG 4.41Å; Y215-K276 HydrophobicContact CE2-CB 4.49Å; N218-K276 WeakPolarHBondContact O-CE 3.24Å; N218-K276 PolarHBondContact O-NZ 3.28Å; L219-K276 WeakPolarHBondContact O-CE 3.29Å; L219-K276 PolarHBondContact O-NZ 3.44Å; V222-K276 PolarHBondContact O-NZ 2.68Å; P224-K276 HydrophobicContact CB-CB 4.39Å; P224-K276 HydrophobicContact CG-CB 4Å; M274-K276 PolarHBondContact O-N 3.06Å; K276-T278 PolarHBondContact O-N 2.71Å; K276-T278 PolarHBondContact O-OG1 3.48Å; K276-N374 PolarHBondContact N-O 3.11Å
277	T	98.3	Very high	95.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.058	C	C	.	.			trans	-61.7	129.6	174.3	52.7	0	0	0	0	109.5	P224 I225 Y226 G273 M274 W275 F373 N374	P224-T277 HydrophobicContact CB-CG2 3.82Å; P224-T277 HydrophobicContact CG-CG2 4.23Å; I225-T277 WeakPolarHBondContact O-CG2 3.35Å; Y226-T277 HydrophobicContact CD2-CG2 3.88Å; Y226-T277 HydrophobicContact CG-CG2 4.02Å; G273-T277 WeakPolarHBondContact CA-OG1 3.47Å; M274-T277 HydrophobicContact CB-CG2 4.38Å; M274-T277 HydrophobicContact CG-CG2 3.51Å; M274-T277 PolarHBondContact N-OG1 3.42Å; M274-T277 VanDerWaalsContact N-OG1 3.09Å; M274-T277 WeakPolarHBondContact O-CB 3.49Å; M274-T277 WeakPolarHBondContact O-CG2 3.42Å; M274-T277 PolarHBondContact O-N 3.43Å; M274-T277 PolarHBondContact O-OG1 2.99Å; W275-T277 PolarHBondContact O-N 3.25Å; T277-F373 CarbonylContact O-C 3.49Å; T277-F373 VanDerWaalsContact O-CA 3.25Å; T277-F373 WeakPolarHBondContact O-CA 3.26Å; T277-N374 PolarHBondContact O-N 3.32Å; T277-N374 PolarHBondContact O-ND2 3.17Å; T277-N374 WeakPolarHBondContact OG1-CB 3.49Å; T277-N374 PolarHBondContact OG1-ND2 2.87Å
278	T	97.9	Very high	96.5	Very high	4 Å²	4	10.8 Å²	10.8	3%	0.025	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	141	-158.1	-63.7	0	0	0	0	110.7	Q167 Y215 K276 L338 G372	Q167-T278 PolarHBondContact NE2-O 2.97Å; Y215-T278 WeakPolarHBondContact CE2-OG1 3.4Å; Y215-T278 VanDerWaalsContact OH-CG2 3.26Å; Y215-T278 WeakPolarHBondContact OH-CG2 3.11Å; Y215-T278 PolarHBondContact OH-OG1 3.25Å; Y215-T278 VanDerWaalsContact OH-OG1 3.09Å; K276-T278 PolarHBondContact O-N 2.71Å; K276-T278 PolarHBondContact O-OG1 3.48Å; T278-L338 HydrophobicContact CG2-CD1 3.95Å; T278-L338 HydrophobicContact CG2-CD2 3.55Å; T278-L338 HydrophobicContact CG2-CG 4.43Å; T278-G372 WeakPolarHBondContact CA-O 3.4Å
279	F	97.8	Very high	96.9	Very high	26 Å²	26	10 Å²	10	11%	0.114	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.6	163.4	53.9	-79.3	0	0	0	109	K300 W302 A371 G372	F279-K300 HydrophobicContact CE1-CD 3.82Å; F279-K300 HydrophobicContact CE1-CG 3.81Å; F279-K300 HydrophobicContact CZ-CD 4.17Å; F279-K300 HydrophobicContact CZ-CG 4.26Å; F279-W302 AromaticContact CE2-CD2 3.95Å; F279-W302 HydrophobicContact CE2-CD2 3.95Å; F279-W302 AromaticContact CE2-CE3 3.49Å; F279-W302 HydrophobicContact CE2-CE3 3.49Å; F279-W302 VanDerWaalsContact CE2-CE3 3.49Å; F279-W302 HydrophobicContact CE2-CH2 4.34Å; F279-W302 AromaticContact CE2-CZ3 3.71Å; F279-W302 HydrophobicContact CE2-CZ3 3.71Å; F279-W302 AromaticContact CZ-CD2 3.64Å; F279-W302 HydrophobicContact CZ-CD2 3.64Å; F279-W302 AromaticContact CZ-CE2 3.98Å; F279-W302 AromaticContact CZ-CE3 3.7Å; F279-W302 HydrophobicContact CZ-CE3 3.7Å; F279-W302 HydrophobicContact CZ-CG 4.1Å; F279-W302 HydrophobicContact CZ-CH2 4.39Å; F279-W302 HydrophobicContact CZ-CZ2 4.35Å; F279-W302 HydrophobicContact CZ-CZ3 4.08Å; F279-A371 CarbonylContact O-C 3.59Å; F279-A371 WeakPolarHBondContact O-CA 3.47Å; F279-G372 WeakPolarHBondContact CD1-O 3.36Å; F279-G372 VanDerWaalsContact CE2-N 3.32Å; F279-G372 PolarHBondContact N-O 3.32Å; F279-G372 PolarHBondContact O-N 2.9Å
280	A	98.1	Very high	97.1	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.008	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	172.5	-169.7	0	0	0	0	0	113.3	H282 K335 L338 H370	A280-H282 PolarHBondContact O-N 2.95Å; A280-H282 VanDerWaalsContact O-N 3.1Å; A280-H282 PolarHBondContact O-ND1 2.89Å; A280-K335 VanDerWaalsContact CB-O 3.28Å; A280-K335 WeakPolarHBondContact CB-O 3.27Å; A280-L338 HydrophobicContact CB-CD2 3.55Å; A280-H370 VanDerWaalsContact O-O 3.05Å
281	W	98.5	Very high	97.2	Very high	2 Å²	2	8.4 Å²	8.4	1%	0.008	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	110.8	176.4	-77	105.6	0	0	0	111.5	Y303 V305 L313 T337 I339 L344 H370 A371	W281-Y303 HydrophobicContact CZ2-CG 4.42Å; W281-V305 HydrophobicContact CH2-CG2 3.95Å; W281-V305 HydrophobicContact CZ3-CB 4.43Å; W281-V305 HydrophobicContact CZ3-CG2 3.85Å; W281-L313 HydrophobicContact CD2-CD2 4.09Å; W281-L313 HydrophobicContact CE3-CD2 3.71Å; W281-L313 HydrophobicContact CG-CD2 4.47Å; W281-L313 HydrophobicContact CZ3-CD2 4.28Å; W281-T337 PolarHBondContact N-O 2.72Å; W281-T337 VanDerWaalsContact N-O 3.08Å; W281-I339 PolarHBondContact NE1-O 2.84Å; W281-L344 HydrophobicContact CH2-CD1 3.98Å; W281-L344 HydrophobicContact CZ2-CD1 3.5Å; W281-L344 VanDerWaalsContact CZ2-CD1 3.5Å; W281-H370 WeakPolarHBondContact CA-O 3.46Å; W281-A371 HydrophobicContact CB-CB 4.44Å; W281-A371 HydrophobicContact CD2-CB 3.5Å; W281-A371 VanDerWaalsContact CD2-CB 3.5Å; W281-A371 HydrophobicContact CE3-CB 3.92Å; W281-A371 HydrophobicContact CG-CB 3.75Å; W281-A371 HydrophobicContact CH2-CB 4.44Å; W281-A371 HydrophobicContact CZ2-CB 4.05Å; W281-A371 HydrophobicContact CZ3-CB 4.38Å
282	H	98.1	Very high	97.2	Very high	8 Å²	8	7.1 Å²	7.1	4%	0.037	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	168.4	176.8	71.3	-62.7	0	0	0	111.7	A280 K335 Y369 H370	A280-H282 PolarHBondContact O-N 2.95Å; A280-H282 VanDerWaalsContact O-N 3.1Å; A280-H282 PolarHBondContact O-ND1 2.89Å; H282-K335 HydrophobicContact CB-CG 4.15Å; H282-K335 WeakPolarHBondContact CD2-CE 3.44Å; H282-K335 PolarHBondContact CD2-NZ 3.15Å; H282-K335 VanDerWaalsContact CD2-NZ 3.26Å; H282-K335 WeakPolarHBondContact NE2-CE 3.48Å; H282-K335 PolarHBondContact NE2-NZ 3.05Å; H282-Y369 WeakPolarHBondContact O-CA 3.18Å; H282-H370 AromaticContact CE1-CD2 3.83Å; H282-H370 AromaticContact CE1-CE1 3.92Å; H282-H370 AromaticContact CE1-NE2 3.17Å; H282-H370 PolarHBondContact CE1-NE2 3.05Å; H282-H370 PolarHBondContact N-O 3.23Å; H282-H370 VanDerWaalsContact N-O 3.1Å; H282-H370 AromaticContact ND1-NE2 3.81Å; H282-H370 AromaticContact NE2-NE2 3.62Å; H282-H370 PolarHBondContact O-N 3.3Å
283	T	97.9	Very high	97.2	Very high	3 Å²	3	7.5 Å²	7.5	2%	0.018	4%	0.036	C	C	.	.			trans	-107.1	161.7	157.9	52.5	0	0	0	0	108.4	D287 R333 Y367 Y369	T283-D287 VanDerWaalsContact CB-OD1 3.23Å; T283-D287 WeakPolarHBondContact CB-OD1 3.27Å; T283-D287 PolarHBondContact OG1-OD1 2.99Å; T283-R333 PolarHBondContact OG1-NH1 3.14Å; T283-Y367 HydrophobicContact CG2-CD2 4.07Å; T283-Y369 HydrophobicContact CG2-CD1 3.89Å; T283-Y369 HydrophobicContact CG2-CD2 3.64Å; T283-Y369 HydrophobicContact CG2-CE1 3.98Å; T283-Y369 HydrophobicContact CG2-CE2 3.76Å; T283-Y369 HydrophobicContact CG2-CG 3.72Å
284	E	95.2	Very high	97.2	Very high	19 Å²	19	7.5 Å²	7.5	9%	0.089	4%	0.036	C	C	.	.			trans	-59.9	157.2	174.5	-62.9	-56.7	159.2	0	0	112.6	D287 L288 S290 R333 H370 N384	E284-D287 VanDerWaalsContact O-CA 3.27Å; E284-D287 WeakPolarHBondContact O-CA 3.48Å; E284-D287 PolarHBondContact O-N 2.99Å; E284-L288 HydrophobicContact CB-CB 4.17Å; E284-L288 WeakPolarHBondContact CB-O 3.37Å; E284-S290 VanDerWaalsContact CD-CB 3.47Å; E284-S290 VanDerWaalsContact CD-OG 3.28Å; E284-S290 WeakPolarHBondContact OE1-CB 3.28Å; E284-S290 PolarHBondContact OE1-OG 2.88Å; E284-R333 PolarHBondContact O-NH1 3.23Å; E284-H370 IonicContact OE1-CE1 2.72Å; E284-H370 PolarHBondContact OE1-CE1 3.3Å; E284-H370 VanDerWaalsContact OE1-CE1 3.28Å; E284-H370 IonicContact OE1-NE2 2.75Å; E284-N384 VanDerWaalsContact CD-ND2 3.3Å; E284-N384 WeakPolarHBondContact CG-ND2 3.32Å; E284-N384 PolarHBondContact OE2-ND2 2.9Å
285	D	91.4	Very high	97.2	Very high	22 Å²	22	7.6 Å²	7.6	12%	0.118	4%	0.036	C	C	.	.	G	3₁₀ helix	trans	-63.6	140.7	176.4	-85.2	-56.8	0	0	0	111.3	D287 L288 V407	D285-D287 PolarHBondContact O-N 2.81Å; D285-L288 WeakPolarHBondContact O-CB 3.12Å; D285-L288 WeakPolarHBondContact O-CD1 3.46Å; D285-L288 WeakPolarHBondContact O-CG 3.2Å; D285-L288 PolarHBondContact O-N 3.18Å; D285-V407 HydrophobicContact CB-CB 3.81Å; D285-V407 HydrophobicContact CB-CG1 3.94Å; D285-V407 HydrophobicContact CB-CG2 4.32Å
286	M	92.7	Very high	97.1	Very high	7 Å²	7	7.5 Å²	7.5	3%	0.034	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	52.5	19.9	-166.3	-57.5	-67.7	-51.7	0	0	114.5	L288 W390 G394 L399 I409 M411	M286-L288 HydrophobicContact CB-CG 4.48Å; M286-L288 PolarHBondContact O-N 3.36Å; M286-W390 HydrophobicContact CB-CZ2 4.06Å; M286-W390 PolarHBondContact O-NE1 3.33Å; M286-G394 WeakPolarHBondContact CE-O 3.49Å; M286-G394 WeakPolarHBondContact O-CA 3.39Å; M286-L399 HydrophobicContact SD-CD1 3.89Å; M286-L399 HydrophobicContact SD-CD2 3.64Å; M286-L399 HydrophobicContact SD-CG 4.4Å; M286-I409 HydrophobicContact CB-CD1 4.21Å; M286-I409 HydrophobicContact CE-CB 4.43Å; M286-I409 HydrophobicContact CG-CB 3.84Å; M286-I409 HydrophobicContact CG-CD1 3.89Å; M286-I409 HydrophobicContact CG-CG1 3.78Å; M286-I409 HydrophobicContact SD-CB 4.43Å; M286-I409 PolarHBondContact SD-N 3.11Å; M286-I409 VanDerWaalsContact SD-N 3.43Å; M286-M411 HydrophobicContact CE-CG 4.11Å; M286-M411 HydrophobicContact CE-SD 3.97Å
287	D	96.4	Very high	97.1	Very high	6 Å²	6	8.1 Å²	8.1	3%	0.032	5%	0.045	C	C	.	.	G	3₁₀ helix	trans	52.4	39.4	-175.2	-58.5	-37.8	0	0	0	113.3	T283 E284 D285 R333 P366 A397	T283-D287 VanDerWaalsContact CB-OD1 3.23Å; T283-D287 WeakPolarHBondContact CB-OD1 3.27Å; T283-D287 PolarHBondContact OG1-OD1 2.99Å; E284-D287 VanDerWaalsContact O-CA 3.27Å; E284-D287 WeakPolarHBondContact O-CA 3.48Å; E284-D287 PolarHBondContact O-N 2.99Å; D285-D287 PolarHBondContact O-N 2.81Å; D287-R333 IonicContact OD1-CZ 3.17Å; D287-R333 IonicContact OD1-NH1 2.78Å; D287-R333 PolarHBondContact OD1-NH1 3.2Å; D287-R333 IonicContact OD1-NH2 2.72Å; D287-R333 PolarHBondContact OD1-NH2 3.37Å; D287-R333 IonicContact OD2-NH2 3.21Å; D287-R333 PolarHBondContact OD2-NH2 3.16Å; D287-P366 VanDerWaalsContact O-CA 3.24Å; D287-P366 WeakPolarHBondContact O-CA 3.1Å; D287-P366 VanDerWaalsContact O-CB 3.27Å; D287-P366 WeakPolarHBondContact O-CB 3.43Å; D287-A397 HydrophobicContact CB-CB 4.24Å; D287-A397 VanDerWaalsContact OD2-CA 3.26Å; D287-A397 WeakPolarHBondContact OD2-CA 3.21Å; D287-A397 VanDerWaalsContact OD2-CB 3.29Å; D287-A397 WeakPolarHBondContact OD2-CB 3.41Å
288	L	96.6	Very high	97.1	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.065	C	C	.	.			trans	-62.9	176.2	172.6	-78.6	164.5	0	0	0	113.5	L251 V265 E284 D285 M286 N384 F385 A386 W390 I409	L251-L288 HydrophobicContact CD1-CD1 4.44Å; L251-L288 HydrophobicContact CD1-CD2 4.37Å; L251-L288 HydrophobicContact CD2-CD1 4.24Å; L251-L288 HydrophobicContact CD2-CD2 4.49Å; V265-L288 HydrophobicContact CG1-CD1 3.81Å; E284-L288 HydrophobicContact CB-CB 4.17Å; E284-L288 WeakPolarHBondContact CB-O 3.37Å; D285-L288 WeakPolarHBondContact O-CB 3.12Å; D285-L288 WeakPolarHBondContact O-CD1 3.46Å; D285-L288 WeakPolarHBondContact O-CG 3.2Å; D285-L288 PolarHBondContact O-N 3.18Å; M286-L288 HydrophobicContact CB-CG 4.48Å; M286-L288 PolarHBondContact O-N 3.36Å; L288-N384 HydrophobicContact CB-CB 4.03Å; L288-N384 HydrophobicContact CD1-CB 3.7Å; L288-N384 HydrophobicContact CG-CB 4.42Å; L288-F385 WeakPolarHBondContact CD2-O 3.27Å; L288-A386 HydrophobicContact CD2-CB 3.83Å; L288-W390 HydrophobicContact CD2-CD2 3.66Å; L288-W390 HydrophobicContact CD2-CE3 4.24Å; L288-W390 HydrophobicContact CD2-CG 4.07Å; L288-W390 HydrophobicContact CD2-CH2 4.15Å; L288-W390 HydrophobicContact CD2-CZ2 3.59Å; L288-W390 HydrophobicContact CD2-CZ3 4.45Å; L288-W390 HydrophobicContact CG-CZ2 4Å; L288-I409 HydrophobicContact CD1-CD1 3.69Å
289	Y	97.8	Very high	97.2	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	160.9	157.4	-58.5	-106.8	0	0	0	109.6	I125 E129 T364 F365 P366 N384 F385 T387 R389 W390	I125-Y289 HydrophobicContact CG2-CE1 4.48Å; E129-Y289 WeakPolarHBondContact OE1-CE1 3.42Å; E129-Y289 PolarHBondContact OE1-OH 2.92Å; E129-Y289 VanDerWaalsContact OE1-OH 3.06Å; Y289-T364 WeakPolarHBondContact CA-O 3.17Å; Y289-T364 WeakPolarHBondContact CB-O 3.09Å; Y289-F365 AromaticContact CD1-CD1 3.94Å; Y289-F365 HydrophobicContact CD1-CD1 3.94Å; Y289-F365 HydrophobicContact CD1-CE1 4.49Å; Y289-F365 AromaticContact CE1-CD1 3.57Å; Y289-F365 HydrophobicContact CE1-CD1 3.57Å; Y289-F365 HydrophobicContact CE1-CE1 4.11Å; Y289-F365 HydrophobicContact CE1-CG 4.47Å; Y289-P366 VanDerWaalsContact CD1-CD 3.41Å; Y289-P366 HydrophobicContact CD1-CG 4.3Å; Y289-P366 HydrophobicContact CD2-CG 3.61Å; Y289-P366 HydrophobicContact CE1-CG 4.11Å; Y289-P366 HydrophobicContact CE2-CG 3.38Å; Y289-P366 VanDerWaalsContact CG-CD 3.49Å; Y289-P366 HydrophobicContact CG-CG 4.05Å; Y289-P366 VanDerWaalsContact CZ-CD 3.46Å; Y289-N384 VanDerWaalsContact O-CA 3.23Å; Y289-N384 WeakPolarHBondContact O-CA 3.44Å; Y289-N384 WeakPolarHBondContact O-CB 3.29Å; Y289-N384 PolarHBondContact O-ND2 3.21Å; Y289-F385 VanDerWaalsContact CB-CE1 3.41Å; Y289-F385 WeakPolarHBondContact CB-O 3.41Å; Y289-F385 AromaticContact CD1-CE2 3.73Å; Y289-F385 HydrophobicContact CD1-CE2 3.73Å; Y289-F385 AromaticContact CD1-CZ 3.66Å; Y289-F385 HydrophobicContact CD1-CZ 3.66Å; Y289-F385 HydrophobicContact CD2-CD2 4.23Å; Y289-F385 HydrophobicContact CD2-CE2 4.06Å; Y289-F385 WeakPolarHBondContact CD2-O 3.28Å; Y289-F385 HydrophobicContact CE1-CE2 4.43Å; Y289-F385 HydrophobicContact CG-CD2 4.03Å; Y289-F385 HydrophobicContact CG-CE1 4.23Å; Y289-F385 AromaticContact CG-CE2 3.54Å; Y289-F385 HydrophobicContact CG-CE2 3.54Å; Y289-F385 AromaticContact CG-CZ 3.66Å; Y289-F385 HydrophobicContact CG-CZ 3.66Å; Y289-F385 PolarHBondContact N-O 3.35Å; Y289-F385 PolarHBondContact O-N 2.77Å; Y289-F385 VanDerWaalsContact O-N 3.14Å; Y289-T387 HydrophobicContact CD2-CG2 4.42Å; Y289-T387 HydrophobicContact CE2-CG2 3.8Å; Y289-T387 VanDerWaalsContact CE2-OG1 3.26Å; Y289-T387 WeakPolarHBondContact CE2-OG1 3.38Å; Y289-T387 VanDerWaalsContact CZ-OG1 3.27Å; Y289-T387 PolarHBondContact OH-OG1 3.23Å; Y289-R389 PolarHBondContact OH-NE 2.77Å; Y289-R389 PolarHBondContact OH-NH2 3.23Å; Y289-W390 HydrophobicContact CD2-CB 4.33Å; Y289-W390 HydrophobicContact CE2-CB 3.85Å
290	S	97.6	Very high	97.2	Very high	7 Å²	7	11.9 Å²	11.9	5%	0.049	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151	157.1	61.6	0	0	0	0	111.5	E284 I363 T364 T383	E284-S290 VanDerWaalsContact CD-CB 3.47Å; E284-S290 VanDerWaalsContact CD-OG 3.28Å; E284-S290 WeakPolarHBondContact OE1-CB 3.28Å; E284-S290 PolarHBondContact OE1-OG 2.88Å; S290-I363 CarbonylContact O-C 3.41Å; S290-I363 WeakPolarHBondContact O-CA 3.11Å; S290-T364 PolarHBondContact N-O 3.38Å; S290-T364 PolarHBondContact N-OG1 2.73Å; S290-T364 PolarHBondContact O-N 3.21Å; S290-T364 VanDerWaalsContact OG-CG2 3.22Å; S290-T364 WeakPolarHBondContact OG-CG2 3.37Å; S290-T364 PolarHBondContact OG-OG1 2.85Å; S290-T383 WeakPolarHBondContact CA-O 3.25Å; S290-T383 WeakPolarHBondContact CB-O 3.38Å
291	I	98.1	Very high	97.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.6	168.8	179.5	168.1	0	0	0	107.9	F121 W242 I244 L247 F361 M362 I363 S382 T383 F385	F121-I291 HydrophobicContact CE2-CD1 3.86Å; F121-I291 HydrophobicContact CZ-CD1 4.32Å; W242-I291 HydrophobicContact CE3-CD1 3.82Å; W242-I291 HydrophobicContact CZ3-CD1 4.25Å; I244-I291 HydrophobicContact CD1-CG1 4.41Å; I244-I291 HydrophobicContact CG1-CD1 4.35Å; I244-I291 HydrophobicContact CG1-CG2 4.3Å; I244-I291 HydrophobicContact CG2-CG2 4.26Å; L247-I291 HydrophobicContact CD1-CG2 3.58Å; L247-I291 HydrophobicContact CD2-CD1 4.26Å; I291-F361 HydrophobicContact CD1-CD1 3.62Å; I291-F361 HydrophobicContact CD1-CE1 3.77Å; I291-F361 HydrophobicContact CG1-CD1 3.75Å; I291-F361 HydrophobicContact CG1-CE1 4.26Å; I291-M362 WeakPolarHBondContact CA-O 3.32Å; I291-I363 HydrophobicContact CB-CD1 3.77Å; I291-I363 HydrophobicContact CD1-CD1 3.95Å; I291-I363 HydrophobicContact CG1-CD1 3.68Å; I291-S382 WeakPolarHBondContact O-CA 3.28Å; I291-S382 WeakPolarHBondContact O-CB 3.33Å; I291-T383 HydrophobicContact CG2-CG2 4.18Å; I291-T383 PolarHBondContact N-O 2.79Å; I291-T383 VanDerWaalsContact N-O 3.11Å; I291-T383 PolarHBondContact O-N 3.44Å; I291-F385 HydrophobicContact CB-CD1 4.25Å; I291-F385 HydrophobicContact CB-CE1 4.02Å; I291-F385 HydrophobicContact CG2-CD1 4.16Å; I291-F385 HydrophobicContact CG2-CE1 4.44Å
292	N	98.5	Very high	97.2	Very high	8 Å²	8	12.8 Å²	12.8	4%	0.043	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.1	173.7	-177.8	-96	0	0	0	110.6	W302 Q356 F361 M362 E381 S382	N292-W302 HydrophobicContact CB-CH2 4.12Å; N292-W302 HydrophobicContact CB-CZ2 4.06Å; N292-Q356 PolarHBondContact O-NE2 3.13Å; N292-Q356 VanDerWaalsContact O-NE2 3.17Å; N292-Q356 PolarHBondContact OD1-NE2 3.11Å; N292-Q356 VanDerWaalsContact OD1-NE2 3.11Å; N292-Q356 PolarHBondContact OD1-OE1 2.78Å; N292-F361 CarbonylContact O-C 3.51Å; N292-F361 WeakPolarHBondContact O-CA 3.33Å; N292-M362 PolarHBondContact N-O 3.19Å; N292-M362 PolarHBondContact O-N 2.83Å; N292-E381 CarbonylContact C-O 3.55Å; N292-E381 VanDerWaalsContact CA-O 3.29Å; N292-E381 WeakPolarHBondContact CA-O 3.11Å; N292-E381 PolarHBondContact ND2-O 2.96Å; N292-S382 WeakPolarHBondContact ND2-CB 3.46Å; N292-S382 PolarHBondContact ND2-OG 2.91Å
293	Y	98.6	Very high	97.2	Very high	9 Å²	9	12.5 Å²	12.5	4%	0.035	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.9	175.2	-179	-103.4	0	0	0	110.2	W147 P149 H295 G359 F361 A380 E381	W147-Y293 AromaticContact CZ3-CE2 3.81Å; W147-Y293 HydrophobicContact CZ3-CE2 3.81Å; W147-Y293 AromaticContact CZ3-CZ 3.97Å; P149-Y293 VanDerWaalsContact CD-OH 3.31Å; P149-Y293 WeakPolarHBondContact CD-OH 3.19Å; P149-Y293 HydrophobicContact CG-CD1 4.18Å; P149-Y293 HydrophobicContact CG-CE1 3.42Å; P149-Y293 VanDerWaalsContact CG-CE1 3.42Å; Y293-H295 HydrophobicContact CD1-CB 4.41Å; Y293-H295 AromaticContact CD1-CD2 3.64Å; Y293-H295 AromaticContact CD1-CE1 3.63Å; Y293-H295 AromaticContact CD1-CG 3.69Å; Y293-H295 AromaticContact CD1-ND1 3.68Å; Y293-H295 AromaticContact CD1-NE2 3.57Å; Y293-H295 HydrophobicContact CE1-CB 4.33Å; Y293-H295 AromaticContact CE1-CE1 3.9Å; Y293-H295 AromaticContact CE1-CG 3.84Å; Y293-H295 AromaticContact CE1-ND1 3.6Å; Y293-H295 PolarHBondContact O-N 3.06Å; Y293-G359 WeakPolarHBondContact CE2-O 3.39Å; Y293-F361 AromaticContact CD2-CD1 3.76Å; Y293-F361 HydrophobicContact CD2-CD1 3.76Å; Y293-F361 AromaticContact CD2-CD2 3.65Å; Y293-F361 HydrophobicContact CD2-CD2 3.65Å; Y293-F361 AromaticContact CD2-CE1 3.67Å; Y293-F361 HydrophobicContact CD2-CE1 3.67Å; Y293-F361 AromaticContact CD2-CE2 3.53Å; Y293-F361 HydrophobicContact CD2-CE2 3.53Å; Y293-F361 AromaticContact CD2-CG 3.77Å; Y293-F361 HydrophobicContact CD2-CG 3.77Å; Y293-F361 AromaticContact CD2-CZ 3.56Å; Y293-F361 HydrophobicContact CD2-CZ 3.56Å; Y293-F361 HydrophobicContact CE2-CD2 4.1Å; Y293-F361 AromaticContact CE2-CE2 3.79Å; Y293-F361 HydrophobicContact CE2-CE2 3.79Å; Y293-F361 HydrophobicContact CE2-CZ 4.1Å; Y293-F361 HydrophobicContact CG-CD1 4.18Å; Y293-F361 AromaticContact CG-CE1 3.97Å; Y293-F361 HydrophobicContact CG-CE1 3.97Å; Y293-F361 HydrophobicContact CG-CZ 4.16Å; Y293-A380 CarbonylContact O-C 3.5Å; Y293-A380 WeakPolarHBondContact O-CA 3.24Å; Y293-A380 VanDerWaalsContact O-CB 3.32Å; Y293-A380 WeakPolarHBondContact O-CB 3.35Å; Y293-E381 PolarHBondContact N-O 2.86Å; Y293-E381 PolarHBondContact O-N 2.66Å
294	L	98.5	Very high	97.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	95.4	177.6	-167.5	63.6	0	0	0	109.5	F296 K300 Q356 G359 E360 N378 C379 A380	L294-F296 PolarHBondContact O-N 3.3Å; L294-K300 HydrophobicContact CD2-CB 4.34Å; L294-Q356 HydrophobicContact CB-CG 4.04Å; L294-Q356 HydrophobicContact CD2-CG 4.26Å; L294-Q356 WeakPolarHBondContact CD2-O 3.41Å; L294-G359 PolarHBondContact O-N 2.91Å; L294-E360 PolarHBondContact N-O 2.79Å; L294-N378 HydrophobicContact CD1-CB 4.03Å; L294-C379 WeakPolarHBondContact CD1-O 3.47Å; L294-A380 HydrophobicContact CD1-CB 3.79Å
295	H	97.8	Very high	97.4	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.009	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	-47.1	-172.8	-80.6	-86.5	0	0	0	113.5	Y153 I234 Y235 Y293 C379 E381	Y153-H295 HydrophobicContact CE1-CB 3.95Å; Y153-H295 AromaticContact CE1-ND1 3.63Å; Y153-H295 VanDerWaalsContact CE2-O 3.32Å; Y153-H295 WeakPolarHBondContact CE2-O 3.37Å; Y153-H295 AromaticContact CZ-ND1 3.65Å; Y153-H295 PolarHBondContact OH-ND1 3Å; Y153-H295 PolarHBondContact OH-O 3.11Å; I234-H295 HydrophobicContact CD1-CB 4.01Å; Y235-H295 AromaticContact CD2-CE1 3.75Å; Y235-H295 AromaticContact CE2-CE1 3.49Å; Y235-H295 VanDerWaalsContact CE2-CE1 3.49Å; Y235-H295 WeakPolarHBondContact CE2-CE1 3.44Å; Y235-H295 AromaticContact CE2-NE2 3.62Å; Y293-H295 HydrophobicContact CD1-CB 4.41Å; Y293-H295 AromaticContact CD1-CD2 3.64Å; Y293-H295 AromaticContact CD1-CE1 3.63Å; Y293-H295 AromaticContact CD1-CG 3.69Å; Y293-H295 AromaticContact CD1-ND1 3.68Å; Y293-H295 AromaticContact CD1-NE2 3.57Å; Y293-H295 HydrophobicContact CE1-CB 4.33Å; Y293-H295 AromaticContact CE1-CE1 3.9Å; Y293-H295 AromaticContact CE1-CG 3.84Å; Y293-H295 AromaticContact CE1-ND1 3.6Å; Y293-H295 PolarHBondContact O-N 3.06Å; H295-C379 PolarHBondContact N-O 3.08Å; H295-E381 IonicContact CE1-OE2 3.28Å; H295-E381 WeakPolarHBondContact NE2-CB 3.5Å; H295-E381 IonicContact NE2-OE2 2.66Å; H295-E381 PolarHBondContact NE2-OE2 3.38Å
296	F	97	Very high	97.8	Very high	23 Å²	23	10.7 Å²	10.7	10%	0.101	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	161.6	177.9	60.1	-93.8	0	0	0	112.4	Y153 I156 I234 F272 L294 E358 F377 N378 C379	Y153-F296 AromaticContact CD1-CD1 3.82Å; Y153-F296 HydrophobicContact CD1-CD1 3.82Å; Y153-F296 HydrophobicContact CD1-CE1 4.08Å; Y153-F296 HydrophobicContact CD2-CB 4.11Å; Y153-F296 AromaticContact CD2-CD1 3.73Å; Y153-F296 HydrophobicContact CD2-CD1 3.73Å; Y153-F296 HydrophobicContact CD2-CG 4.26Å; Y153-F296 HydrophobicContact CE1-CD1 4.18Å; Y153-F296 HydrophobicContact CE2-CB 4.27Å; Y153-F296 HydrophobicContact CE2-CD1 4.08Å; Y153-F296 AromaticContact CG-CD1 3.6Å; Y153-F296 HydrophobicContact CG-CD1 3.6Å; Y153-F296 HydrophobicContact CG-CE1 4.13Å; Y153-F296 HydrophobicContact CG-CG 4.45Å; I156-F296 HydrophobicContact CD1-CD1 4.2Å; I156-F296 HydrophobicContact CD1-CE1 3.14Å; I156-F296 HydrophobicContact CD1-CE2 4.19Å; I156-F296 HydrophobicContact CD1-CZ 3.13Å; I234-F296 HydrophobicContact CD1-CE1 4.33Å; F272-F296 HydrophobicContact CE1-CZ 4.38Å; L294-F296 PolarHBondContact O-N 3.3Å; F296-E358 VanDerWaalsContact CA-OE2 3.31Å; F296-E358 WeakPolarHBondContact CA-OE2 3.49Å; F296-F377 HydrophobicContact CD2-CE1 4.29Å; F296-F377 AromaticContact CE2-CE1 3.64Å; F296-F377 HydrophobicContact CE2-CE1 3.64Å; F296-F377 AromaticContact CE2-CZ 3.8Å; F296-F377 HydrophobicContact CE2-CZ 3.8Å; F296-F377 HydrophobicContact CZ-CZ 4.46Å; F296-N378 WeakPolarHBondContact O-CA 3.42Å; F296-N378 WeakPolarHBondContact O-CB 3.09Å; F296-C379 HydrophobicContact CD1-CB 4.2Å; F296-C379 HydrophobicContact CD2-CB 4.49Å; F296-C379 HydrophobicContact CE1-CB 3.41Å; F296-C379 VanDerWaalsContact CE1-CB 3.41Å; F296-C379 HydrophobicContact CE2-CB 3.76Å; F296-C379 HydrophobicContact CZ-CB 3.14Å; F296-C379 PolarHBondContact O-N 3.3Å; F296-C379 VanDerWaalsContact O-N 3.08Å
297	G	97.1	Very high	98	Very high	22 Å²	22	10.6 Å²	10.6	23%	0.227	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	97.1	-154	166.8	0	0	0	0	0	114.4	E358	G297-E358 PolarHBondContact N-OE2 2.97Å
298	Q	98.3	Very high	97.9	Very high	89 Å²	89	13.1 Å²	13.1	42%	0.416	7%	0.071	S	C	.	.	S	Bend	trans	-72	147.3	-170.3	-66	-64.5	-61.2	0	0	112.7	H375 F377 N378	Q298-H375 HydrophobicContact CB-CB 4.2Å; Q298-F377 PolarHBondContact N-O 2.69Å; Q298-N378 VanDerWaalsContact O-CB 3.22Å; Q298-N378 WeakPolarHBondContact O-CB 3.46Å; Q298-N378 PolarHBondContact O-ND2 2.97Å
299	P	98.5	Very high	97.9	Very high	19 Å²	19	15.4 Å²	15.4	12%	0.123	8%	0.081	C	C	.	.			trans	-61.2	164.9	-173	-24.7	34.7	0	0	0	115.6	F208 T355 Q356 H375	F208-P299 HydrophobicContact CE1-CG 4.31Å; P299-T355 HydrophobicContact CB-CG2 3.41Å; P299-T355 VanDerWaalsContact CB-CG2 3.41Å; P299-T355 HydrophobicContact CG-CG2 4.37Å; P299-Q356 CarbonylContact C-O 3.25Å; P299-Q356 VanDerWaalsContact CA-O 3.25Å; P299-Q356 WeakPolarHBondContact CA-O 3.39Å; P299-Q356 VanDerWaalsContact CB-O 3.26Å; P299-Q356 WeakPolarHBondContact CB-O 3.48Å; P299-H375 VanDerWaalsContact O-CB 3.25Å; P299-H375 WeakPolarHBondContact O-CB 3.38Å; P299-H375 PolarHBondContact O-CD2 3.3Å; P299-H375 VanDerWaalsContact O-CD2 3.29Å; P299-H375 VanDerWaalsContact O-CG 3.25Å; P299-H375 PolarHBondContact O-N 2.93Å
300	K	98.6	Very high	97.9	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.009	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.5	175.8	-169.4	-173	-41.8	-74.9	0	108.9	F279 L294 W302 Q356 N374	F279-K300 HydrophobicContact CE1-CD 3.82Å; F279-K300 HydrophobicContact CE1-CG 3.81Å; F279-K300 HydrophobicContact CZ-CD 4.17Å; F279-K300 HydrophobicContact CZ-CG 4.26Å; L294-K300 HydrophobicContact CD2-CB 4.34Å; K300-W302 HydrophobicContact CD-CZ2 3.75Å; K300-Q356 HydrophobicContact CB-CB 4.36Å; K300-Q356 PolarHBondContact N-O 2.97Å; K300-Q356 PolarHBondContact O-N 2.62Å; K300-N374 WeakPolarHBondContact CG-OD1 3.41Å; K300-N374 PolarHBondContact NZ-OD1 2.98Å
301	S	98.5	Very high	97.8	Very high	10 Å²	10	19.6 Å²	19.6	7%	0.07	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.7	174.3	-77.7	0	0	0	0	111	T355 G372 F373 H375	S301-T355 PolarHBondContact OG-OG1 3.26Å; S301-G372 CarbonylContact O-C 3.34Å; S301-G372 WeakPolarHBondContact O-CA 3.45Å; S301-F373 PolarHBondContact N-O 2.87Å; S301-F373 PolarHBondContact O-N 3.46Å; S301-H375 PolarHBondContact OG-NE2 2.79Å
302	W	98.8	Very high	97.8	Very high	11 Å²	11	23.6 Å²	23.6	4%	0.042	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	144.8	179.3	-62.2	76.1	0	0	0	110.7	L138 F279 N292 K300 R353 I354 M362 T364 H370 A371	L138-W302 HydrophobicContact CD1-CD2 4.43Å; L138-W302 HydrophobicContact CD1-CE3 3.95Å; L138-W302 HydrophobicContact CD1-CZ3 4.31Å; L138-W302 HydrophobicContact CD2-CB 3.63Å; L138-W302 HydrophobicContact CD2-CD2 4.4Å; L138-W302 HydrophobicContact CD2-CE3 4.33Å; L138-W302 HydrophobicContact CD2-CG 4.17Å; F279-W302 AromaticContact CE2-CD2 3.95Å; F279-W302 HydrophobicContact CE2-CD2 3.95Å; F279-W302 AromaticContact CE2-CE3 3.49Å; F279-W302 HydrophobicContact CE2-CE3 3.49Å; F279-W302 VanDerWaalsContact CE2-CE3 3.49Å; F279-W302 HydrophobicContact CE2-CH2 4.34Å; F279-W302 AromaticContact CE2-CZ3 3.71Å; F279-W302 HydrophobicContact CE2-CZ3 3.71Å; F279-W302 AromaticContact CZ-CD2 3.64Å; F279-W302 HydrophobicContact CZ-CD2 3.64Å; F279-W302 AromaticContact CZ-CE2 3.98Å; F279-W302 AromaticContact CZ-CE3 3.7Å; F279-W302 HydrophobicContact CZ-CE3 3.7Å; F279-W302 HydrophobicContact CZ-CG 4.1Å; F279-W302 HydrophobicContact CZ-CH2 4.39Å; F279-W302 HydrophobicContact CZ-CZ2 4.35Å; F279-W302 HydrophobicContact CZ-CZ3 4.08Å; N292-W302 HydrophobicContact CB-CH2 4.12Å; N292-W302 HydrophobicContact CB-CZ2 4.06Å; K300-W302 HydrophobicContact CD-CZ2 3.75Å; W302-R353 VanDerWaalsContact O-CA 3.24Å; W302-R353 WeakPolarHBondContact O-CA 3.36Å; W302-I354 HydrophobicContact CB-CG2 4.15Å; W302-I354 PolarHBondContact N-O 3.29Å; W302-I354 PolarHBondContact O-N 3.23Å; W302-M362 HydrophobicContact CH2-CB 4.48Å; W302-M362 HydrophobicContact CZ2-CB 3.97Å; W302-M362 HydrophobicContact CZ2-CG 4.13Å; W302-T364 HydrophobicContact CZ3-CG2 4.01Å; W302-H370 AromaticContact CZ3-CD2 3.72Å; W302-A371 CarbonylContact C-O 3.25Å
303	Y	98.6	Very high	97.7	Very high	3 Å²	3	23.2 Å²	23.2	1%	0.012	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.7	162.6	-48.7	-82.6	0	0	0	108.3	E212 W216 W281 P341 D352 R353 H370 A371 F373	E212-Y303 WeakPolarHBondContact CG-OH 3.28Å; W216-Y303 AromaticContact CZ2-CE2 3.84Å; W216-Y303 HydrophobicContact CZ2-CE2 3.84Å; W216-Y303 AromaticContact NE1-CZ 3.72Å; W216-Y303 PolarHBondContact NE1-OH 2.75Å; W281-Y303 HydrophobicContact CZ2-CG 4.42Å; Y303-P341 HydrophobicContact CD1-CG 3.79Å; Y303-P341 HydrophobicContact CE1-CG 3.3Å; Y303-D352 CarbonylContact C-O 3.58Å; Y303-D352 WeakPolarHBondContact CA-O 3.08Å; Y303-R353 HydrophobicContact CD1-CB 3.79Å; Y303-R353 HydrophobicContact CE1-CB 4.22Å; Y303-H370 WeakPolarHBondContact O-CA 3.15Å; Y303-H370 WeakPolarHBondContact O-CB 3.46Å; Y303-A371 WeakPolarHBondContact CD2-O 3.5Å; Y303-A371 PolarHBondContact N-O 3.31Å; Y303-A371 PolarHBondContact O-N 2.88Å; Y303-A371 VanDerWaalsContact O-N 3.08Å; Y303-F373 HydrophobicContact CE2-CD1 4.26Å; Y303-F373 HydrophobicContact CE2-CE1 4.34Å; Y303-F373 WeakPolarHBondContact OH-CE1 3.43Å
304	T	98.6	Very high	97.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.1	173.1	-165.8	0	0	0	0	111.8	I108 A136 L138 F351 D352 Y369	I108-T304 HydrophobicContact CD1-CG2 3.91Å; I108-T304 HydrophobicContact CG1-CG2 3.85Å; A136-T304 WeakPolarHBondContact O-CG2 2.99Å; A136-T304 PolarHBondContact O-OG1 2.88Å; L138-T304 HydrophobicContact CB-CG2 3.84Å; L138-T304 HydrophobicContact CD2-CG2 4.44Å; T304-F351 CarbonylContact O-C 3.56Å; T304-F351 WeakPolarHBondContact O-CA 2.95Å; T304-F351 VanDerWaalsContact O-CB 3.23Å; T304-F351 WeakPolarHBondContact O-CB 3.38Å; T304-D352 HydrophobicContact CG2-CB 4.25Å; T304-D352 PolarHBondContact N-O 2.89Å; T304-D352 PolarHBondContact O-N 3.28Å; T304-Y369 CarbonylContact C-O 3.53Å; T304-Y369 VanDerWaalsContact CA-O 3.25Å; T304-Y369 WeakPolarHBondContact CA-O 3.29Å; T304-Y369 PolarHBondContact OG1-O 3.22Å; T304-Y369 VanDerWaalsContact OG1-O 3.07Å
305	V	98.6	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.6	167.7	170.6	0	0	0	0	107.5	W281 H309 L313 L344 I349 F351 Y369	W281-V305 HydrophobicContact CH2-CG2 3.95Å; W281-V305 HydrophobicContact CZ3-CB 4.43Å; W281-V305 HydrophobicContact CZ3-CG2 3.85Å; V305-H309 HydrophobicContact CG1-CB 4.01Å; V305-L313 HydrophobicContact CB-CD2 4.49Å; V305-L313 HydrophobicContact CG2-CD2 4.2Å; V305-L344 HydrophobicContact CG2-CD1 4.46Å; V305-I349 HydrophobicContact CG1-CG2 4.24Å; V305-I349 HydrophobicContact CG2-CG2 4.02Å; V305-F351 HydrophobicContact CG2-CB 3.96Å; V305-Y369 PolarHBondContact N-O 2.72Å; V305-Y369 PolarHBondContact O-N 3.22Å
306	P	98.3	Very high	97.5	Very high	6 Å²	6	32.6 Å²	32.6	4%	0.039	15%	0.15	C	C	.	.			trans	-45.4	139.6	176.3	-35.9	39.6	0	0	0	113.7	C106 R135 E308 H309 G310	C106-P306 HydrophobicContact CB-CB 4.2Å; C106-P306 HydrophobicContact CB-CG 3.78Å; R135-P306 VanDerWaalsContact O-CB 3.27Å; R135-P306 WeakPolarHBondContact O-CB 3.34Å; P306-E308 HydrophobicContact CB-CG 3.86Å; P306-E308 PolarHBondContact O-N 3.32Å; P306-H309 HydrophobicContact CB-CB 4.41Å; P306-H309 CarbonylContact O-C 3.54Å; P306-H309 WeakPolarHBondContact O-CA 3.29Å; P306-H309 PolarHBondContact O-N 2.79Å; P306-G310 PolarHBondContact O-N 3.43Å
307	P	97.3	Very high	97.5	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.026	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-55.4	-39.9	179	-25.8	34	0	0	0	112.7	R135 H309 G310 Y367	R135-P307 WeakPolarHBondContact O-CD 3.49Å; P307-H309 PolarHBondContact O-N 2.88Å; P307-G310 PolarHBondContact O-N 2.91Å; P307-Y367 HydrophobicContact CB-CD1 4.28Å; P307-Y367 WeakPolarHBondContact O-CD1 3.27Å; P307-Y367 WeakPolarHBondContact O-CE1 3.44Å
308	E	95.4	Very high	97.4	Very high	60 Å²	60	33.8 Å²	33.8	28%	0.28	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-58.6	-7.9	172.7	54.9	-176.8	-75.9	0	0	114.5	C106 R135 P306 H437	C106-E308 PolarHBondContact SG-OE2 3.48Å; R135-E308 IonicContact CZ-OE2 3.71Å; R135-E308 IonicContact NE-OE2 2.63Å; R135-E308 PolarHBondContact NE-OE2 3.04Å; R135-E308 IonicContact NH2-OE1 3.91Å; R135-E308 PolarHBondContact NH2-OE1 2.89Å; R135-E308 IonicContact NH2-OE2 2.72Å; R135-E308 PolarHBondContact NH2-OE2 2.89Å; P306-E308 HydrophobicContact CB-CG 3.86Å; P306-E308 PolarHBondContact O-N 3.32Å; E308-H437 HydrophobicContact CB-CB 4Å
309	H	96.7	Very high	97.1	Very high	48 Å²	48	32.5 Å²	32.5	22%	0.222	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-126.4	1.6	178.7	-61.9	-28.4	0	0	0	114.2	V305 P306 P307 K311 R312 L313 P350	V305-H309 HydrophobicContact CG1-CB 4.01Å; P306-H309 HydrophobicContact CB-CB 4.41Å; P306-H309 CarbonylContact O-C 3.54Å; P306-H309 WeakPolarHBondContact O-CA 3.29Å; P306-H309 PolarHBondContact O-N 2.79Å; P307-H309 PolarHBondContact O-N 2.88Å; H309-K311 VanDerWaalsContact C-N 3.31Å; H309-K311 PolarHBondContact O-N 2.99Å; H309-R312 WeakPolarHBondContact O-CA 2.97Å; H309-R312 VanDerWaalsContact O-CB 3.23Å; H309-R312 WeakPolarHBondContact O-CB 3.35Å; H309-R312 PolarHBondContact O-N 3.34Å; H309-L313 PolarHBondContact O-N 3.12Å; H309-P350 HydrophobicContact CB-CG 4.06Å; H309-P350 WeakPolarHBondContact CD2-CG 3.37Å
310	G	96.1	Very high	97	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.4	-41.7	178.7	0	0	0	0	0	113.5	P306 P307 R312 L313 E314	P306-G310 PolarHBondContact O-N 3.43Å; P307-G310 PolarHBondContact O-N 2.91Å; G310-R312 PolarHBondContact O-N 3.12Å; G310-L313 PolarHBondContact O-N 3.31Å; G310-E314 PolarHBondContact O-N 3.31Å
311	K	95.8	Very high	96.7	Very high	95 Å²	95	35.7 Å²	35.7	41%	0.413	17%	0.172	S	C	.	.	H	α-helix	trans	-66.1	-6	174.6	-65.5	-62.1	173.1	-155.8	0	114.5	H309 E314 R315 Y367	H309-K311 VanDerWaalsContact C-N 3.31Å; H309-K311 PolarHBondContact O-N 2.99Å; K311-E314 VanDerWaalsContact CD-OE2 3.23Å; K311-E314 WeakPolarHBondContact CD-OE2 3.45Å; K311-E314 IonicContact NZ-OE1 3.88Å; K311-E314 PolarHBondContact NZ-OE1 3.45Å; K311-E314 IonicContact NZ-OE2 3.94Å; K311-E314 PolarHBondContact NZ-OE2 2.94Å; K311-R315 PolarHBondContact O-NE 3.25Å; K311-Y367 WeakPolarHBondContact CD-OH 3.29Å; K311-Y367 WeakPolarHBondContact CE-OH 3.23Å; K311-Y367 HydrophobicContact CG-CE1 4.43Å; K311-Y367 WeakPolarHBondContact CG-OH 3.44Å; K311-Y367 PolarHBondContact N-OH 3.05Å; K311-Y367 VanDerWaalsContact N-OH 3.08Å; K311-Y367 PolarHBondContact NZ-OH 2.87Å
312	R	97.5	Very high	96.2	Very high	85 Å²	85	38.4 Å²	38.4	32%	0.321	19%	0.189	S	C	.	.	H	α-helix	trans	-89.1	-40.9	169.2	-53.9	177.3	60.3	-163.2	-8.4	110.8	H309 G310 L316 G348 I349 P350	H309-R312 WeakPolarHBondContact O-CA 2.97Å; H309-R312 VanDerWaalsContact O-CB 3.23Å; H309-R312 WeakPolarHBondContact O-CB 3.35Å; H309-R312 PolarHBondContact O-N 3.34Å; G310-R312 PolarHBondContact O-N 3.12Å; R312-L316 PolarHBondContact O-N 3.23Å; R312-L316 VanDerWaalsContact O-N 3.13Å; R312-G348 PolarHBondContact NH2-O 3.16Å; R312-I349 HydrophobicContact CB-CD1 3.66Å; R312-P350 VanDerWaalsContact NH1-CD 3.26Å
313	L	97.9	Very high	95.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.5	-44.4	174.1	-178.3	66.2	0	0	0	111.6	W281 V305 H309 G310 R315 L316 A317 I339 L344 Y369	W281-L313 HydrophobicContact CD2-CD2 4.09Å; W281-L313 HydrophobicContact CE3-CD2 3.71Å; W281-L313 HydrophobicContact CG-CD2 4.47Å; W281-L313 HydrophobicContact CZ3-CD2 4.28Å; V305-L313 HydrophobicContact CB-CD2 4.49Å; V305-L313 HydrophobicContact CG2-CD2 4.2Å; H309-L313 PolarHBondContact O-N 3.12Å; G310-L313 PolarHBondContact O-N 3.31Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 2.89Å; L313-L316 PolarHBondContact O-N 3.14Å; L313-A317 WeakPolarHBondContact O-CB 3.35Å; L313-A317 PolarHBondContact O-N 3.43Å; L313-I339 HydrophobicContact CD1-CD1 4.26Å; L313-L344 HydrophobicContact CD1-CD2 3.61Å; L313-Y369 HydrophobicContact CD2-CD1 3.8Å; L313-Y369 HydrophobicContact CD2-CD2 4.33Å; L313-Y369 HydrophobicContact CD2-CG 3.69Å
314	E	97.1	Very high	95.3	Very high	25 Å²	25	42.8 Å²	42.8	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-53.2	-49.6	175.9	-77.4	179	-154.5	0	0	112	G310 K311 L316 A317 Q318 L332 Y367 Y369	G310-E314 PolarHBondContact O-N 3.31Å; K311-E314 VanDerWaalsContact CD-OE2 3.23Å; K311-E314 WeakPolarHBondContact CD-OE2 3.45Å; K311-E314 IonicContact NZ-OE1 3.88Å; K311-E314 PolarHBondContact NZ-OE1 3.45Å; K311-E314 IonicContact NZ-OE2 3.94Å; K311-E314 PolarHBondContact NZ-OE2 2.94Å; E314-L316 PolarHBondContact O-N 3.43Å; E314-A317 PolarHBondContact O-N 2.84Å; E314-Q318 VanDerWaalsContact O-CG 3.25Å; E314-Q318 WeakPolarHBondContact O-CG 3.37Å; E314-Q318 PolarHBondContact O-N 2.91Å; E314-L332 HydrophobicContact CG-CD1 4.38Å; E314-Y367 WeakPolarHBondContact OE1-CE2 3.35Å; E314-Y367 PolarHBondContact OE1-OH 3.36Å; E314-Y369 HydrophobicContact CG-CE2 4.1Å; E314-Y369 VanDerWaalsContact CG-OH 3.3Å; E314-Y369 WeakPolarHBondContact CG-OH 3.32Å; E314-Y369 PolarHBondContact OE1-OH 2.85Å
315	R	96.6	Very high	94.8	Very high	160 Å²	160	43.9 Å²	43.9	60%	0.604	24%	0.239	S	C	*	.	H	α-helix	trans	-65.5	-37.7	179.3	-74	-178.2	-70.9	142.8	-10.5	112.8	K311 L313 A317 Q318 G319	K311-R315 PolarHBondContact O-NE 3.25Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 2.89Å; R315-A317 VanDerWaalsContact C-N 3.35Å; R315-Q318 PolarHBondContact O-N 3.31Å; R315-G319 PolarHBondContact O-N 3.13Å
316	L	96.5	Very high	94.4	Very high	23 Å²	23	52 Å²	52	12%	0.12	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-42.4	174.8	-173.3	65.8	0	0	0	111.2	R312 L313 E314 G319 F320 I343 L344 Y347 I349	R312-L316 PolarHBondContact O-N 3.23Å; R312-L316 VanDerWaalsContact O-N 3.13Å; L313-L316 PolarHBondContact O-N 3.14Å; E314-L316 PolarHBondContact O-N 3.43Å; L316-G319 PolarHBondContact O-N 2.85Å; L316-F320 HydrophobicContact CD1-CD2 3.97Å; L316-F320 HydrophobicContact CD1-CE2 3.6Å; L316-F320 HydrophobicContact CG-CD2 4.03Å; L316-F320 HydrophobicContact CG-CE2 4.03Å; L316-F320 WeakPolarHBondContact O-CD2 3.24Å; L316-F320 PolarHBondContact O-N 3.04Å; L316-F320 VanDerWaalsContact O-N 3.16Å; L316-I343 HydrophobicContact CD2-CG2 4.42Å; L316-L344 HydrophobicContact CD2-CD2 4.15Å; L316-Y347 HydrophobicContact CD1-CD1 3.75Å; L316-Y347 HydrophobicContact CD1-CD2 4.15Å; L316-Y347 HydrophobicContact CD1-CE1 4.46Å; L316-Y347 HydrophobicContact CD1-CG 3.58Å; L316-Y347 HydrophobicContact CD2-CG 4.43Å; L316-I349 HydrophobicContact CD2-CD1 4.38Å; L316-I349 HydrophobicContact CD2-CG1 3.64Å
317	A	96.6	Very high	94	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-43.5	177	0	0	0	0	0	111.8	L313 E314 R315 G319 F320 F321 F331 L332 I339	L313-A317 WeakPolarHBondContact O-CB 3.35Å; L313-A317 PolarHBondContact O-N 3.43Å; E314-A317 PolarHBondContact O-N 2.84Å; R315-A317 VanDerWaalsContact C-N 3.35Å; A317-G319 VanDerWaalsContact C-N 3.29Å; A317-G319 PolarHBondContact O-N 3.13Å; A317-F320 PolarHBondContact O-N 3.44Å; A317-F321 WeakPolarHBondContact O-CB 3.27Å; A317-F321 WeakPolarHBondContact O-CD2 3.41Å; A317-F321 PolarHBondContact O-N 3.38Å; A317-F331 HydrophobicContact CB-CE1 4.48Å; A317-F331 HydrophobicContact CB-CZ 3.78Å; A317-L332 HydrophobicContact CB-CD1 4.2Å; A317-L332 HydrophobicContact CB-CD2 3.98Å; A317-L332 HydrophobicContact CB-CG 4.44Å; A317-I339 HydrophobicContact CB-CD1 4.12Å
318	Q	94.6	Very high	93.7	Very high	70 Å²	70	54 Å²	54	33%	0.327	30%	0.299	S	S	.	.	H	α-helix	trans	-57.6	-41	174.1	-72.1	166.4	-8.3	0	0	112	E314 R315 F331	E314-Q318 VanDerWaalsContact O-CG 3.25Å; E314-Q318 WeakPolarHBondContact O-CG 3.37Å; E314-Q318 PolarHBondContact O-N 2.91Å; R315-Q318 PolarHBondContact O-N 3.31Å; Q318-F331 HydrophobicContact CG-CE1 4.14Å
319	G	93.2	Very high	93.4	Very high	61 Å²	61	56.7 Å²	56.7	63%	0.629	32%	0.315	S	S	*	.	H	α-helix	trans	-66.1	-36.1	177.1	0	0	0	0	0	114.4	R315 L316 A317	R315-G319 PolarHBondContact O-N 3.13Å; L316-G319 PolarHBondContact O-N 2.85Å; A317-G319 VanDerWaalsContact C-N 3.29Å; A317-G319 PolarHBondContact O-N 3.13Å
320	F	94.7	Very high	93.3	Very high	68 Å²	68	55 Å²	55	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-89.8	-24.3	-179.8	-78.2	-52.6	0	0	0	115.1	L175 L316 A317 P322 I343 Y347	L175-F320 HydrophobicContact CD1-CB 4.15Å; L175-F320 HydrophobicContact CD1-CD1 3.41Å; L175-F320 VanDerWaalsContact CD1-CD1 3.41Å; L175-F320 HydrophobicContact CD1-CD2 3.91Å; L175-F320 HydrophobicContact CD1-CE1 3.62Å; L175-F320 HydrophobicContact CD1-CE2 4.07Å; L175-F320 HydrophobicContact CD1-CG 3.58Å; L175-F320 HydrophobicContact CD1-CZ 3.93Å; L175-F320 HydrophobicContact CD2-CB 4.12Å; L175-F320 HydrophobicContact CD2-CD2 3.71Å; L175-F320 HydrophobicContact CD2-CE2 4.2Å; L175-F320 HydrophobicContact CD2-CG 3.93Å; L175-F320 HydrophobicContact CG-CD2 4.47Å; L175-F320 HydrophobicContact CG-CG 4.42Å; L316-F320 HydrophobicContact CD1-CD2 3.97Å; L316-F320 HydrophobicContact CD1-CE2 3.6Å; L316-F320 HydrophobicContact CG-CD2 4.03Å; L316-F320 HydrophobicContact CG-CE2 4.03Å; L316-F320 WeakPolarHBondContact O-CD2 3.24Å; L316-F320 PolarHBondContact O-N 3.04Å; L316-F320 VanDerWaalsContact O-N 3.16Å; A317-F320 PolarHBondContact O-N 3.44Å; F320-P322 WeakPolarHBondContact O-CD 3.26Å; F320-I343 HydrophobicContact CE2-CG2 3.91Å; F320-Y347 HydrophobicContact CE2-CD2 4.2Å; F320-Y347 AromaticContact CE2-CE2 3.93Å; F320-Y347 HydrophobicContact CE2-CE2 3.93Å; F320-Y347 HydrophobicContact CZ-CD2 4.29Å; F320-Y347 HydrophobicContact CZ-CE1 4.35Å; F320-Y347 AromaticContact CZ-CE2 3.56Å; F320-Y347 HydrophobicContact CZ-CE2 3.56Å; F320-Y347 AromaticContact CZ-CZ 3.61Å
321	F	93.9	Very high	93.3	Very high	21 Å²	21	55.2 Å²	55.2	9%	0.092	31%	0.31	C	S	.	.			trans	-121.5	53.9	-177.9	-58.3	-90.6	0	0	0	111.5	L175 A317 G323 S324 S325 F331 T337 I339	L175-F321 HydrophobicContact CB-CZ 4.25Å; L175-F321 HydrophobicContact CD2-CE2 3.96Å; L175-F321 HydrophobicContact CD2-CZ 4.16Å; A317-F321 WeakPolarHBondContact O-CB 3.27Å; A317-F321 WeakPolarHBondContact O-CD2 3.41Å; A317-F321 PolarHBondContact O-N 3.38Å; F321-G323 VanDerWaalsContact C-N 3.3Å; F321-G323 PolarHBondContact O-N 3.46Å; F321-S324 WeakPolarHBondContact O-CA 3.49Å; F321-S324 WeakPolarHBondContact O-CB 3.42Å; F321-S324 PolarHBondContact O-N 2.85Å; F321-S325 PolarHBondContact O-N 3.39Å; F321-F331 HydrophobicContact CB-CE2 3.79Å; F321-F331 HydrophobicContact CB-CZ 3.92Å; F321-F331 HydrophobicContact CG-CE2 4.3Å; F321-T337 HydrophobicContact CD1-CG2 4.49Å; F321-T337 HydrophobicContact CD2-CG2 3.73Å; F321-T337 HydrophobicContact CE1-CG2 4.24Å; F321-T337 HydrophobicContact CE2-CG2 3.45Å; F321-T337 VanDerWaalsContact CE2-CG2 3.45Å; F321-T337 HydrophobicContact CG-CG2 4.27Å; F321-T337 HydrophobicContact CZ-CG2 3.73Å; F321-I339 HydrophobicContact CE2-CD1 4.27Å; F321-I339 HydrophobicContact CE2-CG1 4.16Å
322	P	88.1	Confident	93.3	Very high	66 Å²	66	51 Å²	51	43%	0.429	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-34.5	-170	24.5	-35.1	0	0	0	113.4	F320 S324 S325 Q326	F320-P322 WeakPolarHBondContact O-CD 3.26Å; P322-S324 VanDerWaalsContact C-N 3.25Å; P322-S324 PolarHBondContact O-N 3.49Å; P322-S325 WeakPolarHBondContact CA-OG 3.25Å; P322-S325 PolarHBondContact O-N 2.92Å; P322-S325 PolarHBondContact O-OG 3.42Å; P322-S325 VanDerWaalsContact O-OG 3.14Å; P322-Q326 VanDerWaalsContact O-CB 3.29Å; P322-Q326 WeakPolarHBondContact O-CB 3.44Å; P322-Q326 WeakPolarHBondContact O-CG 3.28Å; P322-Q326 PolarHBondContact O-N 3.08Å
323	G	87.7	Confident	93.2	Very high	59 Å²	59	47.7 Å²	47.7	61%	0.608	28%	0.28	S	S	*	.	H	α-helix	trans	-68.5	-21.9	174.4	0	0	0	0	0	113.9	F321	F321-G323 VanDerWaalsContact C-N 3.3Å; F321-G323 PolarHBondContact O-N 3.46Å
324	S	89.4	Confident	93	Very high	47 Å²	47	49.4 Å²	49.4	33%	0.329	29%	0.288	S	S	.	.	H	α-helix	trans	-84	-42.1	173	-56.6	0	0	0	0	111.6	F321 P322 G327 C328 F331	F321-S324 WeakPolarHBondContact O-CA 3.49Å; F321-S324 WeakPolarHBondContact O-CB 3.42Å; F321-S324 PolarHBondContact O-N 2.85Å; P322-S324 VanDerWaalsContact C-N 3.25Å; P322-S324 PolarHBondContact O-N 3.49Å; S324-G327 PolarHBondContact O-N 2.95Å; S324-C328 PolarHBondContact O-N 3.42Å; S324-C328 VanDerWaalsContact O-N 3.13Å; S324-F331 VanDerWaalsContact CB-CD2 3.45Å
325	S	89.3	Confident	92.9	Very high	24 Å²	24	51.8 Å²	51.8	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-68.8	-36	177.2	60.6	0	0	0	0	113	F321 P322 G327 C328	F321-S325 PolarHBondContact O-N 3.39Å; P322-S325 WeakPolarHBondContact CA-OG 3.25Å; P322-S325 PolarHBondContact O-N 2.92Å; P322-S325 PolarHBondContact O-OG 3.42Å; P322-S325 VanDerWaalsContact O-OG 3.14Å; S325-G327 PolarHBondContact O-N 3.29Å; S325-C328 CarbonylContact O-C 3.48Å; S325-C328 PolarHBondContact O-N 3.16Å
326	Q	90	Very high	92.9	Very high	170 Å²	170	46.1 Å²	46.1	79%	0.794	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-24	172	-75	171.6	5.4	0	0	112.9	P322	P322-Q326 VanDerWaalsContact O-CB 3.29Å; P322-Q326 WeakPolarHBondContact O-CB 3.44Å; P322-Q326 WeakPolarHBondContact O-CG 3.28Å; P322-Q326 PolarHBondContact O-N 3.08Å
327	G	88.9	Confident	92.9	Very high	49 Å²	49	45.1 Å²	45.1	51%	0.505	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-21.7	176	0	0	0	0	0	114.6	S324 S325 C402	S324-G327 PolarHBondContact O-N 2.95Å; S325-G327 PolarHBondContact O-N 3.29Å; G327-C402 WeakPolarHBondContact O-CB 3.44Å
328	C	92.5	Very high	93	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.014	27%	0.274	C	S	.	.			trans	-166.7	123.3	179.2	-176.8	0	0	0	0	111	S324 S325 A330 F331 C402	S324-C328 PolarHBondContact O-N 3.42Å; S324-C328 VanDerWaalsContact O-N 3.13Å; S325-C328 CarbonylContact O-C 3.48Å; S325-C328 PolarHBondContact O-N 3.16Å; C328-A330 PolarHBondContact O-N 3.12Å; C328-F331 HydrophobicContact CB-CB 4.12Å; C328-F331 WeakPolarHBondContact O-CB 3.47Å; C328-F331 PolarHBondContact O-N 2.8Å; C328-F331 VanDerWaalsContact O-N 3.16Å; C328-C402 HydrophobicContact CB-CB 4.17Å
329	D	88.9	Confident	93.1	Very high	117 Å²	117	42 Å²	42	63%	0.626	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.8	179.4	-51.4	-76.5	0	0	0	112.6
330	A	93.6	Very high	93.4	Very high	12 Å²	12	39.3 Å²	39.3	10%	0.099	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	33.1	179.9	0	0	0	0	0	113.2	C328 L332 R333 T398	C328-A330 PolarHBondContact O-N 3.12Å; A330-L332 PolarHBondContact O-N 3.36Å; A330-R333 WeakPolarHBondContact O-CB 3.48Å; A330-R333 PolarHBondContact O-N 2.9Å; A330-T398 HydrophobicContact CB-CG2 4.3Å; A330-T398 WeakPolarHBondContact CB-O 3.37Å
331	F	95.7	Very high	93.5	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.022	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-56.8	-18.5	-173.9	75.4	-80.4	0	0	0	115.6	A317 Q318 F321 S324 C328 R333 H334 T337	A317-F331 HydrophobicContact CB-CE1 4.48Å; A317-F331 HydrophobicContact CB-CZ 3.78Å; Q318-F331 HydrophobicContact CG-CE1 4.14Å; F321-F331 HydrophobicContact CB-CE2 3.79Å; F321-F331 HydrophobicContact CB-CZ 3.92Å; F321-F331 HydrophobicContact CG-CE2 4.3Å; S324-F331 VanDerWaalsContact CB-CD2 3.45Å; C328-F331 HydrophobicContact CB-CB 4.12Å; C328-F331 WeakPolarHBondContact O-CB 3.47Å; C328-F331 PolarHBondContact O-N 2.8Å; C328-F331 VanDerWaalsContact O-N 3.16Å; F331-R333 PolarHBondContact O-N 2.89Å; F331-H334 WeakPolarHBondContact O-CB 3.22Å; F331-H334 PolarHBondContact O-N 3.12Å; F331-H334 VanDerWaalsContact O-N 3.08Å; F331-H334 PolarHBondContact O-ND1 2.63Å; F331-T337 HydrophobicContact CE2-CG2 4.29Å; F331-T337 WeakPolarHBondContact CE2-OG1 3.42Å
332	L	95.9	Very high	93.6	Very high	6 Å²	6	40 Å²	40	3%	0.031	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.9	-30.7	172.8	-65.4	179.8	0	0	0	112.4	E314 A317 A330 H334 K335 T337 Y369	E314-L332 HydrophobicContact CG-CD1 4.38Å; A317-L332 HydrophobicContact CB-CD1 4.2Å; A317-L332 HydrophobicContact CB-CD2 3.98Å; A317-L332 HydrophobicContact CB-CG 4.44Å; A330-L332 PolarHBondContact O-N 3.36Å; L332-H334 PolarHBondContact O-N 2.94Å; L332-K335 PolarHBondContact O-N 3.5Å; L332-T337 HydrophobicContact CD2-CG2 3.86Å; L332-Y369 HydrophobicContact CB-CE1 4.12Å; L332-Y369 HydrophobicContact CD1-CD1 4.44Å; L332-Y369 HydrophobicContact CD1-CE1 3.54Å; L332-Y369 HydrophobicContact CG-CE1 4.47Å
333	R	95.1	Very high	94.1	Very high	17 Å²	17	37.7 Å²	37.7	6%	0.064	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63	-11.6	172.5	-66	-162.4	-168.2	-79.3	-7.8	114.2	T283 E284 D287 A330 F331 K335 T398 C400	T283-R333 PolarHBondContact OG1-NH1 3.14Å; E284-R333 PolarHBondContact O-NH1 3.23Å; D287-R333 IonicContact OD1-CZ 3.17Å; D287-R333 IonicContact OD1-NH1 2.78Å; D287-R333 PolarHBondContact OD1-NH1 3.2Å; D287-R333 IonicContact OD1-NH2 2.72Å; D287-R333 PolarHBondContact OD1-NH2 3.37Å; D287-R333 IonicContact OD2-NH2 3.21Å; D287-R333 PolarHBondContact OD2-NH2 3.16Å; A330-R333 WeakPolarHBondContact O-CB 3.48Å; A330-R333 PolarHBondContact O-N 2.9Å; F331-R333 PolarHBondContact O-N 2.89Å; R333-K335 PolarHBondContact O-N 2.89Å; R333-T398 PolarHBondContact NE-O 2.61Å; R333-T398 PolarHBondContact NH2-O 2.85Å; R333-C400 HydrophobicContact CB-CB 4.46Å
334	H	94.3	Very high	94.5	Very high	35 Å²	35	34.9 Å²	34.9	16%	0.162	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-68.2	-10.7	171.1	-57.5	158.9	0	0	0	112.9	F331 L332 M336 C400 C402	F331-H334 WeakPolarHBondContact O-CB 3.22Å; F331-H334 PolarHBondContact O-N 3.12Å; F331-H334 VanDerWaalsContact O-N 3.08Å; F331-H334 PolarHBondContact O-ND1 2.63Å; L332-H334 PolarHBondContact O-N 2.94Å; H334-M336 VanDerWaalsContact C-N 3.27Å; H334-M336 HydrophobicContact CB-CB 4.42Å; H334-M336 HydrophobicContact CB-CG 4.19Å; H334-M336 HydrophobicContact CB-SD 3.99Å; H334-M336 WeakPolarHBondContact O-CG 3.49Å; H334-M336 PolarHBondContact O-N 2.77Å; H334-C400 PolarHBondContact NE2-SG 3.26Å; H334-C402 VanDerWaalsContact CE1-SG 3.55Å; H334-C402 PolarHBondContact NE2-SG 2.82Å; H334-C402 VanDerWaalsContact NE2-SG 3.36Å
335	K	95.4	Very high	94.9	Very high	76 Å²	76	40.7 Å²	40.7	33%	0.33	22%	0.22	S	C	.	.	S	Bend	trans	53.9	40.4	-175.9	-48.6	-164.3	-171.9	-158.2	0	112.4	A280 H282 L332 R333	A280-K335 VanDerWaalsContact CB-O 3.28Å; A280-K335 WeakPolarHBondContact CB-O 3.27Å; H282-K335 HydrophobicContact CB-CG 4.15Å; H282-K335 WeakPolarHBondContact CD2-CE 3.44Å; H282-K335 PolarHBondContact CD2-NZ 3.15Å; H282-K335 VanDerWaalsContact CD2-NZ 3.26Å; H282-K335 WeakPolarHBondContact NE2-CE 3.48Å; H282-K335 PolarHBondContact NE2-NZ 3.05Å; L332-K335 PolarHBondContact O-N 3.5Å; R333-K335 PolarHBondContact O-N 2.89Å
336	M	95.7	Very high	95.2	Very high	40 Å²	40	46.7 Å²	46.7	20%	0.197	24%	0.243	C	C	.	.			trans	-118.6	-13.8	-176	-70.6	171.4	74.5	0	0	115.3	T177 Q178 Y179 H334 R403	T177-M336 CarbonylContact C-O 3.52Å; T177-M336 WeakPolarHBondContact CA-O 3.15Å; T177-M336 HydrophobicContact CG2-CB 4.37Å; T177-M336 HydrophobicContact CG2-CE 4.29Å; Q178-M336 PolarHBondContact N-O 2.87Å; Q178-M336 WeakPolarHBondContact O-CB 3.36Å; Q178-M336 WeakPolarHBondContact O-CE 3.19Å; Q178-M336 VanDerWaalsContact O-CG 3.31Å; Q178-M336 WeakPolarHBondContact O-CG 3.18Å; Y179-M336 HydrophobicContact CD1-CE 3.45Å; Y179-M336 VanDerWaalsContact CD1-CE 3.45Å; Y179-M336 HydrophobicContact CE1-CE 3.57Å; Y179-M336 HydrophobicContact CG-CE 4.16Å; H334-M336 VanDerWaalsContact C-N 3.27Å; H334-M336 HydrophobicContact CB-CB 4.42Å; H334-M336 HydrophobicContact CB-CG 4.19Å; H334-M336 HydrophobicContact CB-SD 3.99Å; H334-M336 WeakPolarHBondContact O-CG 3.49Å; H334-M336 PolarHBondContact O-N 2.77Å; M336-R403 PolarHBondContact SD-NH2 3.38Å
337	T	97.6	Very high	95.6	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.3	-169.3	-54	0	0	0	0	112.3	W281 F321 F331 L332 I339	W281-T337 PolarHBondContact N-O 2.72Å; W281-T337 VanDerWaalsContact N-O 3.08Å; F321-T337 HydrophobicContact CD1-CG2 4.49Å; F321-T337 HydrophobicContact CD2-CG2 3.73Å; F321-T337 HydrophobicContact CE1-CG2 4.24Å; F321-T337 HydrophobicContact CE2-CG2 3.45Å; F321-T337 VanDerWaalsContact CE2-CG2 3.45Å; F321-T337 HydrophobicContact CG-CG2 4.27Å; F321-T337 HydrophobicContact CZ-CG2 3.73Å; F331-T337 HydrophobicContact CE2-CG2 4.29Å; F331-T337 WeakPolarHBondContact CE2-OG1 3.42Å; L332-T337 HydrophobicContact CD2-CG2 3.86Å; T337-I339 HydrophobicContact CG2-CD1 4.43Å; T337-I339 HydrophobicContact CG2-CG1 4.27Å
338	L	98.1	Very high	95.9	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.6	-178.3	-52.7	-179.4	0	0	0	110.5	V169 F176 Q178 L219 T278 A280	V169-L338 HydrophobicContact CG1-CD1 3.96Å; V169-L338 HydrophobicContact CG2-CD1 4.14Å; F176-L338 HydrophobicContact CB-CB 4.15Å; F176-L338 HydrophobicContact CB-CD1 4.49Å; F176-L338 HydrophobicContact CD2-CB 4.38Å; F176-L338 PolarHBondContact N-O 3.25Å; F176-L338 PolarHBondContact O-N 2.93Å; Q178-L338 HydrophobicContact CB-CD1 4.26Å; L219-L338 HydrophobicContact CD2-CD1 3.92Å; T278-L338 HydrophobicContact CG2-CD1 3.95Å; T278-L338 HydrophobicContact CG2-CD2 3.55Å; T278-L338 HydrophobicContact CG2-CG 4.43Å; A280-L338 HydrophobicContact CB-CD2 3.55Å
339	I	98.1	Very high	96.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.6	179.7	-54.2	-179.6	0	0	0	107.3	G174 L175 W281 L313 A317 F321 T337 I343 L344	G174-I339 WeakPolarHBondContact O-CA 3.39Å; L175-I339 HydrophobicContact CD2-CG1 4.12Å; L175-I339 HydrophobicContact CD2-CG2 4.16Å; W281-I339 PolarHBondContact NE1-O 2.84Å; L313-I339 HydrophobicContact CD1-CD1 4.26Å; A317-I339 HydrophobicContact CB-CD1 4.12Å; F321-I339 HydrophobicContact CE2-CD1 4.27Å; F321-I339 HydrophobicContact CE2-CG1 4.16Å; T337-I339 HydrophobicContact CG2-CD1 4.43Å; T337-I339 HydrophobicContact CG2-CG1 4.27Å; I339-I343 HydrophobicContact CG2-CB 3.89Å; I339-I343 HydrophobicContact CG2-CG2 3.62Å; I339-L344 HydrophobicContact CB-CD2 4.45Å; I339-L344 HydrophobicContact CG2-CD2 3.71Å; I339-L344 HydrophobicContact CG2-CG 4.16Å
340	S	97.8	Very high	96.6	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.035	21%	0.209	C	C	.	.			trans	-80.7	154.1	-175.2	74.3	0	0	0	0	113.3	G174 S342 I343 L344	G174-S340 WeakPolarHBondContact CA-OG 3.37Å; G174-S340 PolarHBondContact O-N 3.37Å; S340-S342 PolarHBondContact O-N 3.33Å; S340-S342 VanDerWaalsContact O-N 3.12Å; S340-I343 PolarHBondContact O-N 3.15Å; S340-L344 PolarHBondContact O-N 2.79Å
341	P	97.2	Very high	96.8	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.078	22%	0.215	C	C	.	.	H	α-helix	trans	-46.7	-38.8	170.5	-33.3	38.4	0	0	0	113.9	W216 Y303 I343 L344 K345 F351	W216-P341 VanDerWaalsContact CE2-CD 3.42Å; W216-P341 VanDerWaalsContact CZ2-CD 3.47Å; W216-P341 HydrophobicContact CZ2-CG 4.49Å; Y303-P341 HydrophobicContact CD1-CG 3.79Å; Y303-P341 HydrophobicContact CE1-CG 3.3Å; P341-I343 VanDerWaalsContact C-N 3.34Å; P341-I343 PolarHBondContact O-N 3.14Å; P341-L344 PolarHBondContact O-N 3.03Å; P341-K345 WeakPolarHBondContact O-CB 3.4Å; P341-K345 PolarHBondContact O-N 2.85Å; P341-F351 HydrophobicContact CB-CE1 4.43Å; P341-F351 HydrophobicContact CB-CE2 3.78Å; P341-F351 HydrophobicContact CB-CZ 3.58Å; P341-F351 HydrophobicContact CG-CE2 4.28Å
342	S	96.4	Very high	96.9	Very high	91 Å²	91	43.3 Å²	43.3	64%	0.636	22%	0.221	S	C	*	.	H	α-helix	trans	-63.7	-36.4	178.1	-51.1	0	0	0	0	112.9	S340 K346	S340-S342 PolarHBondContact O-N 3.33Å; S340-S342 VanDerWaalsContact O-N 3.12Å; S342-K346 VanDerWaalsContact O-CB 3.27Å; S342-K346 WeakPolarHBondContact O-CB 3.29Å; S342-K346 PolarHBondContact O-N 3.25Å
343	I	97.6	Very high	97	Very high	17 Å²	17	48 Å²	48	9%	0.087	24%	0.238	C	C	.	.	H	α-helix	trans	-75	-43.5	175.1	-67.4	-63.7	0	0	0	110.6	L175 L316 F320 I339 S340 P341 K345 K346 Y347	L175-I343 HydrophobicContact CD2-CG2 4.16Å; L175-I343 HydrophobicContact CG-CG1 4.38Å; L316-I343 HydrophobicContact CD2-CG2 4.42Å; F320-I343 HydrophobicContact CE2-CG2 3.91Å; I339-I343 HydrophobicContact CG2-CB 3.89Å; I339-I343 HydrophobicContact CG2-CG2 3.62Å; S340-I343 PolarHBondContact O-N 3.15Å; P341-I343 VanDerWaalsContact C-N 3.34Å; P341-I343 PolarHBondContact O-N 3.14Å; I343-K345 VanDerWaalsContact C-N 3.33Å; I343-K345 PolarHBondContact O-N 3.46Å; I343-K346 PolarHBondContact O-N 3.2Å; I343-K346 VanDerWaalsContact O-N 3.17Å; I343-Y347 HydrophobicContact CG2-CD2 4.11Å; I343-Y347 HydrophobicContact CG2-CE2 4.47Å; I343-Y347 WeakPolarHBondContact O-CD2 3.48Å; I343-Y347 PolarHBondContact O-N 3.36Å
344	L	97.4	Very high	97.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-47.7	176	-61.8	-175.3	0	0	0	111.4	W281 V305 L313 L316 I339 S340 P341 K346 Y347 G348 I349 F351	W281-L344 HydrophobicContact CH2-CD1 3.98Å; W281-L344 HydrophobicContact CZ2-CD1 3.5Å; W281-L344 VanDerWaalsContact CZ2-CD1 3.5Å; V305-L344 HydrophobicContact CG2-CD1 4.46Å; L313-L344 HydrophobicContact CD1-CD2 3.61Å; L316-L344 HydrophobicContact CD2-CD2 4.15Å; I339-L344 HydrophobicContact CB-CD2 4.45Å; I339-L344 HydrophobicContact CG2-CD2 3.71Å; I339-L344 HydrophobicContact CG2-CG 4.16Å; S340-L344 PolarHBondContact O-N 2.79Å; P341-L344 PolarHBondContact O-N 3.03Å; L344-K346 PolarHBondContact O-N 2.98Å; L344-Y347 CarbonylContact O-C 3.55Å; L344-Y347 PolarHBondContact O-N 3.42Å; L344-G348 PolarHBondContact O-N 2.94Å; L344-G348 VanDerWaalsContact O-N 3.13Å; L344-I349 HydrophobicContact CB-CB 4.16Å; L344-I349 HydrophobicContact CD2-CB 4.13Å; L344-I349 HydrophobicContact CD2-CG1 4.31Å; L344-I349 HydrophobicContact CD2-CG2 4.16Å; L344-I349 PolarHBondContact O-N 3.23Å; L344-F351 HydrophobicContact CB-CD1 3.58Å; L344-F351 HydrophobicContact CB-CE1 3.9Å; L344-F351 HydrophobicContact CB-CG 4.37Å; L344-F351 HydrophobicContact CD1-CB 4Å; L344-F351 HydrophobicContact CD1-CD1 4.02Å; L344-F351 HydrophobicContact CD1-CG 3.96Å; L344-F351 HydrophobicContact CG-CD1 4.47Å
345	K	97.1	Very high	97.4	Very high	169 Å²	169	48.1 Å²	48.1	74%	0.735	24%	0.242	S	C	*	.	H	α-helix	trans	-60.6	-43.8	174.7	-169.4	172.3	-177.8	176.2	0	112.4	P341 I343 Y347 G348 F351	P341-K345 WeakPolarHBondContact O-CB 3.4Å; P341-K345 PolarHBondContact O-N 2.85Å; I343-K345 VanDerWaalsContact C-N 3.33Å; I343-K345 PolarHBondContact O-N 3.46Å; K345-Y347 VanDerWaalsContact C-N 3.29Å; K345-Y347 PolarHBondContact O-N 3.28Å; K345-G348 PolarHBondContact O-N 3.17Å; K345-G348 VanDerWaalsContact O-N 3.17Å; K345-F351 HydrophobicContact CB-CE1 4.23Å
346	K	97.1	Very high	97.5	Very high	149 Å²	149	44.5 Å²	44.5	65%	0.648	23%	0.226	S	C	*	.	H	α-helix	trans	-60.8	-35.3	178.9	180	178.5	175.2	-174.4	0	113	S342 I343 L344	S342-K346 VanDerWaalsContact O-CB 3.27Å; S342-K346 WeakPolarHBondContact O-CB 3.29Å; S342-K346 PolarHBondContact O-N 3.25Å; I343-K346 PolarHBondContact O-N 3.2Å; I343-K346 VanDerWaalsContact O-N 3.17Å; L344-K346 PolarHBondContact O-N 2.98Å
347	Y	97.1	Very high	97.6	Very high	107 Å²	107	45.3 Å²	45.3	42%	0.42	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	15.7	179	-71.1	-91.4	0	0	0	113.2	L316 F320 I343 L344 K345 I349	L316-Y347 HydrophobicContact CD1-CD1 3.75Å; L316-Y347 HydrophobicContact CD1-CD2 4.15Å; L316-Y347 HydrophobicContact CD1-CE1 4.46Å; L316-Y347 HydrophobicContact CD1-CG 3.58Å; L316-Y347 HydrophobicContact CD2-CG 4.43Å; F320-Y347 HydrophobicContact CE2-CD2 4.2Å; F320-Y347 AromaticContact CE2-CE2 3.93Å; F320-Y347 HydrophobicContact CE2-CE2 3.93Å; F320-Y347 HydrophobicContact CZ-CD2 4.29Å; F320-Y347 HydrophobicContact CZ-CE1 4.35Å; F320-Y347 AromaticContact CZ-CE2 3.56Å; F320-Y347 HydrophobicContact CZ-CE2 3.56Å; F320-Y347 AromaticContact CZ-CZ 3.61Å; I343-Y347 HydrophobicContact CG2-CD2 4.11Å; I343-Y347 HydrophobicContact CG2-CE2 4.47Å; I343-Y347 WeakPolarHBondContact O-CD2 3.48Å; I343-Y347 PolarHBondContact O-N 3.36Å; L344-Y347 CarbonylContact O-C 3.55Å; L344-Y347 PolarHBondContact O-N 3.42Å; K345-Y347 VanDerWaalsContact C-N 3.29Å; K345-Y347 PolarHBondContact O-N 3.28Å; Y347-I349 PolarHBondContact O-N 3.21Å; Y347-I349 VanDerWaalsContact O-N 3.15Å
348	G	96.3	Very high	97.6	Very high	45 Å²	45	50.5 Å²	50.5	46%	0.464	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	20.6	175.3	0	0	0	0	0	114.5	R312 L344 K345 P350	R312-G348 PolarHBondContact NH2-O 3.16Å; L344-G348 PolarHBondContact O-N 2.94Å; L344-G348 VanDerWaalsContact O-N 3.13Å; K345-G348 PolarHBondContact O-N 3.17Å; K345-G348 VanDerWaalsContact O-N 3.17Å; G348-P350 VanDerWaalsContact O-CD 3.29Å; G348-P350 WeakPolarHBondContact O-CD 3.49Å
349	I	98	Very high	97.6	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.051	27%	0.265	C	S	.	.			trans	-73.9	116.5	172.2	-55.2	-59	0	0	0	107.3	V305 R312 L316 L344 Y347 F351	V305-I349 HydrophobicContact CG1-CG2 4.24Å; V305-I349 HydrophobicContact CG2-CG2 4.02Å; R312-I349 HydrophobicContact CB-CD1 3.66Å; L316-I349 HydrophobicContact CD2-CD1 4.38Å; L316-I349 HydrophobicContact CD2-CG1 3.64Å; L344-I349 HydrophobicContact CB-CB 4.16Å; L344-I349 HydrophobicContact CD2-CB 4.13Å; L344-I349 HydrophobicContact CD2-CG1 4.31Å; L344-I349 HydrophobicContact CD2-CG2 4.16Å; L344-I349 PolarHBondContact O-N 3.23Å; Y347-I349 PolarHBondContact O-N 3.21Å; Y347-I349 VanDerWaalsContact O-N 3.15Å; I349-F351 PolarHBondContact O-N 3.11Å
350	P	97.3	Very high	97.6	Very high	45 Å²	45	52.1 Å²	52.1	29%	0.292	27%	0.268	S	S	.	.			trans	-69.5	132.6	173.8	29.4	-33.8	0	0	0	109.1	H309 R312 G348	H309-P350 HydrophobicContact CB-CG 4.06Å; H309-P350 WeakPolarHBondContact CD2-CG 3.37Å; R312-P350 VanDerWaalsContact NH1-CD 3.26Å; G348-P350 VanDerWaalsContact O-CD 3.29Å; G348-P350 WeakPolarHBondContact O-CD 3.49Å
351	F	98.3	Very high	97.6	Very high	50 Å²	50	51.9 Å²	51.9	22%	0.219	27%	0.267	C	S	.	.			trans	-144.7	164	175.2	71.9	-84.4	0	0	0	108.3	T304 V305 P341 L344 K345 I349	T304-F351 CarbonylContact O-C 3.56Å; T304-F351 WeakPolarHBondContact O-CA 2.95Å; T304-F351 VanDerWaalsContact O-CB 3.23Å; T304-F351 WeakPolarHBondContact O-CB 3.38Å; V305-F351 HydrophobicContact CG2-CB 3.96Å; P341-F351 HydrophobicContact CB-CE1 4.43Å; P341-F351 HydrophobicContact CB-CE2 3.78Å; P341-F351 HydrophobicContact CB-CZ 3.58Å; P341-F351 HydrophobicContact CG-CE2 4.28Å; L344-F351 HydrophobicContact CB-CD1 3.58Å; L344-F351 HydrophobicContact CB-CE1 3.9Å; L344-F351 HydrophobicContact CB-CG 4.37Å; L344-F351 HydrophobicContact CD1-CB 4Å; L344-F351 HydrophobicContact CD1-CD1 4.02Å; L344-F351 HydrophobicContact CD1-CG 3.96Å; L344-F351 HydrophobicContact CG-CD1 4.47Å; K345-F351 HydrophobicContact CB-CE1 4.23Å; I349-F351 PolarHBondContact O-N 3.11Å
352	D	98.1	Very high	97.7	Very high	27 Å²	27	51.3 Å²	51.3	14%	0.144	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	165.7	171.5	-153.2	23.9	0	0	0	110	K107 I108 Y303 T304	K107-D352 HydrophobicContact CD-CB 4.49Å; K107-D352 VanDerWaalsContact CD-CG 3.5Å; K107-D352 WeakPolarHBondContact CD-OD2 3.46Å; K107-D352 VanDerWaalsContact NZ-CG 3.32Å; K107-D352 IonicContact NZ-OD1 3.87Å; K107-D352 PolarHBondContact NZ-OD1 3.32Å; K107-D352 IonicContact NZ-OD2 2.79Å; I108-D352 HydrophobicContact CD1-CB 3.76Å; I108-D352 HydrophobicContact CG1-CB 3.91Å; I108-D352 WeakPolarHBondContact CG1-OD2 3.22Å; I108-D352 PolarHBondContact N-OD2 2.92Å; Y303-D352 CarbonylContact C-O 3.58Å; Y303-D352 WeakPolarHBondContact CA-O 3.08Å; T304-D352 HydrophobicContact CG2-CB 4.25Å; T304-D352 PolarHBondContact N-O 2.89Å; T304-D352 PolarHBondContact O-N 3.28Å
353	R	97.4	Very high	97.8	Very high	106 Å²	106	47 Å²	47	40%	0.4	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.4	-177.9	69.9	-179.4	-176.3	159.8	9.2	112.1	D209 E212 W302 Y303	D209-R353 IonicContact OD1-CZ 2.77Å; D209-R353 IonicContact OD1-NH1 3.82Å; D209-R353 PolarHBondContact OD1-NH1 3.01Å; D209-R353 IonicContact OD1-NH2 2.65Å; D209-R353 PolarHBondContact OD1-NH2 3.27Å; D209-R353 IonicContact OD2-NH2 2.84Å; D209-R353 PolarHBondContact OD2-NH2 2.88Å; E212-R353 WeakPolarHBondContact OE1-CD 3.41Å; E212-R353 IonicContact OE1-CZ 3.52Å; E212-R353 IonicContact OE1-NE 3.31Å; E212-R353 IonicContact OE1-NH1 2.67Å; E212-R353 PolarHBondContact OE1-NH1 3.25Å; E212-R353 IonicContact OE2-NH1 3.18Å; E212-R353 PolarHBondContact OE2-NH1 3.44Å; W302-R353 VanDerWaalsContact O-CA 3.24Å; W302-R353 WeakPolarHBondContact O-CA 3.36Å; Y303-R353 HydrophobicContact CD1-CB 3.79Å; Y303-R353 HydrophobicContact CE1-CB 4.22Å
354	I	98.4	Very high	97.9	Very high	29 Å²	29	46.2 Å²	46.2	15%	0.149	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	153.5	176.3	-164	162.1	0	0	0	110.4	I108 L138 K140 W302 M362	I108-I354 HydrophobicContact CD1-CB 3.91Å; I108-I354 HydrophobicContact CD1-CG2 3.88Å; I108-I354 HydrophobicContact CG2-CB 4.26Å; I108-I354 HydrophobicContact CG2-CD1 3.63Å; I108-I354 HydrophobicContact CG2-CG2 4.15Å; L138-I354 HydrophobicContact CD2-CG2 3.96Å; K140-I354 HydrophobicContact CB-CD1 4.06Å; K140-I354 HydrophobicContact CD-CD1 4.36Å; W302-I354 HydrophobicContact CB-CG2 4.15Å; W302-I354 PolarHBondContact N-O 3.29Å; W302-I354 PolarHBondContact O-N 3.23Å; I354-M362 HydrophobicContact CG2-CE 3.6Å; I354-M362 HydrophobicContact CG2-SD 4.47Å
355	T	98.3	Very high	97.9	Very high	24 Å²	24	46.2 Å²	46.2	15%	0.147	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.3	170.8	-62.5	0	0	0	0	109	K140 F208 P299 S301	K140-T355 WeakPolarHBondContact CE-O 3.23Å; K140-T355 PolarHBondContact NZ-O 3.18Å; F208-T355 HydrophobicContact CE1-CG2 4.19Å; F208-T355 HydrophobicContact CE2-CG2 4.33Å; F208-T355 HydrophobicContact CZ-CG2 4.06Å; P299-T355 HydrophobicContact CB-CG2 3.41Å; P299-T355 VanDerWaalsContact CB-CG2 3.41Å; P299-T355 HydrophobicContact CG-CG2 4.37Å; S301-T355 PolarHBondContact OG-OG1 3.26Å
356	Q	98.6	Very high	98	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.4	171	178.2	-169	19.8	0	0	108.7	N292 L294 P299 K300 E360 M362	N292-Q356 PolarHBondContact O-NE2 3.13Å; N292-Q356 VanDerWaalsContact O-NE2 3.17Å; N292-Q356 PolarHBondContact OD1-NE2 3.11Å; N292-Q356 VanDerWaalsContact OD1-NE2 3.11Å; N292-Q356 PolarHBondContact OD1-OE1 2.78Å; L294-Q356 HydrophobicContact CB-CG 4.04Å; L294-Q356 HydrophobicContact CD2-CG 4.26Å; L294-Q356 WeakPolarHBondContact CD2-O 3.41Å; P299-Q356 CarbonylContact C-O 3.25Å; P299-Q356 VanDerWaalsContact CA-O 3.25Å; P299-Q356 WeakPolarHBondContact CA-O 3.39Å; P299-Q356 VanDerWaalsContact CB-O 3.26Å; P299-Q356 WeakPolarHBondContact CB-O 3.48Å; K300-Q356 HydrophobicContact CB-CB 4.36Å; K300-Q356 PolarHBondContact N-O 2.97Å; K300-Q356 PolarHBondContact O-N 2.62Å; Q356-E360 VanDerWaalsContact CA-OE2 3.28Å; Q356-E360 WeakPolarHBondContact CA-OE2 3.38Å; Q356-E360 HydrophobicContact CG-CB 4.15Å; Q356-E360 PolarHBondContact NE2-O 3.26Å; Q356-M362 HydrophobicContact CB-CG 3.77Å; Q356-M362 HydrophobicContact CB-SD 3.99Å; Q356-M362 HydrophobicContact CG-CG 3.63Å; Q356-M362 HydrophobicContact CG-SD 4.22Å
357	N	98.2	Very high	98	Very high	57 Å²	57	31.7 Å²	31.7	31%	0.305	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-97.5	169.3	176.4	-49.7	-62.8	0	0	0	110.5	E360	N357-E360 HydrophobicContact CB-CG 4.18Å; N357-E360 PolarHBondContact N-OE2 2.87Å; N357-E360 PolarHBondContact ND2-OE1 3.18Å; N357-E360 PolarHBondContact ND2-OE2 3.33Å; N357-E360 WeakPolarHBondContact O-CB 3.31Å; N357-E360 PolarHBondContact O-N 3.01Å
358	E	97.4	Very high	98.1	Very high	113 Å²	113	26.7 Å²	26.7	53%	0.528	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	139	168.9	171.9	168.9	147.9	0	0	111	F296 G297 E360	F296-E358 VanDerWaalsContact CA-OE2 3.31Å; F296-E358 WeakPolarHBondContact CA-OE2 3.49Å; G297-E358 PolarHBondContact N-OE2 2.97Å; E358-E360 VanDerWaalsContact C-N 3.3Å; E358-E360 PolarHBondContact O-N 2.62Å
359	G	97.3	Very high	98.2	Very high	21 Å²	21	25.2 Å²	25.2	22%	0.216	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	0.9	-178	0	0	0	0	0	115.3	P143 Y293 L294	P143-G359 WeakPolarHBondContact CD-O 3.4Å; P143-G359 VanDerWaalsContact CG-O 3.23Å; P143-G359 WeakPolarHBondContact CG-O 3.22Å; Y293-G359 WeakPolarHBondContact CE2-O 3.39Å; L294-G359 PolarHBondContact O-N 2.91Å
360	E	98.5	Very high	98.2	Very high	16 Å²	16	24.9 Å²	24.9	8%	0.075	13%	0.125	C	C	.	.			trans	-105.2	138.2	-177.3	-57	-178.3	155.5	0	0	113.4	K140 I142 L294 Q356 N357 E358	K140-E360 HydrophobicContact CD-CG 4.5Å; K140-E360 WeakPolarHBondContact CD-OE2 3.47Å; K140-E360 WeakPolarHBondContact CE-OE2 3.2Å; K140-E360 IonicContact NZ-OE1 3.44Å; K140-E360 PolarHBondContact NZ-OE1 3.42Å; K140-E360 IonicContact NZ-OE2 3.39Å; K140-E360 PolarHBondContact NZ-OE2 3.38Å; I142-E360 HydrophobicContact CG1-CG 4.16Å; L294-E360 PolarHBondContact N-O 2.79Å; Q356-E360 VanDerWaalsContact CA-OE2 3.28Å; Q356-E360 WeakPolarHBondContact CA-OE2 3.38Å; Q356-E360 HydrophobicContact CG-CB 4.15Å; Q356-E360 PolarHBondContact NE2-O 3.26Å; N357-E360 HydrophobicContact CB-CG 4.18Å; N357-E360 PolarHBondContact N-OE2 2.87Å; N357-E360 PolarHBondContact ND2-OE1 3.18Å; N357-E360 PolarHBondContact ND2-OE2 3.33Å; N357-E360 WeakPolarHBondContact O-CB 3.31Å; N357-E360 PolarHBondContact O-N 3.01Å; E358-E360 VanDerWaalsContact C-N 3.3Å; E358-E360 PolarHBondContact O-N 2.62Å
361	F	98.8	Very high	98.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	145.8	168.6	-68.8	-89.2	0	0	0	111.8	F118 K140 V141 P143 W147 W242 I244 I291 N292 Y293	F118-F361 HydrophobicContact CE2-CD2 4.49Å; F118-F361 HydrophobicContact CE2-CE2 4.04Å; F118-F361 AromaticContact CZ-CE2 3.71Å; F118-F361 HydrophobicContact CZ-CE2 3.71Å; F118-F361 HydrophobicContact CZ-CZ 4.17Å; K140-F361 WeakPolarHBondContact CA-O 3.29Å; V141-F361 HydrophobicContact CB-CB 4.17Å; V141-F361 PolarHBondContact N-O 3.46Å; V141-F361 WeakPolarHBondContact O-CB 3.39Å; V141-F361 PolarHBondContact O-N 2.72Å; P143-F361 HydrophobicContact CB-CE2 4.21Å; P143-F361 HydrophobicContact CG-CD2 4.43Å; P143-F361 HydrophobicContact CG-CE2 4.31Å; W147-F361 HydrophobicContact CE3-CE2 4.49Å; W147-F361 AromaticContact CH2-CE2 3.87Å; W147-F361 HydrophobicContact CH2-CE2 3.87Å; W147-F361 AromaticContact CH2-CZ 3.58Å; W147-F361 HydrophobicContact CH2-CZ 3.58Å; W147-F361 AromaticContact CZ3-CE2 3.64Å; W147-F361 HydrophobicContact CZ3-CE2 3.64Å; W147-F361 AromaticContact CZ3-CZ 3.84Å; W147-F361 HydrophobicContact CZ3-CZ 3.84Å; W242-F361 HydrophobicContact CB-CE1 4.18Å; W242-F361 HydrophobicContact CB-CE2 4.44Å; W242-F361 HydrophobicContact CB-CZ 3.75Å; W242-F361 AromaticContact CE3-CD1 3.97Å; W242-F361 HydrophobicContact CE3-CD1 3.97Å; W242-F361 HydrophobicContact CE3-CD2 4.11Å; W242-F361 AromaticContact CE3-CE1 4Å; W242-F361 HydrophobicContact CE3-CE1 4Å; W242-F361 HydrophobicContact CE3-CE2 4.17Å; W242-F361 AromaticContact CE3-CG 4Å; W242-F361 HydrophobicContact CE3-CG 4Å; W242-F361 HydrophobicContact CE3-CZ 4.1Å; W242-F361 HydrophobicContact CG-CZ 4.46Å; W242-F361 HydrophobicContact CZ3-CB 4.42Å; W242-F361 HydrophobicContact CZ3-CD1 4.49Å; W242-F361 HydrophobicContact CZ3-CG 4.27Å; I244-F361 HydrophobicContact CD1-CE1 4.35Å; I291-F361 HydrophobicContact CD1-CD1 3.62Å; I291-F361 HydrophobicContact CD1-CE1 3.77Å; I291-F361 HydrophobicContact CG1-CD1 3.75Å; I291-F361 HydrophobicContact CG1-CE1 4.26Å; N292-F361 CarbonylContact O-C 3.51Å; N292-F361 WeakPolarHBondContact O-CA 3.33Å; Y293-F361 AromaticContact CD2-CD1 3.76Å; Y293-F361 HydrophobicContact CD2-CD1 3.76Å; Y293-F361 AromaticContact CD2-CD2 3.65Å; Y293-F361 HydrophobicContact CD2-CD2 3.65Å; Y293-F361 AromaticContact CD2-CE1 3.67Å; Y293-F361 HydrophobicContact CD2-CE1 3.67Å; Y293-F361 AromaticContact CD2-CE2 3.53Å; Y293-F361 HydrophobicContact CD2-CE2 3.53Å; Y293-F361 AromaticContact CD2-CG 3.77Å; Y293-F361 HydrophobicContact CD2-CG 3.77Å; Y293-F361 AromaticContact CD2-CZ 3.56Å; Y293-F361 HydrophobicContact CD2-CZ 3.56Å; Y293-F361 HydrophobicContact CE2-CD2 4.1Å; Y293-F361 AromaticContact CE2-CE2 3.79Å; Y293-F361 HydrophobicContact CE2-CE2 3.79Å; Y293-F361 HydrophobicContact CE2-CZ 4.1Å; Y293-F361 HydrophobicContact CG-CD1 4.18Å; Y293-F361 AromaticContact CG-CE1 3.97Å; Y293-F361 HydrophobicContact CG-CE1 3.97Å; Y293-F361 HydrophobicContact CG-CZ 4.16Å
362	M	98.8	Very high	98.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.5	165.8	-62.9	-58.7	-53.7	0	0	109.2	L138 A139 K140 I291 N292 W302 I354 Q356	L138-M362 HydrophobicContact CD1-CB 4.45Å; L138-M362 HydrophobicContact CD1-CE 3.72Å; L138-M362 HydrophobicContact CD2-CE 3.71Å; L138-M362 HydrophobicContact CG-CE 3.54Å; A139-M362 WeakPolarHBondContact O-CA 3.3Å; A139-M362 WeakPolarHBondContact O-CE 3.35Å; K140-M362 HydrophobicContact CB-CE 4.18Å; K140-M362 HydrophobicContact CB-SD 3.67Å; K140-M362 HydrophobicContact CG-SD 3.91Å; I291-M362 WeakPolarHBondContact CA-O 3.32Å; N292-M362 PolarHBondContact N-O 3.19Å; N292-M362 PolarHBondContact O-N 2.83Å; W302-M362 HydrophobicContact CH2-CB 4.48Å; W302-M362 HydrophobicContact CZ2-CB 3.97Å; W302-M362 HydrophobicContact CZ2-CG 4.13Å; I354-M362 HydrophobicContact CG2-CE 3.6Å; I354-M362 HydrophobicContact CG2-SD 4.47Å; Q356-M362 HydrophobicContact CB-CG 3.77Å; Q356-M362 HydrophobicContact CB-SD 3.99Å; Q356-M362 HydrophobicContact CG-CG 3.63Å; Q356-M362 HydrophobicContact CG-SD 4.22Å
363	I	98.7	Very high	98.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.1	174.7	-58.4	-61.6	0	0	0	108.3	F121 I125 M128 L138 A139 V141 W242 S290 I291 F365 F385	F121-I363 HydrophobicContact CE2-CD1 4.28Å; I125-I363 HydrophobicContact CD1-CD1 4.13Å; I125-I363 HydrophobicContact CD1-CG1 4.1Å; I125-I363 HydrophobicContact CD1-CG2 4.01Å; M128-I363 HydrophobicContact CE-CB 4.32Å; M128-I363 HydrophobicContact CE-CG1 4.1Å; L138-I363 CarbonylContact C-O 3.59Å; L138-I363 WeakPolarHBondContact CA-O 3.44Å; A139-I363 PolarHBondContact N-O 3.01Å; A139-I363 PolarHBondContact O-N 2.58Å; V141-I363 HydrophobicContact CG2-CG1 4.33Å; W242-I363 HydrophobicContact CZ3-CD1 4.2Å; S290-I363 CarbonylContact O-C 3.41Å; S290-I363 WeakPolarHBondContact O-CA 3.11Å; I291-I363 HydrophobicContact CB-CD1 3.77Å; I291-I363 HydrophobicContact CD1-CD1 3.95Å; I291-I363 HydrophobicContact CG1-CD1 3.68Å; I363-F365 HydrophobicContact CB-CE2 4.35Å; I363-F365 HydrophobicContact CB-CZ 4.49Å; I363-F365 HydrophobicContact CG2-CD2 4.4Å; I363-F365 HydrophobicContact CG2-CE1 4.24Å; I363-F365 HydrophobicContact CG2-CE2 3.96Å; I363-F365 HydrophobicContact CG2-CZ 3.88Å; I363-F385 HydrophobicContact CD1-CE1 4.25Å; I363-F385 HydrophobicContact CD1-CZ 4.41Å; I363-F385 HydrophobicContact CG2-CE1 4.39Å; I363-F385 HydrophobicContact CG2-CZ 4.01Å
364	T	98.6	Very high	98.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.006	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	148.7	166.5	83	0	0	0	0	109.5	L138 Y289 S290 W302	L138-T364 HydrophobicContact CD1-CG2 3.89Å; Y289-T364 WeakPolarHBondContact CA-O 3.17Å; Y289-T364 WeakPolarHBondContact CB-O 3.09Å; S290-T364 PolarHBondContact N-O 3.38Å; S290-T364 PolarHBondContact N-OG1 2.73Å; S290-T364 PolarHBondContact O-N 3.21Å; S290-T364 VanDerWaalsContact OG-CG2 3.22Å; S290-T364 WeakPolarHBondContact OG-CG2 3.37Å; S290-T364 PolarHBondContact OG-OG1 2.85Å; W302-T364 HydrophobicContact CZ3-CG2 4.01Å
365	F	98.5	Very high	98.3	Very high	1 Å²	1	13.1 Å²	13.1	0%	0.004	7%	0.071	C	C	.	.			trans	-112.7	152.8	-176.4	-67.7	-92.4	0	0	0	111.6	M128 E129 A133 H134 G137 A139 Y289 I363 Y367 G368	M128-F365 HydrophobicContact CE-CZ 4.28Å; E129-F365 HydrophobicContact CG-CD1 4.46Å; E129-F365 HydrophobicContact CG-CE1 3.87Å; E129-F365 VanDerWaalsContact OE1-CD1 3.23Å; E129-F365 WeakPolarHBondContact OE1-CD1 3.41Å; E129-F365 WeakPolarHBondContact OE1-CE1 3.36Å; A133-F365 HydrophobicContact CB-CE2 4.4Å; A133-F365 HydrophobicContact CB-CZ 3.96Å; H134-F365 VanDerWaalsContact CA-CD1 3.49Å; H134-F365 HydrophobicContact CB-CB 4.33Å; H134-F365 HydrophobicContact CB-CD1 3.4Å; H134-F365 HydrophobicContact CB-CE1 3.75Å; H134-F365 HydrophobicContact CB-CG 3.88Å; H134-F365 HydrophobicContact CB-CZ 4.47Å; G137-F365 PolarHBondContact O-N 3.25Å; A139-F365 HydrophobicContact CB-CE2 3.7Å; A139-F365 HydrophobicContact CB-CZ 4.18Å; Y289-F365 AromaticContact CD1-CD1 3.94Å; Y289-F365 HydrophobicContact CD1-CD1 3.94Å; Y289-F365 HydrophobicContact CD1-CE1 4.49Å; Y289-F365 AromaticContact CE1-CD1 3.57Å; Y289-F365 HydrophobicContact CE1-CD1 3.57Å; Y289-F365 HydrophobicContact CE1-CE1 4.11Å; Y289-F365 HydrophobicContact CE1-CG 4.47Å; I363-F365 HydrophobicContact CB-CE2 4.35Å; I363-F365 HydrophobicContact CB-CZ 4.49Å; I363-F365 HydrophobicContact CG2-CD2 4.4Å; I363-F365 HydrophobicContact CG2-CE1 4.24Å; I363-F365 HydrophobicContact CG2-CE2 3.96Å; I363-F365 HydrophobicContact CG2-CZ 3.88Å; F365-Y367 PolarHBondContact O-N 2.81Å; F365-G368 WeakPolarHBondContact O-CA 3.41Å; F365-G368 PolarHBondContact O-N 2.87Å
366	P	98.1	Very high	98.3	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.9	124.6	177.6	-36.4	34.4	0	0	0	114.4	D287 Y289 G368 W390 Y393	D287-P366 VanDerWaalsContact O-CA 3.24Å; D287-P366 WeakPolarHBondContact O-CA 3.1Å; D287-P366 VanDerWaalsContact O-CB 3.27Å; D287-P366 WeakPolarHBondContact O-CB 3.43Å; Y289-P366 VanDerWaalsContact CD1-CD 3.41Å; Y289-P366 HydrophobicContact CD1-CG 4.3Å; Y289-P366 HydrophobicContact CD2-CG 3.61Å; Y289-P366 HydrophobicContact CE1-CG 4.11Å; Y289-P366 HydrophobicContact CE2-CG 3.38Å; Y289-P366 VanDerWaalsContact CG-CD 3.49Å; Y289-P366 HydrophobicContact CG-CG 4.05Å; Y289-P366 VanDerWaalsContact CZ-CD 3.46Å; P366-G368 PolarHBondContact O-N 2.71Å; P366-W390 HydrophobicContact CG-CB 4.14Å; P366-Y393 HydrophobicContact CB-CD1 3.39Å; P366-Y393 HydrophobicContact CB-CD2 4.26Å; P366-Y393 HydrophobicContact CB-CE1 3.9Å; P366-Y393 HydrophobicContact CB-CG 3.62Å; P366-Y393 WeakPolarHBondContact O-CE1 3.18Å
367	Y	98.1	Very high	98.3	Very high	14 Å²	14	13.2 Å²	13.2	6%	0.055	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	12.3	-175.8	-165.7	-113.7	0	0	0	115.6	T283 P307 K311 E314 F365 Y369	T283-Y367 HydrophobicContact CG2-CD2 4.07Å; P307-Y367 HydrophobicContact CB-CD1 4.28Å; P307-Y367 WeakPolarHBondContact O-CD1 3.27Å; P307-Y367 WeakPolarHBondContact O-CE1 3.44Å; K311-Y367 WeakPolarHBondContact CD-OH 3.29Å; K311-Y367 WeakPolarHBondContact CE-OH 3.23Å; K311-Y367 HydrophobicContact CG-CE1 4.43Å; K311-Y367 WeakPolarHBondContact CG-OH 3.44Å; K311-Y367 PolarHBondContact N-OH 3.05Å; K311-Y367 VanDerWaalsContact N-OH 3.08Å; K311-Y367 PolarHBondContact NZ-OH 2.87Å; E314-Y367 WeakPolarHBondContact OE1-CE2 3.35Å; E314-Y367 PolarHBondContact OE1-OH 3.36Å; F365-Y367 PolarHBondContact O-N 2.81Å; Y367-Y369 HydrophobicContact CD2-CE2 4.4Å; Y367-Y369 HydrophobicContact CE2-CD2 4.49Å; Y367-Y369 AromaticContact CE2-CE2 3.73Å; Y367-Y369 HydrophobicContact CE2-CE2 3.73Å; Y367-Y369 AromaticContact CZ-CE2 3.91Å; Y367-Y369 PolarHBondContact O-N 3.31Å
368	G	97.9	Very high	98.3	Very high	2 Å²	2	10.5 Å²	10.5	2%	0.021	6%	0.056	C	C	.	.			trans	-73.5	98.3	169.7	0	0	0	0	0	111.2	F365 P366 H370	F365-G368 WeakPolarHBondContact O-CA 3.41Å; F365-G368 PolarHBondContact O-N 2.87Å; P366-G368 PolarHBondContact O-N 2.71Å; G368-H370 PolarHBondContact O-N 3.23Å; G368-H370 PolarHBondContact O-ND1 2.92Å
369	Y	98.7	Very high	98.4	Very high	13 Å²	13	5.1 Å²	5.1	5%	0.051	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.5	176.5	-91.2	-80.5	0	0	0	110.4	H282 T283 T304 V305 L313 E314 L332 Y367	H282-Y369 WeakPolarHBondContact O-CA 3.18Å; T283-Y369 HydrophobicContact CG2-CD1 3.89Å; T283-Y369 HydrophobicContact CG2-CD2 3.64Å; T283-Y369 HydrophobicContact CG2-CE1 3.98Å; T283-Y369 HydrophobicContact CG2-CE2 3.76Å; T283-Y369 HydrophobicContact CG2-CG 3.72Å; T304-Y369 CarbonylContact C-O 3.53Å; T304-Y369 VanDerWaalsContact CA-O 3.25Å; T304-Y369 WeakPolarHBondContact CA-O 3.29Å; T304-Y369 PolarHBondContact OG1-O 3.22Å; T304-Y369 VanDerWaalsContact OG1-O 3.07Å; V305-Y369 PolarHBondContact N-O 2.72Å; V305-Y369 PolarHBondContact O-N 3.22Å; L313-Y369 HydrophobicContact CD2-CD1 3.8Å; L313-Y369 HydrophobicContact CD2-CD2 4.33Å; L313-Y369 HydrophobicContact CD2-CG 3.69Å; E314-Y369 HydrophobicContact CG-CE2 4.1Å; E314-Y369 VanDerWaalsContact CG-OH 3.3Å; E314-Y369 WeakPolarHBondContact CG-OH 3.32Å; E314-Y369 PolarHBondContact OE1-OH 2.85Å; L332-Y369 HydrophobicContact CB-CE1 4.12Å; L332-Y369 HydrophobicContact CD1-CD1 4.44Å; L332-Y369 HydrophobicContact CD1-CE1 3.54Å; L332-Y369 HydrophobicContact CG-CE1 4.47Å; Y367-Y369 HydrophobicContact CD2-CE2 4.4Å; Y367-Y369 HydrophobicContact CE2-CD2 4.49Å; Y367-Y369 AromaticContact CE2-CE2 3.73Å; Y367-Y369 HydrophobicContact CE2-CE2 3.73Å; Y367-Y369 AromaticContact CZ-CE2 3.91Å; Y367-Y369 PolarHBondContact O-N 3.31Å
370	H	98.7	Very high	98.4	Very high	4 Å²	4	4.1 Å²	4.1	2%	0.019	2%	0.02	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.6	179.1	64.7	-90.8	0	0	0	112.6	A280 W281 H282 E284 W302 Y303 G368	A280-H370 VanDerWaalsContact O-O 3.05Å; W281-H370 WeakPolarHBondContact CA-O 3.46Å; H282-H370 AromaticContact CE1-CD2 3.83Å; H282-H370 AromaticContact CE1-CE1 3.92Å; H282-H370 AromaticContact CE1-NE2 3.17Å; H282-H370 PolarHBondContact CE1-NE2 3.05Å; H282-H370 PolarHBondContact N-O 3.23Å; H282-H370 VanDerWaalsContact N-O 3.1Å; H282-H370 AromaticContact ND1-NE2 3.81Å; H282-H370 AromaticContact NE2-NE2 3.62Å; H282-H370 PolarHBondContact O-N 3.3Å; E284-H370 IonicContact OE1-CE1 2.72Å; E284-H370 PolarHBondContact OE1-CE1 3.3Å; E284-H370 VanDerWaalsContact OE1-CE1 3.28Å; E284-H370 IonicContact OE1-NE2 2.75Å; W302-H370 AromaticContact CZ3-CD2 3.72Å; Y303-H370 WeakPolarHBondContact O-CA 3.15Å; Y303-H370 WeakPolarHBondContact O-CB 3.46Å; G368-H370 PolarHBondContact O-N 3.23Å; G368-H370 PolarHBondContact O-ND1 2.92Å
371	A	98.6	Very high	98.4	Very high	4 Å²	4	3.3 Å²	3.3	3%	0.033	2%	0.017	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	168.3	177.2	0	0	0	0	0	109.8	F279 W281 W302 Y303	F279-A371 CarbonylContact O-C 3.59Å; F279-A371 WeakPolarHBondContact O-CA 3.47Å; W281-A371 HydrophobicContact CB-CB 4.44Å; W281-A371 HydrophobicContact CD2-CB 3.5Å; W281-A371 VanDerWaalsContact CD2-CB 3.5Å; W281-A371 HydrophobicContact CE3-CB 3.92Å; W281-A371 HydrophobicContact CG-CB 3.75Å; W281-A371 HydrophobicContact CH2-CB 4.44Å; W281-A371 HydrophobicContact CZ2-CB 4.05Å; W281-A371 HydrophobicContact CZ3-CB 4.38Å; W302-A371 CarbonylContact C-O 3.25Å; Y303-A371 WeakPolarHBondContact CD2-O 3.5Å; Y303-A371 PolarHBondContact N-O 3.31Å; Y303-A371 PolarHBondContact O-N 2.88Å; Y303-A371 VanDerWaalsContact O-N 3.08Å
372	G	98.1	Very high	98.2	Very high	3 Å²	3	4.2 Å²	4.2	3%	0.031	2%	0.023	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-172.3	178.7	0	0	0	0	0	115.8	T278 F279 S301	T278-G372 WeakPolarHBondContact CA-O 3.4Å; F279-G372 WeakPolarHBondContact CD1-O 3.36Å; F279-G372 VanDerWaalsContact CE2-N 3.32Å; F279-G372 PolarHBondContact N-O 3.32Å; F279-G372 PolarHBondContact O-N 2.9Å; S301-G372 CarbonylContact O-C 3.34Å; S301-G372 WeakPolarHBondContact O-CA 3.45Å
373	F	98.6	Very high	98	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.025	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149.7	-176	68.6	-82.6	0	0	0	113.3	E212 Y215 W275 T277 S301 Y303 H375	E212-F373 HydrophobicContact CB-CZ 4.39Å; E212-F373 HydrophobicContact CG-CE1 4.27Å; E212-F373 HydrophobicContact CG-CZ 4.39Å; Y215-F373 AromaticContact CD1-CD1 3.64Å; Y215-F373 HydrophobicContact CD1-CD1 3.64Å; Y215-F373 AromaticContact CD1-CE1 3.9Å; Y215-F373 HydrophobicContact CD1-CE1 3.9Å; Y215-F373 AromaticContact CD1-CG 3.99Å; Y215-F373 HydrophobicContact CD1-CG 3.99Å; Y215-F373 HydrophobicContact CD1-CZ 4.44Å; Y215-F373 HydrophobicContact CD2-CB 3.77Å; Y215-F373 HydrophobicContact CD2-CD1 4.17Å; Y215-F373 AromaticContact CD2-CD2 3.79Å; Y215-F373 HydrophobicContact CD2-CD2 3.79Å; Y215-F373 HydrophobicContact CD2-CE2 4.47Å; Y215-F373 AromaticContact CD2-CG 3.62Å; Y215-F373 HydrophobicContact CD2-CG 3.62Å; Y215-F373 HydrophobicContact CE1-CB 4.32Å; Y215-F373 AromaticContact CE1-CD1 3.79Å; Y215-F373 HydrophobicContact CE1-CD1 3.79Å; Y215-F373 HydrophobicContact CE1-CE1 4.43Å; Y215-F373 HydrophobicContact CE1-CG 4.15Å; Y215-F373 HydrophobicContact CE2-CB 3.44Å; Y215-F373 VanDerWaalsContact CE2-CB 3.44Å; Y215-F373 HydrophobicContact CE2-CD1 4.3Å; Y215-F373 HydrophobicContact CE2-CD2 4.38Å; Y215-F373 AromaticContact CE2-CG 3.79Å; Y215-F373 HydrophobicContact CE2-CG 3.79Å; Y215-F373 HydrophobicContact CG-CB 4.34Å; Y215-F373 AromaticContact CG-CD1 3.85Å; Y215-F373 HydrophobicContact CG-CD1 3.85Å; Y215-F373 AromaticContact CG-CD2 3.88Å; Y215-F373 HydrophobicContact CG-CD2 3.88Å; Y215-F373 HydrophobicContact CG-CE1 4.12Å; Y215-F373 HydrophobicContact CG-CE2 4.15Å; Y215-F373 AromaticContact CG-CG 3.74Å; Y215-F373 HydrophobicContact CG-CG 3.74Å; Y215-F373 HydrophobicContact CG-CZ 4.26Å; W275-F373 HydrophobicContact CZ3-CD2 4.14Å; W275-F373 AromaticContact CZ3-CE2 3.99Å; W275-F373 HydrophobicContact CZ3-CE2 3.99Å; T277-F373 CarbonylContact O-C 3.49Å; T277-F373 VanDerWaalsContact O-CA 3.25Å; T277-F373 WeakPolarHBondContact O-CA 3.26Å; S301-F373 PolarHBondContact N-O 2.87Å; S301-F373 PolarHBondContact O-N 3.46Å; Y303-F373 HydrophobicContact CE2-CD1 4.26Å; Y303-F373 HydrophobicContact CE2-CE1 4.34Å; Y303-F373 WeakPolarHBondContact OH-CE1 3.43Å; F373-H375 AromaticContact CE2-CD2 3.62Å; F373-H375 AromaticContact CE2-NE2 3.85Å
374	N	98.6	Very high	97.8	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	141.6	173.6	-60	-68.1	0	0	0	111.5	Y226 K276 T277 K300 N378	Y226-N374 WeakPolarHBondContact CE2-ND2 3.43Å; K276-N374 PolarHBondContact N-O 3.11Å; T277-N374 PolarHBondContact O-N 3.32Å; T277-N374 PolarHBondContact O-ND2 3.17Å; T277-N374 WeakPolarHBondContact OG1-CB 3.49Å; T277-N374 PolarHBondContact OG1-ND2 2.87Å; K300-N374 WeakPolarHBondContact CG-OD1 3.41Å; K300-N374 PolarHBondContact NZ-OD1 2.98Å; N374-N378 PolarHBondContact OD1-ND2 3.26Å; N374-N378 PolarHBondContact OD1-OD1 3.33Å
375	H	98.4	Very high	97.6	Very high	2 Å²	2	5 Å²	5	1%	0.009	3%	0.028	C	C	.	.			trans	-79.9	-28.1	-175.7	-69.4	-159.6	0	0	0	112.6	T202 F208 L211 Q298 P299 S301 F373	T202-H375 WeakPolarHBondContact CB-O 3.33Å; T202-H375 WeakPolarHBondContact CG2-O 3.4Å; T202-H375 PolarHBondContact OG1-O 3.11Å; F208-H375 AromaticContact CD1-CE1 3.43Å; F208-H375 VanDerWaalsContact CD1-CE1 3.43Å; F208-H375 WeakPolarHBondContact CD1-CE1 3.41Å; F208-H375 AromaticContact CD1-ND1 3.8Å; F208-H375 AromaticContact CE1-CE1 3.65Å; F208-H375 AromaticContact CE1-ND1 3.74Å; L211-H375 HydrophobicContact CD2-CB 3.8Å; L211-H375 WeakPolarHBondContact CD2-ND1 3.1Å; Q298-H375 HydrophobicContact CB-CB 4.2Å; P299-H375 VanDerWaalsContact O-CB 3.25Å; P299-H375 WeakPolarHBondContact O-CB 3.38Å; P299-H375 PolarHBondContact O-CD2 3.3Å; P299-H375 VanDerWaalsContact O-CD2 3.29Å; P299-H375 VanDerWaalsContact O-CG 3.25Å; P299-H375 PolarHBondContact O-N 2.93Å; S301-H375 PolarHBondContact OG-NE2 2.79Å; F373-H375 AromaticContact CE2-CD2 3.62Å; F373-H375 AromaticContact CE2-NE2 3.85Å
376	G	97.8	Very high	97.3	Very high	2 Å²	2	5.1 Å²	5.1	2%	0.021	3%	0.028	C	C	.	.	S	Bend	trans	-172.5	-154.6	-177.5	0	0	0	0	0	110.6	T202 G273 M274 N378	T202-G376 VanDerWaalsContact OG1-CA 3.28Å; T202-G376 WeakPolarHBondContact OG1-CA 3.02Å; G273-G376 CarbonylContact C-O 3.6Å; M274-G376 CarbonylContact C-O 3.57Å; M274-G376 WeakPolarHBondContact CA-O 3.14Å; G376-N378 PolarHBondContact O-N 2.59Å
377	F	98.4	Very high	97.1	Very high	24 Å²	24	6 Å²	6	11%	0.105	3%	0.033	C	C	.	.	S	Bend	trans	-63.3	125.2	174.3	175.8	-108.8	0	0	0	111.2	V188 Y191 R192 A195 G273 F296 Q298	V188-F377 HydrophobicContact CG1-CE2 4.36Å; V188-F377 HydrophobicContact CG1-CZ 4.04Å; Y191-F377 HydrophobicContact CD1-CD2 4.04Å; Y191-F377 AromaticContact CD1-CE2 3.91Å; Y191-F377 HydrophobicContact CD1-CE2 3.91Å; Y191-F377 HydrophobicContact CE1-CD2 4.08Å; Y191-F377 HydrophobicContact CE1-CE2 4.27Å; R192-F377 HydrophobicContact CB-CD1 4.46Å; R192-F377 HydrophobicContact CB-CD2 4.08Å; R192-F377 HydrophobicContact CB-CE1 4.11Å; R192-F377 HydrophobicContact CB-CE2 3.72Å; R192-F377 HydrophobicContact CB-CG 4.43Å; R192-F377 HydrophobicContact CB-CZ 3.73Å; R192-F377 VanDerWaalsContact CD-CE1 3.46Å; R192-F377 HydrophobicContact CG-CD1 3.7Å; R192-F377 HydrophobicContact CG-CD2 4.14Å; R192-F377 HydrophobicContact CG-CE1 3.55Å; R192-F377 HydrophobicContact CG-CE2 4.02Å; R192-F377 HydrophobicContact CG-CG 3.98Å; R192-F377 HydrophobicContact CG-CZ 3.72Å; A195-F377 HydrophobicContact CB-CB 3.98Å; A195-F377 HydrophobicContact CB-CD2 4.18Å; A195-F377 HydrophobicContact CB-CG 4.49Å; G273-F377 VanDerWaalsContact O-CA 3.29Å; G273-F377 WeakPolarHBondContact O-CA 3.38Å; F296-F377 HydrophobicContact CD2-CE1 4.29Å; F296-F377 AromaticContact CE2-CE1 3.64Å; F296-F377 HydrophobicContact CE2-CE1 3.64Å; F296-F377 AromaticContact CE2-CZ 3.8Å; F296-F377 HydrophobicContact CE2-CZ 3.8Å; F296-F377 HydrophobicContact CZ-CZ 4.46Å; Q298-F377 PolarHBondContact N-O 2.69Å
378	N	98.4	Very high	96.8	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	168.8	175	68.7	19.4	0	0	0	112	F272 G273 L294 F296 Q298 N374 G376	F272-N378 CarbonylContact C-O 3.6Å; F272-N378 VanDerWaalsContact CA-O 3.31Å; F272-N378 WeakPolarHBondContact CA-O 3.44Å; G273-N378 WeakPolarHBondContact CA-OD1 3.44Å; G273-N378 PolarHBondContact N-O 2.89Å; G273-N378 PolarHBondContact N-OD1 2.76Å; G273-N378 VanDerWaalsContact N-OD1 3.14Å; G273-N378 PolarHBondContact O-N 3.04Å; L294-N378 HydrophobicContact CD1-CB 4.03Å; F296-N378 WeakPolarHBondContact O-CA 3.42Å; F296-N378 WeakPolarHBondContact O-CB 3.09Å; Q298-N378 VanDerWaalsContact O-CB 3.22Å; Q298-N378 WeakPolarHBondContact O-CB 3.46Å; Q298-N378 PolarHBondContact O-ND2 2.97Å; N374-N378 PolarHBondContact OD1-ND2 3.26Å; N374-N378 PolarHBondContact OD1-OD1 3.33Å; G376-N378 PolarHBondContact O-N 2.59Å
379	C	98.3	Very high	96.7	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135	165.2	-175.2	0	0	0	0	110.4	Y271 F272 L294 H295 F296	Y271-C379 WeakPolarHBondContact O-CA 3.42Å; F272-C379 HydrophobicContact CD1-CB 3.82Å; F272-C379 HydrophobicContact CE1-CB 3.66Å; F272-C379 WeakPolarHBondContact CE1-SG 3.08Å; F272-C379 HydrophobicContact CZ-CB 4.39Å; F272-C379 WeakPolarHBondContact CZ-SG 3.37Å; L294-C379 WeakPolarHBondContact CD1-O 3.47Å; H295-C379 PolarHBondContact N-O 3.08Å; F296-C379 HydrophobicContact CD1-CB 4.2Å; F296-C379 HydrophobicContact CD2-CB 4.49Å; F296-C379 HydrophobicContact CE1-CB 3.41Å; F296-C379 VanDerWaalsContact CE1-CB 3.41Å; F296-C379 HydrophobicContact CE2-CB 3.76Å; F296-C379 HydrophobicContact CZ-CB 3.14Å; F296-C379 PolarHBondContact O-N 3.3Å; F296-C379 VanDerWaalsContact O-N 3.08Å
380	A	98.2	Very high	96.6	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149	170.1	0	0	0	0	0	111.3	L270 Y271 Y293 L294	L270-A380 CarbonylContact C-O 3.58Å; L270-A380 WeakPolarHBondContact CA-O 3.12Å; Y271-A380 PolarHBondContact N-O 3.45Å; Y271-A380 PolarHBondContact O-N 2.94Å; Y293-A380 CarbonylContact O-C 3.5Å; Y293-A380 WeakPolarHBondContact O-CA 3.24Å; Y293-A380 VanDerWaalsContact O-CB 3.32Å; Y293-A380 WeakPolarHBondContact O-CB 3.35Å; L294-A380 HydrophobicContact CD1-CB 3.79Å
381	E	97.4	Very high	96.3	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.8	172	-171.9	172.6	142.2	0	0	109.5	S233 I234 I244 P268 Y269 L270 N292 Y293 H295	S233-E381 VanDerWaalsContact CA-OE2 3.27Å; S233-E381 WeakPolarHBondContact CA-OE2 3.48Å; S233-E381 VanDerWaalsContact CB-OE1 3.27Å; S233-E381 WeakPolarHBondContact CB-OE1 3.42Å; S233-E381 VanDerWaalsContact OG-CD 3.25Å; S233-E381 PolarHBondContact OG-OE1 2.92Å; S233-E381 PolarHBondContact OG-OE2 2.92Å; S233-E381 VanDerWaalsContact OG-OE2 3.12Å; I234-E381 PolarHBondContact N-OE2 2.88Å; I244-E381 HydrophobicContact CB-CG 4.37Å; I244-E381 HydrophobicContact CD1-CB 4.2Å; I244-E381 HydrophobicContact CD1-CG 4.26Å; I244-E381 HydrophobicContact CG2-CG 4.18Å; P268-E381 HydrophobicContact CB-CG 3.98Å; P268-E381 VanDerWaalsContact CB-OE1 3.32Å; P268-E381 WeakPolarHBondContact CB-OE1 3.43Å; Y269-E381 WeakPolarHBondContact O-CA 3.23Å; L270-E381 HydrophobicContact CD2-CB 3.77Å; L270-E381 HydrophobicContact CD2-CG 3.76Å; L270-E381 WeakPolarHBondContact CD2-OE2 3.43Å; N292-E381 CarbonylContact C-O 3.55Å; N292-E381 VanDerWaalsContact CA-O 3.29Å; N292-E381 WeakPolarHBondContact CA-O 3.11Å; N292-E381 PolarHBondContact ND2-O 2.96Å; Y293-E381 PolarHBondContact N-O 2.86Å; Y293-E381 PolarHBondContact O-N 2.66Å; H295-E381 IonicContact CE1-OE2 3.28Å; H295-E381 WeakPolarHBondContact NE2-CB 3.5Å; H295-E381 IonicContact NE2-OE2 2.66Å; H295-E381 PolarHBondContact NE2-OE2 3.38Å
382	S	95.5	Very high	96.1	Very high	18 Å²	18	8 Å²	8	13%	0.126	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	156.1	176.4	26.1	0	0	0	0	113.8	Y269 Y271 I291 N292	Y269-S382 PolarHBondContact N-O 3.45Å; Y269-S382 PolarHBondContact O-N 3.38Å; Y271-S382 WeakPolarHBondContact CD2-OG 3.37Å; Y271-S382 WeakPolarHBondContact CE2-OG 3.2Å; I291-S382 WeakPolarHBondContact O-CA 3.28Å; I291-S382 WeakPolarHBondContact O-CB 3.33Å; N292-S382 WeakPolarHBondContact ND2-CB 3.46Å; N292-S382 PolarHBondContact ND2-OG 2.91Å
383	T	94.3	Very high	96	Very high	6 Å²	6	8.1 Å²	8.1	4%	0.037	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	172.3	167.8	-158.5	0	0	0	0	110.2	I244 L247 V265 T267 S290 I291	I244-T383 HydrophobicContact CG2-CG2 3.65Å; I244-T383 WeakPolarHBondContact O-CG2 3.48Å; L247-T383 HydrophobicContact CD1-CG2 3.56Å; V265-T383 PolarHBondContact O-OG1 3.02Å; T267-T383 PolarHBondContact O-OG1 3.24Å; S290-T383 WeakPolarHBondContact CA-O 3.25Å; S290-T383 WeakPolarHBondContact CB-O 3.38Å; I291-T383 HydrophobicContact CG2-CG2 4.18Å; I291-T383 PolarHBondContact N-O 2.79Å; I291-T383 VanDerWaalsContact N-O 3.11Å; I291-T383 PolarHBondContact O-N 3.44Å
384	N	94.6	Very high	95.8	Very high	12 Å²	12	8.3 Å²	8.3	6%	0.064	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	157	171.2	-62	122.9	0	0	0	112.1	L251 V265 E284 L288 Y289	L251-N384 HydrophobicContact CD2-CB 4.3Å; L251-N384 WeakPolarHBondContact CD2-O 3.26Å; V265-N384 HydrophobicContact CG1-CB 4.26Å; V265-N384 CarbonylContact O-C 3.59Å; V265-N384 WeakPolarHBondContact O-CB 3.23Å; V265-N384 PolarHBondContact O-N 3.02Å; V265-N384 VanDerWaalsContact O-O 3.08Å; E284-N384 VanDerWaalsContact CD-ND2 3.3Å; E284-N384 WeakPolarHBondContact CG-ND2 3.32Å; E284-N384 PolarHBondContact OE2-ND2 2.9Å; L288-N384 HydrophobicContact CB-CB 4.03Å; L288-N384 HydrophobicContact CD1-CB 3.7Å; L288-N384 HydrophobicContact CG-CB 4.42Å; Y289-N384 VanDerWaalsContact O-CA 3.23Å; Y289-N384 WeakPolarHBondContact O-CA 3.44Å; Y289-N384 WeakPolarHBondContact O-CB 3.29Å; Y289-N384 PolarHBondContact O-ND2 3.21Å
385	F	93.6	Very high	95.5	Very high	1 Å²	1	9.7 Å²	9.7	0%	0.004	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	167.6	173.6	70.6	-88.7	0	0	0	112.4	F121 I125 L247 T249 L288 Y289 I291 I363 T387	F121-F385 HydrophobicContact CE1-CD1 4.44Å; F121-F385 AromaticContact CE1-CD2 3.9Å; F121-F385 HydrophobicContact CE1-CD2 3.9Å; F121-F385 HydrophobicContact CE1-CE2 4.04Å; F121-F385 HydrophobicContact CE1-CG 4.11Å; F121-F385 HydrophobicContact CE1-CZ 4.37Å; F121-F385 AromaticContact CZ-CD1 3.99Å; F121-F385 HydrophobicContact CZ-CD1 3.99Å; F121-F385 AromaticContact CZ-CD2 3.98Å; F121-F385 HydrophobicContact CZ-CD2 3.98Å; F121-F385 AromaticContact CZ-CE1 3.76Å; F121-F385 HydrophobicContact CZ-CE1 3.76Å; F121-F385 AromaticContact CZ-CE2 3.76Å; F121-F385 HydrophobicContact CZ-CE2 3.76Å; F121-F385 HydrophobicContact CZ-CG 4.1Å; F121-F385 AromaticContact CZ-CZ 3.64Å; F121-F385 HydrophobicContact CZ-CZ 3.64Å; I125-F385 HydrophobicContact CD1-CE2 4.22Å; I125-F385 HydrophobicContact CD1-CZ 3.84Å; I125-F385 HydrophobicContact CG1-CE2 4.11Å; I125-F385 HydrophobicContact CG1-CZ 4.22Å; I125-F385 HydrophobicContact CG2-CE2 4.33Å; L247-F385 HydrophobicContact CD1-CB 4.14Å; L247-F385 HydrophobicContact CD1-CD1 4.45Å; T249-F385 HydrophobicContact CG2-CB 3.96Å; T249-F385 HydrophobicContact CG2-CD2 4.4Å; L288-F385 WeakPolarHBondContact CD2-O 3.27Å; Y289-F385 VanDerWaalsContact CB-CE1 3.41Å; Y289-F385 WeakPolarHBondContact CB-O 3.41Å; Y289-F385 AromaticContact CD1-CE2 3.73Å; Y289-F385 HydrophobicContact CD1-CE2 3.73Å; Y289-F385 AromaticContact CD1-CZ 3.66Å; Y289-F385 HydrophobicContact CD1-CZ 3.66Å; Y289-F385 HydrophobicContact CD2-CD2 4.23Å; Y289-F385 HydrophobicContact CD2-CE2 4.06Å; Y289-F385 WeakPolarHBondContact CD2-O 3.28Å; Y289-F385 HydrophobicContact CE1-CE2 4.43Å; Y289-F385 HydrophobicContact CG-CD2 4.03Å; Y289-F385 HydrophobicContact CG-CE1 4.23Å; Y289-F385 AromaticContact CG-CE2 3.54Å; Y289-F385 HydrophobicContact CG-CE2 3.54Å; Y289-F385 AromaticContact CG-CZ 3.66Å; Y289-F385 HydrophobicContact CG-CZ 3.66Å; Y289-F385 PolarHBondContact N-O 3.35Å; Y289-F385 PolarHBondContact O-N 2.77Å; Y289-F385 VanDerWaalsContact O-N 3.14Å; I291-F385 HydrophobicContact CB-CD1 4.25Å; I291-F385 HydrophobicContact CB-CE1 4.02Å; I291-F385 HydrophobicContact CG2-CD1 4.16Å; I291-F385 HydrophobicContact CG2-CE1 4.44Å; I363-F385 HydrophobicContact CD1-CE1 4.25Å; I363-F385 HydrophobicContact CD1-CZ 4.41Å; I363-F385 HydrophobicContact CG2-CE1 4.39Å; I363-F385 HydrophobicContact CG2-CZ 4.01Å; F385-T387 HydrophobicContact CD2-CG2 4.46Å; F385-T387 HydrophobicContact CE2-CG2 4.25Å
386	A	93.4	Very high	95.2	Very high	2 Å²	2	13 Å²	13	2%	0.017	7%	0.069	C	C	.	.			trans	-135.7	137	-174.5	0	0	0	0	0	113.6	L250 L251 L288 W390	L250-A386 HydrophobicContact CB-CB 4.08Å; L250-A386 WeakPolarHBondContact CB-O 3.33Å; L250-A386 PolarHBondContact N-O 2.84Å; L250-A386 VanDerWaalsContact N-O 3.14Å; L251-A386 HydrophobicContact CB-CB 3.98Å; L288-A386 HydrophobicContact CD2-CB 3.83Å; A386-W390 HydrophobicContact CB-CD2 4.08Å; A386-W390 HydrophobicContact CB-CE3 3.6Å; A386-W390 HydrophobicContact CB-CZ3 4.05Å
387	T	94	Very high	95	Very high	18 Å²	18	13.6 Å²	13.6	11%	0.11	7%	0.073	C	C	.	.			trans	-119.3	172	170.6	75.3	0	0	0	0	110.6	I125 Y289 F385 R389 W390 T441	I125-T387 HydrophobicContact CG2-CG2 3.98Å; Y289-T387 HydrophobicContact CD2-CG2 4.42Å; Y289-T387 HydrophobicContact CE2-CG2 3.8Å; Y289-T387 VanDerWaalsContact CE2-OG1 3.26Å; Y289-T387 WeakPolarHBondContact CE2-OG1 3.38Å; Y289-T387 VanDerWaalsContact CZ-OG1 3.27Å; Y289-T387 PolarHBondContact OH-OG1 3.23Å; F385-T387 HydrophobicContact CD2-CG2 4.46Å; F385-T387 HydrophobicContact CE2-CG2 4.25Å; T387-R389 PolarHBondContact O-N 2.94Å; T387-W390 WeakPolarHBondContact O-CB 3.22Å; T387-W390 PolarHBondContact O-N 3.18Å; T387-T441 WeakPolarHBondContact CB-OG1 3.49Å; T387-T441 HydrophobicContact CG2-CG2 4.33Å; T387-T441 PolarHBondContact OG1-OG1 2.93Å; T387-T441 VanDerWaalsContact OG1-OG1 3.05Å
388	L	92.3	Very high	94.6	Very high	28 Å²	28	15.2 Å²	15.2	15%	0.147	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37.5	-178.5	-72.4	171.5	0	0	0	112.5	L250 W390 V391 L418 E442 L448	L250-L388 HydrophobicContact CD1-CB 4.5Å; L250-L388 HydrophobicContact CD1-CD2 3.81Å; L250-L388 HydrophobicContact CD1-CG 4.04Å; L388-W390 VanDerWaalsContact C-N 3.29Å; L388-W390 PolarHBondContact O-N 3.33Å; L388-V391 PolarHBondContact O-N 3.01Å; L388-L418 HydrophobicContact CD2-CD1 4.09Å; L388-L418 HydrophobicContact CD2-CD2 4.31Å; L388-E442 HydrophobicContact CD1-CB 4.33Å; L388-L448 HydrophobicContact CD2-CD2 4.43Å
389	R	94.9	Very high	94.3	Very high	22 Å²	22	17.9 Å²	17.9	8%	0.083	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.5	176.7	-173.7	175.9	71.3	82	-2.1	113.6	E129 Y289 T387 V391 Y393 K439 T441	E129-R389 IonicContact OE1-CZ 2.7Å; E129-R389 VanDerWaalsContact OE1-CZ 3.28Å; E129-R389 IonicContact OE1-NE 3.64Å; E129-R389 PolarHBondContact OE1-NE 2.83Å; E129-R389 VanDerWaalsContact OE1-NE 3.11Å; E129-R389 IonicContact OE1-NH2 2.65Å; E129-R389 PolarHBondContact OE1-NH2 3.43Å; E129-R389 WeakPolarHBondContact OE2-CD 3.38Å; E129-R389 IonicContact OE2-CZ 2.92Å; E129-R389 IonicContact OE2-NE 3.78Å; E129-R389 PolarHBondContact OE2-NE 3.2Å; E129-R389 IonicContact OE2-NH2 3.76Å; Y289-R389 PolarHBondContact OH-NE 2.77Å; Y289-R389 PolarHBondContact OH-NH2 3.23Å; T387-R389 PolarHBondContact O-N 2.94Å; R389-V391 PolarHBondContact O-N 3.2Å; R389-Y393 HydrophobicContact CG-CE2 4.17Å; R389-Y393 PolarHBondContact NH1-OH 2.63Å; R389-Y393 WeakPolarHBondContact O-CD2 3.46Å; R389-K439 WeakPolarHBondContact CD-O 3.37Å; R389-T441 PolarHBondContact N-OG1 2.86Å
390	W	95.9	Very high	93.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.5	-24.6	-178.7	165.1	77.6	0	0	0	113.1	M286 L288 Y289 P366 A386 T387 L388 D392 Y393 G394 I409 M411 F414	M286-W390 HydrophobicContact CB-CZ2 4.06Å; M286-W390 PolarHBondContact O-NE1 3.33Å; L288-W390 HydrophobicContact CD2-CD2 3.66Å; L288-W390 HydrophobicContact CD2-CE3 4.24Å; L288-W390 HydrophobicContact CD2-CG 4.07Å; L288-W390 HydrophobicContact CD2-CH2 4.15Å; L288-W390 HydrophobicContact CD2-CZ2 3.59Å; L288-W390 HydrophobicContact CD2-CZ3 4.45Å; L288-W390 HydrophobicContact CG-CZ2 4Å; Y289-W390 HydrophobicContact CD2-CB 4.33Å; Y289-W390 HydrophobicContact CE2-CB 3.85Å; P366-W390 HydrophobicContact CG-CB 4.14Å; A386-W390 HydrophobicContact CB-CD2 4.08Å; A386-W390 HydrophobicContact CB-CE3 3.6Å; A386-W390 HydrophobicContact CB-CZ3 4.05Å; T387-W390 WeakPolarHBondContact O-CB 3.22Å; T387-W390 PolarHBondContact O-N 3.18Å; L388-W390 VanDerWaalsContact C-N 3.29Å; L388-W390 PolarHBondContact O-N 3.33Å; W390-D392 PolarHBondContact O-N 2.88Å; W390-D392 VanDerWaalsContact O-N 3.12Å; W390-Y393 CarbonylContact O-C 3.44Å; W390-Y393 WeakPolarHBondContact O-CA 3.18Å; W390-Y393 WeakPolarHBondContact O-CB 3.46Å; W390-Y393 PolarHBondContact O-N 3.19Å; W390-G394 PolarHBondContact O-N 3.33Å; W390-I409 HydrophobicContact CH2-CG2 4.37Å; W390-M411 HydrophobicContact CE3-CE 4.32Å; W390-M411 HydrophobicContact CH2-CE 3.56Å; W390-M411 HydrophobicContact CH2-SD 3.49Å; W390-M411 WeakPolarHBondContact CH2-SD 3.41Å; W390-M411 HydrophobicContact CZ2-CE 3.94Å; W390-M411 HydrophobicContact CZ2-SD 3.75Å; W390-M411 HydrophobicContact CZ3-CE 3.75Å; W390-M411 HydrophobicContact CZ3-SD 4.27Å; W390-F414 HydrophobicContact CH2-CD2 4.26Å; W390-F414 HydrophobicContact CH2-CE1 4.48Å; W390-F414 AromaticContact CH2-CE2 3.87Å; W390-F414 HydrophobicContact CH2-CE2 3.87Å; W390-F414 AromaticContact CH2-CZ 3.98Å; W390-F414 HydrophobicContact CH2-CZ 3.98Å; W390-F414 AromaticContact CZ3-CD1 3.89Å; W390-F414 HydrophobicContact CZ3-CD1 3.89Å; W390-F414 HydrophobicContact CZ3-CD2 4.05Å; W390-F414 AromaticContact CZ3-CE1 3.65Å; W390-F414 HydrophobicContact CZ3-CE1 3.65Å; W390-F414 AromaticContact CZ3-CE2 3.81Å; W390-F414 HydrophobicContact CZ3-CE2 3.81Å; W390-F414 HydrophobicContact CZ3-CG 4.07Å; W390-F414 AromaticContact CZ3-CZ 3.59Å; W390-F414 HydrophobicContact CZ3-CZ 3.59Å
391	V	93.7	Very high	93.4	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-55.3	-39.1	-174.2	179.8	0	0	0	0	112.1	L388 R389 K395 M411 F414 V415 L418 Q419	L388-V391 PolarHBondContact O-N 3.01Å; R389-V391 PolarHBondContact O-N 3.2Å; V391-K395 HydrophobicContact CG1-CD 4.24Å; V391-K395 WeakPolarHBondContact O-CD 3.31Å; V391-K395 WeakPolarHBondContact O-CG 3.37Å; V391-K395 PolarHBondContact O-N 3.03Å; V391-M411 HydrophobicContact CG1-CE 4.4Å; V391-M411 WeakPolarHBondContact O-CE 3.4Å; V391-F414 HydrophobicContact CG1-CB 3.99Å; V391-F414 HydrophobicContact CG2-CB 4.25Å; V391-F414 HydrophobicContact CG2-CD1 4.39Å; V391-V415 HydrophobicContact CG1-CG2 4.37Å; V391-L418 HydrophobicContact CG2-CD1 3.86Å; V391-Q419 HydrophobicContact CG1-CG 4.27Å
392	D	94.5	Very high	93	Very high	28 Å²	28	25.2 Å²	25.2	15%	0.15	15%	0.15	C	C	.	.	H	α-helix	trans	-74.7	-30.2	174.8	-82.4	-53.7	0	0	0	114.2	W390 K395 N396 Q419 R422 L435	W390-D392 PolarHBondContact O-N 2.88Å; W390-D392 VanDerWaalsContact O-N 3.12Å; D392-K395 IonicContact OD1-NZ 2.71Å; D392-K395 PolarHBondContact OD1-NZ 3.09Å; D392-N396 PolarHBondContact O-N 3.11Å; D392-Q419 PolarHBondContact OD2-NE2 3.08Å; D392-R422 IonicContact OD1-CZ 3.77Å; D392-R422 IonicContact OD1-NH1 3.09Å; D392-R422 PolarHBondContact OD1-NH1 2.93Å; D392-R422 IonicContact OD1-NH2 3.45Å; D392-R422 PolarHBondContact OD1-NH2 2.86Å; D392-R422 IonicContact OD2-CZ 3.89Å; D392-R422 IonicContact OD2-NH1 2.68Å; D392-R422 PolarHBondContact OD2-NH1 2.95Å; D392-R422 IonicContact OD2-NH2 2.68Å; D392-L435 HydrophobicContact CB-CD2 3.89Å; D392-L435 WeakPolarHBondContact O-CD2 3.36Å
393	Y	95.7	Very high	92.4	Very high	6 Å²	6	28.2 Å²	28.2	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-67.8	-49	173.5	-72.8	-112.6	0	0	0	110.7	P366 R389 W390 K395 N396 A397 L435 D436 H437	P366-Y393 HydrophobicContact CB-CD1 3.39Å; P366-Y393 HydrophobicContact CB-CD2 4.26Å; P366-Y393 HydrophobicContact CB-CE1 3.9Å; P366-Y393 HydrophobicContact CB-CG 3.62Å; P366-Y393 WeakPolarHBondContact O-CE1 3.18Å; R389-Y393 HydrophobicContact CG-CE2 4.17Å; R389-Y393 PolarHBondContact NH1-OH 2.63Å; R389-Y393 WeakPolarHBondContact O-CD2 3.46Å; W390-Y393 CarbonylContact O-C 3.44Å; W390-Y393 WeakPolarHBondContact O-CA 3.18Å; W390-Y393 WeakPolarHBondContact O-CB 3.46Å; W390-Y393 PolarHBondContact O-N 3.19Å; Y393-K395 PolarHBondContact O-N 2.99Å; Y393-N396 CarbonylContact O-C 3.54Å; Y393-N396 PolarHBondContact O-N 3.11Å; Y393-A397 PolarHBondContact O-N 3.24Å; Y393-L435 HydrophobicContact CD1-CD1 4.02Å; Y393-L435 HydrophobicContact CD2-CD2 3.99Å; Y393-L435 HydrophobicContact CE1-CD1 4.16Å; Y393-L435 HydrophobicContact CE2-CD2 4.13Å; Y393-L435 HydrophobicContact CG-CD1 4.23Å; Y393-L435 HydrophobicContact CG-CD2 4.35Å; Y393-D436 PolarHBondContact OH-O 2.87Å; Y393-H437 AromaticContact CE1-CE1 3.93Å; Y393-H437 AromaticContact CE1-ND1 3.71Å; Y393-H437 AromaticContact CZ-ND1 3.66Å; Y393-H437 WeakPolarHBondContact OH-CA 3.49Å; Y393-H437 PolarHBondContact OH-ND1 3.41Å
394	G	93.8	Very high	91.2	Very high	4 Å²	4	38 Å²	38	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-62.7	-25.9	178	0	0	0	0	0	114.4	M286 W390 M411	M286-G394 WeakPolarHBondContact CE-O 3.49Å; M286-G394 WeakPolarHBondContact O-CA 3.39Å; W390-G394 PolarHBondContact O-N 3.33Å; G394-M411 WeakPolarHBondContact O-CG 3.48Å
395	K	93.2	Very high	90.2	Very high	29 Å²	29	43 Å²	43	13%	0.126	23%	0.228	C	C	.	.	H	α-helix	trans	-72.4	-32.8	171.7	-71.2	157.9	69.7	-171.3	0	112.9	V391 D392 Y393 M411 V415 D431	V391-K395 HydrophobicContact CG1-CD 4.24Å; V391-K395 WeakPolarHBondContact O-CD 3.31Å; V391-K395 WeakPolarHBondContact O-CG 3.37Å; V391-K395 PolarHBondContact O-N 3.03Å; D392-K395 IonicContact OD1-NZ 2.71Å; D392-K395 PolarHBondContact OD1-NZ 3.09Å; Y393-K395 PolarHBondContact O-N 2.99Å; K395-M411 HydrophobicContact CG-CB 4.18Å; K395-M411 HydrophobicContact CG-CE 4.31Å; K395-M411 HydrophobicContact CG-CG 4.33Å; K395-V415 HydrophobicContact CD-CG2 3.53Å; K395-V415 HydrophobicContact CG-CG2 3.85Å; K395-D431 WeakPolarHBondContact CE-OD2 3.49Å; K395-D431 IonicContact NZ-OD2 3.38Å; K395-D431 PolarHBondContact NZ-OD2 3.3Å
396	N	91.5	Very high	89.4	Confident	71 Å²	71	44.6 Å²	44.6	38%	0.38	24%	0.235	S	C	.	.	H	α-helix	trans	-100.6	-3	-175.2	-67.3	0.6	0	0	0	112.9	D392 Y393 T398 T433 L435	D392-N396 PolarHBondContact O-N 3.11Å; Y393-N396 CarbonylContact O-C 3.54Å; Y393-N396 PolarHBondContact O-N 3.11Å; N396-T398 PolarHBondContact O-N 3.13Å; N396-T433 PolarHBondContact ND2-O 3.06Å; N396-L435 HydrophobicContact CB-CD1 4.26Å
397	A	92.9	Very high	88.8	Confident	15 Å²	15	46.1 Å²	46.1	12%	0.124	24%	0.244	C	C	.	.			trans	-58.6	119.9	-175.6	0	0	0	0	0	112.5	D287 Y393 L399	D287-A397 HydrophobicContact CB-CB 4.24Å; D287-A397 VanDerWaalsContact OD2-CA 3.26Å; D287-A397 WeakPolarHBondContact OD2-CA 3.21Å; D287-A397 VanDerWaalsContact OD2-CB 3.29Å; D287-A397 WeakPolarHBondContact OD2-CB 3.41Å; Y393-A397 PolarHBondContact O-N 3.24Å; A397-L399 HydrophobicContact CB-CD2 4.16Å; A397-L399 PolarHBondContact O-N 2.88Å
398	T	91.1	Very high	88.2	Confident	59 Å²	59	51 Å²	51	36%	0.362	26%	0.264	S	S	.	.			trans	-80.9	105.4	-178.8	-46.9	0	0	0	0	109.7	A330 R333 N396	A330-T398 HydrophobicContact CB-CG2 4.3Å; A330-T398 WeakPolarHBondContact CB-O 3.37Å; R333-T398 PolarHBondContact NE-O 2.61Å; R333-T398 PolarHBondContact NH2-O 2.85Å; N396-T398 PolarHBondContact O-N 3.13Å
399	L	90.7	Very high	87.8	Confident	55 Å²	55	50.2 Å²	50.2	29%	0.288	26%	0.26	S	S	.	.			trans	-89.3	156	-171.7	-53.4	-176.9	0	0	0	113.5	M286 A397 K408	M286-L399 HydrophobicContact SD-CD1 3.89Å; M286-L399 HydrophobicContact SD-CD2 3.64Å; M286-L399 HydrophobicContact SD-CG 4.4Å; A397-L399 HydrophobicContact CB-CD2 4.16Å; A397-L399 PolarHBondContact O-N 2.88Å; L399-K408 HydrophobicContact CD1-CD 4.34Å; L399-K408 HydrophobicContact CD1-CG 4.17Å
400	C	91.4	Very high	87.3	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.014	27%	0.273	C	S	.	.			trans	-67.6	133.9	171.5	171.9	0	0	0	0	111.5	R333 H334 M406	R333-C400 HydrophobicContact CB-CB 4.46Å; H334-C400 PolarHBondContact NE2-SG 3.26Å; C400-M406 HydrophobicContact CB-CG 3.83Å; C400-M406 HydrophobicContact CB-SD 3.68Å
401	S	87.1	Confident	87	Confident	80 Å²	80	52.1 Å²	52.1	56%	0.559	28%	0.276	S	S	*	.	S	Bend	trans	-102.8	-23.3	-178.3	54.2	0	0	0	0	113.8
402	C	89.4	Confident	86.7	Confident	72 Å²	72	52.8 Å²	52.8	49%	0.486	28%	0.279	S	S	.	.	S	Bend	trans	-90.8	-10.1	-174	79.6	0	0	0	0	115	G327 C328 H334	G327-C402 WeakPolarHBondContact O-CB 3.44Å; C328-C402 HydrophobicContact CB-CB 4.17Å; H334-C402 VanDerWaalsContact CE1-SG 3.55Å; H334-C402 PolarHBondContact NE2-SG 2.82Å; H334-C402 VanDerWaalsContact NE2-SG 3.36Å
403	R	81.9	Confident	86.3	Confident	82 Å²	82	51.9 Å²	51.9	31%	0.309	27%	0.274	S	S	.	.			trans	-115	146	177.7	-73.3	-169.5	-167.3	-177.6	4.9	110.9	M336 D405 M406	M336-R403 PolarHBondContact SD-NH2 3.38Å; R403-D405 WeakPolarHBondContact CB-OD1 3.49Å; R403-M406 HydrophobicContact CB-CG 3.49Å; R403-M406 VanDerWaalsContact CB-CG 3.49Å; R403-M406 HydrophobicContact CB-SD 3.91Å
404	K	70.2	Confident	86	Confident	211 Å²	211	51.6 Å²	51.6	92%	0.917	27%	0.273	S	S	*	.	S	Bend	trans	-100.4	-19.1	-177.7	-68.4	-172.4	177.5	-175.5	0	113.1	M406	K404-M406 VanDerWaalsContact C-N 3.3Å
405	D	72.6	Confident	85.8	Confident	118 Å²	118	51.4 Å²	51.4	63%	0.631	27%	0.271	S	S	*	.	S	Bend	trans	-83.4	6.5	179.7	46	-63.2	0	0	0	113.6	R403	R403-D405 WeakPolarHBondContact CB-OD1 3.49Å
406	M	77.1	Confident	85.6	Confident	34 Å²	34	54.6 Å²	54.6	17%	0.167	28%	0.282	C	S	.	.			trans	-84.9	138.1	-178.2	-53.7	-85.2	66.7	0	0	111.6	C400 R403 K404	C400-M406 HydrophobicContact CB-CG 3.83Å; C400-M406 HydrophobicContact CB-SD 3.68Å; R403-M406 HydrophobicContact CB-CG 3.49Å; R403-M406 VanDerWaalsContact CB-CG 3.49Å; R403-M406 HydrophobicContact CB-SD 3.91Å; K404-M406 VanDerWaalsContact C-N 3.3Å
407	V	80.4	Confident	85.2	Confident	33 Å²	33	52.3 Å²	52.3	20%	0.2	27%	0.272	C	S	.	.			trans	-56	135.2	174.9	173.3	0	0	0	0	110.8	I262 V265 D285 I409	I262-V407 HydrophobicContact CG2-CG1 4.23Å; I262-V407 HydrophobicContact CG2-CG2 4.42Å; V265-V407 HydrophobicContact CG2-CG1 4.02Å; V265-V407 HydrophobicContact CG2-CG2 3.91Å; D285-V407 HydrophobicContact CB-CB 3.81Å; D285-V407 HydrophobicContact CB-CG1 3.94Å; D285-V407 HydrophobicContact CB-CG2 4.32Å; V407-I409 HydrophobicContact CG1-CG1 4.4Å
408	K	81.4	Confident	85	Confident	120 Å²	120	52.2 Å²	52.2	52%	0.522	27%	0.269	S	S	.	.			trans	-143.1	111.4	175.2	-60.6	-170.5	-178.5	-175.9	0	110.5	L399	L399-K408 HydrophobicContact CD1-CD 4.34Å; L399-K408 HydrophobicContact CD1-CG 4.17Å
409	I	84.3	Confident	85.1	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.062	26%	0.258	C	S	.	.			trans	-93.5	140	176.9	-57.8	170.7	0	0	0	109.4	L251 V254 I262 V265 M286 L288 W390 V407 M411 F414	L251-I409 HydrophobicContact CD1-CD1 3.92Å; V254-I409 HydrophobicContact CG2-CG2 3.94Å; I262-I409 HydrophobicContact CD1-CG1 3.91Å; V265-I409 HydrophobicContact CG1-CD1 4.06Å; M286-I409 HydrophobicContact CB-CD1 4.21Å; M286-I409 HydrophobicContact CE-CB 4.43Å; M286-I409 HydrophobicContact CG-CB 3.84Å; M286-I409 HydrophobicContact CG-CD1 3.89Å; M286-I409 HydrophobicContact CG-CG1 3.78Å; M286-I409 HydrophobicContact SD-CB 4.43Å; M286-I409 PolarHBondContact SD-N 3.11Å; M286-I409 VanDerWaalsContact SD-N 3.43Å; L288-I409 HydrophobicContact CD1-CD1 3.69Å; W390-I409 HydrophobicContact CH2-CG2 4.37Å; V407-I409 HydrophobicContact CG1-CG1 4.4Å; I409-M411 PolarHBondContact O-N 2.87Å; I409-F414 HydrophobicContact CG2-CE2 3.81Å
410	S	84.9	Confident	85.1	Confident	52 Å²	52	51.2 Å²	51.2	36%	0.364	27%	0.265	S	S	.	.			trans	-88	93.6	-178.1	-153.4	0	0	0	0	111.6	D412 V413 R634	S410-D412 PolarHBondContact O-N 2.94Å; S410-V413 PolarHBondContact O-N 2.96Å; S410-R634 PolarHBondContact OG-NE 3.04Å; S410-R634 PolarHBondContact OG-NH2 2.89Å
411	M	89.8	Confident	85.1	Confident	11 Å²	11	56.1 Å²	56.1	5%	0.054	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-20.6	-179	-58.5	-49.9	-63.7	0	0	114.9	M286 W390 V391 G394 K395 I409 V413 F414 V415 W426	M286-M411 HydrophobicContact CE-CG 4.11Å; M286-M411 HydrophobicContact CE-SD 3.97Å; W390-M411 HydrophobicContact CE3-CE 4.32Å; W390-M411 HydrophobicContact CH2-CE 3.56Å; W390-M411 HydrophobicContact CH2-SD 3.49Å; W390-M411 WeakPolarHBondContact CH2-SD 3.41Å; W390-M411 HydrophobicContact CZ2-CE 3.94Å; W390-M411 HydrophobicContact CZ2-SD 3.75Å; W390-M411 HydrophobicContact CZ3-CE 3.75Å; W390-M411 HydrophobicContact CZ3-SD 4.27Å; V391-M411 HydrophobicContact CG1-CE 4.4Å; V391-M411 WeakPolarHBondContact O-CE 3.4Å; G394-M411 WeakPolarHBondContact O-CG 3.48Å; K395-M411 HydrophobicContact CG-CB 4.18Å; K395-M411 HydrophobicContact CG-CE 4.31Å; K395-M411 HydrophobicContact CG-CG 4.33Å; I409-M411 PolarHBondContact O-N 2.87Å; M411-V413 PolarHBondContact O-N 2.85Å; M411-V413 VanDerWaalsContact O-N 3.13Å; M411-F414 HydrophobicContact CE-CB 4.35Å; M411-F414 HydrophobicContact CE-CD2 4.3Å; M411-F414 HydrophobicContact CE-CG 4.45Å; M411-F414 WeakPolarHBondContact O-CB 3.22Å; M411-F414 PolarHBondContact O-N 2.77Å; M411-F414 HydrophobicContact SD-CD2 4.41Å; M411-V415 HydrophobicContact CB-CG2 4.41Å; M411-V415 WeakPolarHBondContact O-CG2 3.25Å; M411-V415 PolarHBondContact O-N 2.95Å; M411-W426 HydrophobicContact CB-CH2 4.17Å; M411-W426 HydrophobicContact CB-CZ2 3.87Å
412	D	87.9	Confident	85.3	Confident	14 Å²	14	54.8 Å²	54.8	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-53.8	-29.6	179.5	166.4	-96.7	0	0	0	114.9	S410 R416 Y423 W426 K427 R634	S410-D412 PolarHBondContact O-N 2.94Å; D412-R416 WeakPolarHBondContact O-CB 3.18Å; D412-R416 PolarHBondContact O-N 2.9Å; D412-R416 VanDerWaalsContact O-N 3.13Å; D412-R416 PolarHBondContact O-NH1 3.05Å; D412-R416 IonicContact OD1-NH1 3.11Å; D412-R416 PolarHBondContact OD1-NH1 2.65Å; D412-R416 VanDerWaalsContact OD1-NH1 3.08Å; D412-Y423 PolarHBondContact OD2-OH 2.93Å; D412-W426 HydrophobicContact CB-CH2 3.93Å; D412-W426 HydrophobicContact CB-CZ3 3.92Å; D412-K427 WeakPolarHBondContact OD2-CE 3.34Å; D412-R634 VanDerWaalsContact CB-NH2 3.3Å; D412-R634 VanDerWaalsContact CG-NH2 3.31Å; D412-R634 IonicContact OD1-CZ 3.59Å; D412-R634 VanDerWaalsContact OD1-CZ 3.24Å; D412-R634 IonicContact OD1-NH1 2.93Å; D412-R634 PolarHBondContact OD1-NH1 2.99Å; D412-R634 IonicContact OD1-NH2 3.61Å; D412-R634 PolarHBondContact OD1-NH2 3.08Å; D412-R634 IonicContact OD2-NH1 2.69Å
413	V	84.8	Confident	85.5	Confident	9 Å²	9	52.9 Å²	52.9	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-72.9	-50.9	172.6	-179.8	0	0	0	0	110.5	E257 S410 M411 V415 R416 C417	E257-V413 HydrophobicContact CB-CG1 4.26Å; E257-V413 HydrophobicContact CG-CG1 4.39Å; S410-V413 PolarHBondContact O-N 2.96Å; M411-V413 PolarHBondContact O-N 2.85Å; M411-V413 VanDerWaalsContact O-N 3.13Å; V413-V415 PolarHBondContact O-N 2.74Å; V413-R416 PolarHBondContact O-N 3Å; V413-C417 VanDerWaalsContact O-CB 3.32Å; V413-C417 WeakPolarHBondContact O-CB 3.47Å; V413-C417 PolarHBondContact O-N 3.26Å; V413-C417 PolarHBondContact O-SG 2.83Å; V413-C417 VanDerWaalsContact O-SG 3.38Å
414	F	89.2	Confident	86	Confident	1 Å²	1	53.8 Å²	53.8	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-57.8	-46.6	177.5	-62.4	-85.9	0	0	0	112.2	L250 M253 V254 W390 V391 I409 M411 C417 L418	L250-F414 HydrophobicContact CB-CE1 4.27Å; L250-F414 WeakPolarHBondContact O-CE1 3.34Å; M253-F414 HydrophobicContact CE-CD1 3.45Å; M253-F414 VanDerWaalsContact CE-CD1 3.45Å; M253-F414 HydrophobicContact CE-CE1 3.66Å; M253-F414 HydrophobicContact CE-CG 4.36Å; V254-F414 HydrophobicContact CG2-CE2 3.56Å; V254-F414 HydrophobicContact CG2-CZ 3.46Å; V254-F414 VanDerWaalsContact CG2-CZ 3.46Å; W390-F414 HydrophobicContact CH2-CD2 4.26Å; W390-F414 HydrophobicContact CH2-CE1 4.48Å; W390-F414 AromaticContact CH2-CE2 3.87Å; W390-F414 HydrophobicContact CH2-CE2 3.87Å; W390-F414 AromaticContact CH2-CZ 3.98Å; W390-F414 HydrophobicContact CH2-CZ 3.98Å; W390-F414 AromaticContact CZ3-CD1 3.89Å; W390-F414 HydrophobicContact CZ3-CD1 3.89Å; W390-F414 HydrophobicContact CZ3-CD2 4.05Å; W390-F414 AromaticContact CZ3-CE1 3.65Å; W390-F414 HydrophobicContact CZ3-CE1 3.65Å; W390-F414 AromaticContact CZ3-CE2 3.81Å; W390-F414 HydrophobicContact CZ3-CE2 3.81Å; W390-F414 HydrophobicContact CZ3-CG 4.07Å; W390-F414 AromaticContact CZ3-CZ 3.59Å; W390-F414 HydrophobicContact CZ3-CZ 3.59Å; V391-F414 HydrophobicContact CG1-CB 3.99Å; V391-F414 HydrophobicContact CG2-CB 4.25Å; V391-F414 HydrophobicContact CG2-CD1 4.39Å; I409-F414 HydrophobicContact CG2-CE2 3.81Å; M411-F414 HydrophobicContact CE-CB 4.35Å; M411-F414 HydrophobicContact CE-CD2 4.3Å; M411-F414 HydrophobicContact CE-CG 4.45Å; M411-F414 WeakPolarHBondContact O-CB 3.22Å; M411-F414 PolarHBondContact O-N 2.77Å; M411-F414 HydrophobicContact SD-CD2 4.41Å; F414-C417 PolarHBondContact O-N 3.04Å; F414-L418 HydrophobicContact CB-CD1 4.44Å; F414-L418 HydrophobicContact CD1-CD1 4.08Å; F414-L418 WeakPolarHBondContact O-CA 3.4Å; F414-L418 WeakPolarHBondContact O-CB 3.3Å; F414-L418 WeakPolarHBondContact O-CG 3.14Å; F414-L418 PolarHBondContact O-N 3.18Å
415	V	90.6	Very high	87	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.2	-39.2	180	-172	0	0	0	0	111.4	V391 K395 M411 V413 Q419 Y423 W426	V391-V415 HydrophobicContact CG1-CG2 4.37Å; K395-V415 HydrophobicContact CD-CG2 3.53Å; K395-V415 HydrophobicContact CG-CG2 3.85Å; M411-V415 HydrophobicContact CB-CG2 4.41Å; M411-V415 WeakPolarHBondContact O-CG2 3.25Å; M411-V415 PolarHBondContact O-N 2.95Å; V413-V415 PolarHBondContact O-N 2.74Å; V415-Q419 HydrophobicContact CG1-CB 4.09Å; V415-Q419 CarbonylContact O-C 3.59Å; V415-Q419 VanDerWaalsContact O-CA 3.31Å; V415-Q419 WeakPolarHBondContact O-CA 3.43Å; V415-Q419 PolarHBondContact O-N 3.39Å; V415-Y423 HydrophobicContact CB-CD2 4.2Å; V415-Y423 HydrophobicContact CG1-CD2 4.06Å; V415-W426 HydrophobicContact CB-CD2 4.26Å; V415-W426 HydrophobicContact CB-CE3 3.98Å; V415-W426 HydrophobicContact CB-CZ3 4.32Å; V415-W426 HydrophobicContact CG1-CB 4.14Å; V415-W426 HydrophobicContact CG1-CD2 4.05Å; V415-W426 HydrophobicContact CG1-CE3 3.93Å; V415-W426 HydrophobicContact CG1-CG 4.15Å; V415-W426 HydrophobicContact CG2-CD2 4Å; V415-W426 HydrophobicContact CG2-CE3 4.14Å; V415-W426 HydrophobicContact CG2-CG 4.48Å; V415-W426 HydrophobicContact CG2-CZ2 4.44Å; V415-W426 HydrophobicContact CG2-CZ3 4.43Å
416	R	88	Confident	88	Confident	95 Å²	95	45.4 Å²	45.4	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-44.8	175.5	-176.7	175	59.9	-108.8	5.9	112.2	D412 V413 Y423	D412-R416 WeakPolarHBondContact O-CB 3.18Å; D412-R416 PolarHBondContact O-N 2.9Å; D412-R416 VanDerWaalsContact O-N 3.13Å; D412-R416 PolarHBondContact O-NH1 3.05Å; D412-R416 IonicContact OD1-NH1 3.11Å; D412-R416 PolarHBondContact OD1-NH1 2.65Å; D412-R416 VanDerWaalsContact OD1-NH1 3.08Å; V413-R416 PolarHBondContact O-N 3Å; R416-Y423 HydrophobicContact CB-CD2 3.92Å; R416-Y423 HydrophobicContact CB-CE1 4.29Å; R416-Y423 HydrophobicContact CB-CE2 3.54Å; R416-Y423 HydrophobicContact CB-CG 4.42Å; R416-Y423 HydrophobicContact CG-CE1 4.08Å; R416-Y423 HydrophobicContact CG-CE2 4.22Å
417	C	84.6	Confident	88.6	Confident	24 Å²	24	48.4 Å²	48.4	16%	0.162	25%	0.245	C	C	.	.	H	α-helix	trans	-91.6	-23.7	-169.1	-62.7	0	0	0	0	113.7	V413 F414 E447	V413-C417 VanDerWaalsContact O-CB 3.32Å; V413-C417 WeakPolarHBondContact O-CB 3.47Å; V413-C417 PolarHBondContact O-N 3.26Å; V413-C417 PolarHBondContact O-SG 2.83Å; V413-C417 VanDerWaalsContact O-SG 3.38Å; F414-C417 PolarHBondContact O-N 3.04Å; C417-E447 WeakPolarHBondContact O-CB 3.3Å
418	L	88.4	Confident	89.2	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-120.8	-13.4	-175.3	-49.1	173.9	0	0	0	113.7	L250 M253 L388 V391 F414 P420 L448	L250-L418 HydrophobicContact CD1-CD1 3.95Å; M253-L418 HydrophobicContact CE-CD1 3.68Å; M253-L418 HydrophobicContact CE-CD2 4.36Å; M253-L418 HydrophobicContact CE-CG 4.12Å; L388-L418 HydrophobicContact CD2-CD1 4.09Å; L388-L418 HydrophobicContact CD2-CD2 4.31Å; V391-L418 HydrophobicContact CG2-CD1 3.86Å; F414-L418 HydrophobicContact CB-CD1 4.44Å; F414-L418 HydrophobicContact CD1-CD1 4.08Å; F414-L418 WeakPolarHBondContact O-CA 3.4Å; F414-L418 WeakPolarHBondContact O-CB 3.3Å; F414-L418 WeakPolarHBondContact O-CG 3.14Å; F414-L418 PolarHBondContact O-N 3.18Å; L418-P420 VanDerWaalsContact C-CD 3.5Å; L418-L448 HydrophobicContact CD2-CB 3.85Å; L418-L448 HydrophobicContact CD2-CD1 3.79Å; L418-L448 HydrophobicContact CD2-CG 4.41Å
419	Q	91.6	Very high	89.5	Confident	25 Å²	25	48 Å²	48	12%	0.117	26%	0.259	C	S	.	.			trans	-137.3	47	177.6	-58.8	-172.4	-22	0	0	112.2	V391 D392 V415 S421 R422 Y423	V391-Q419 HydrophobicContact CG1-CG 4.27Å; D392-Q419 PolarHBondContact OD2-NE2 3.08Å; V415-Q419 HydrophobicContact CG1-CB 4.09Å; V415-Q419 CarbonylContact O-C 3.59Å; V415-Q419 VanDerWaalsContact O-CA 3.31Å; V415-Q419 WeakPolarHBondContact O-CA 3.43Å; V415-Q419 PolarHBondContact O-N 3.39Å; Q419-S421 VanDerWaalsContact C-N 3.26Å; Q419-S421 PolarHBondContact O-N 3.49Å; Q419-S421 VanDerWaalsContact O-N 3.16Å; Q419-R422 HydrophobicContact CB-CB 4.42Å; Q419-R422 PolarHBondContact O-N 3.3Å; Q419-Y423 PolarHBondContact O-N 3.19Å
420	P	91	Very high	89.8	Confident	68 Å²	68	53.2 Å²	53.2	44%	0.442	28%	0.282	S	S	.	.	H	α-helix	trans	-58.7	-34.6	-169.6	24.3	-34.7	0	0	0	113.4	L418 R422 Y423 E447	L418-P420 VanDerWaalsContact C-CD 3.5Å; P420-R422 PolarHBondContact O-N 2.93Å; P420-Y423 WeakPolarHBondContact O-CB 3.35Å; P420-Y423 PolarHBondContact O-N 3.07Å; P420-E447 HydrophobicContact CG-CG 3.99Å
421	S	92.4	Very high	90	Very high	105 Å²	105	52.1 Å²	52.1	73%	0.734	27%	0.272	S	S	*	.	H	α-helix	trans	-63.5	-26.1	175.6	54.4	0	0	0	0	113.9	Q419	Q419-S421 VanDerWaalsContact C-N 3.26Å; Q419-S421 PolarHBondContact O-N 3.49Å; Q419-S421 VanDerWaalsContact O-N 3.16Å
422	R	91.8	Very high	89.8	Confident	53 Å²	53	58.8 Å²	58.8	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-100.3	-15.3	178.9	-68.2	169.2	61.4	-161	-3.5	113	D392 Q419 P420 E424 L425 W426 D431 T433	D392-R422 IonicContact OD1-CZ 3.77Å; D392-R422 IonicContact OD1-NH1 3.09Å; D392-R422 PolarHBondContact OD1-NH1 2.93Å; D392-R422 IonicContact OD1-NH2 3.45Å; D392-R422 PolarHBondContact OD1-NH2 2.86Å; D392-R422 IonicContact OD2-CZ 3.89Å; D392-R422 IonicContact OD2-NH1 2.68Å; D392-R422 PolarHBondContact OD2-NH1 2.95Å; D392-R422 IonicContact OD2-NH2 2.68Å; Q419-R422 HydrophobicContact CB-CB 4.42Å; Q419-R422 PolarHBondContact O-N 3.3Å; P420-R422 PolarHBondContact O-N 2.93Å; R422-E424 PolarHBondContact O-N 2.81Å; R422-L425 PolarHBondContact O-N 3.08Å; R422-L425 VanDerWaalsContact O-N 3.12Å; R422-W426 WeakPolarHBondContact O-CB 3.45Å; R422-W426 PolarHBondContact O-N 2.67Å; R422-D431 IonicContact CZ-OD1 3.63Å; R422-D431 IonicContact CZ-OD2 2.83Å; R422-D431 IonicContact NE-OD1 3.96Å; R422-D431 PolarHBondContact NE-OD1 2.82Å; R422-D431 IonicContact NE-OD2 2.99Å; R422-D431 PolarHBondContact NE-OD2 2.93Å; R422-D431 VanDerWaalsContact NH2-CG 3.3Å; R422-D431 IonicContact NH2-OD1 2.71Å; R422-D431 PolarHBondContact NH2-OD1 3.23Å; R422-D431 IonicContact NH2-OD2 3.43Å; R422-D431 PolarHBondContact NH2-OD2 3.18Å; R422-T433 PolarHBondContact NH2-OG1 2.6Å
423	Y	92.2	Very high	89.8	Confident	31 Å²	31	60.7 Å²	60.7	12%	0.122	32%	0.319	C	S	.	.	H	α-helix	trans	-54.6	-44.9	-172.1	175.3	-118.7	0	0	0	114.8	D412 V415 R416 Q419 P420 W426 K427	D412-Y423 PolarHBondContact OD2-OH 2.93Å; V415-Y423 HydrophobicContact CB-CD2 4.2Å; V415-Y423 HydrophobicContact CG1-CD2 4.06Å; R416-Y423 HydrophobicContact CB-CD2 3.92Å; R416-Y423 HydrophobicContact CB-CE1 4.29Å; R416-Y423 HydrophobicContact CB-CE2 3.54Å; R416-Y423 HydrophobicContact CB-CG 4.42Å; R416-Y423 HydrophobicContact CG-CE1 4.08Å; R416-Y423 HydrophobicContact CG-CE2 4.22Å; Q419-Y423 PolarHBondContact O-N 3.19Å; P420-Y423 WeakPolarHBondContact O-CB 3.35Å; P420-Y423 PolarHBondContact O-N 3.07Å; Y423-W426 HydrophobicContact CD2-CE3 4.28Å; Y423-W426 PolarHBondContact O-N 3.49Å; Y423-K427 HydrophobicContact CD2-CD 4.49Å; Y423-K427 HydrophobicContact CE1-CD 4.25Å; Y423-K427 HydrophobicContact CE2-CD 4.11Å; Y423-K427 VanDerWaalsContact CE2-CE 3.48Å; Y423-K427 HydrophobicContact CE2-CG 4.44Å; Y423-K427 WeakPolarHBondContact O-CB 3.47Å; Y423-K427 PolarHBondContact O-N 3.06Å; Y423-K427 WeakPolarHBondContact OH-CE 3.36Å; Y423-K427 PolarHBondContact OH-NZ 2.79Å
424	E	92.4	Very high	89.9	Confident	101 Å²	101	66.4 Å²	66.4	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-73.9	-31.9	179	-69.5	-55.4	135.9	0	0	113	R422 Q428	R422-E424 PolarHBondContact O-N 2.81Å; E424-Q428 WeakPolarHBondContact O-CB 3.29Å; E424-Q428 WeakPolarHBondContact O-CG 3.33Å; E424-Q428 PolarHBondContact O-N 3.25Å; E424-Q428 PolarHBondContact O-NE2 2.99Å
425	L	92.3	Very high	90	Very high	87 Å²	87	68.2 Å²	68.2	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-67.6	-43	171.2	-67.9	172.5	0	0	0	110.9	R422 Q428 G429 K430 D431	R422-L425 PolarHBondContact O-N 3.08Å; R422-L425 VanDerWaalsContact O-N 3.12Å; L425-Q428 CarbonylContact O-C 3.01Å; L425-Q428 PolarHBondContact O-N 2.77Å; L425-G429 PolarHBondContact O-N 3.07Å; L425-K430 HydrophobicContact CD2-CB 4.37Å; L425-K430 PolarHBondContact O-N 3.18Å; L425-D431 PolarHBondContact O-N 3.28Å
426	W	93.1	Very high	89.9	Confident	67 Å²	67	72.3 Å²	72.3	25%	0.254	38%	0.384	S	S	.	.	H	α-helix	trans	-62.6	-47.3	176.6	175.1	73.3	0	0	0	111.9	M411 D412 V415 R422 Y423 Q428 G429 D431	M411-W426 HydrophobicContact CB-CH2 4.17Å; M411-W426 HydrophobicContact CB-CZ2 3.87Å; D412-W426 HydrophobicContact CB-CH2 3.93Å; D412-W426 HydrophobicContact CB-CZ3 3.92Å; V415-W426 HydrophobicContact CB-CD2 4.26Å; V415-W426 HydrophobicContact CB-CE3 3.98Å; V415-W426 HydrophobicContact CB-CZ3 4.32Å; V415-W426 HydrophobicContact CG1-CB 4.14Å; V415-W426 HydrophobicContact CG1-CD2 4.05Å; V415-W426 HydrophobicContact CG1-CE3 3.93Å; V415-W426 HydrophobicContact CG1-CG 4.15Å; V415-W426 HydrophobicContact CG2-CD2 4Å; V415-W426 HydrophobicContact CG2-CE3 4.14Å; V415-W426 HydrophobicContact CG2-CG 4.48Å; V415-W426 HydrophobicContact CG2-CZ2 4.44Å; V415-W426 HydrophobicContact CG2-CZ3 4.43Å; R422-W426 WeakPolarHBondContact O-CB 3.45Å; R422-W426 PolarHBondContact O-N 2.67Å; Y423-W426 HydrophobicContact CD2-CE3 4.28Å; Y423-W426 PolarHBondContact O-N 3.49Å; W426-Q428 PolarHBondContact O-N 3.27Å; W426-G429 PolarHBondContact O-N 3.45Å; W426-D431 HydrophobicContact CB-CB 3.84Å
427	K	90	Very high	90.1	Very high	97 Å²	97	69.6 Å²	69.6	42%	0.422	38%	0.376	S	S	.	.	H	α-helix	trans	-59.2	-33.8	172.4	-85.1	-177	166.9	177.2	0	113.5	D412 Y423 G429	D412-K427 WeakPolarHBondContact OD2-CE 3.34Å; Y423-K427 HydrophobicContact CD2-CD 4.49Å; Y423-K427 HydrophobicContact CE1-CD 4.25Å; Y423-K427 HydrophobicContact CE2-CD 4.11Å; Y423-K427 VanDerWaalsContact CE2-CE 3.48Å; Y423-K427 HydrophobicContact CE2-CG 4.44Å; Y423-K427 WeakPolarHBondContact O-CB 3.47Å; Y423-K427 PolarHBondContact O-N 3.06Å; Y423-K427 WeakPolarHBondContact OH-CE 3.36Å; Y423-K427 PolarHBondContact OH-NZ 2.79Å; K427-G429 PolarHBondContact O-N 3.17Å
428	Q	91.4	Very high	90.4	Very high	78 Å²	78	72.6 Å²	72.6	36%	0.364	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-7.9	174.1	-73.9	175.1	52.9	0	0	113.5	E424 L425 W426 K430 K631	E424-Q428 WeakPolarHBondContact O-CB 3.29Å; E424-Q428 WeakPolarHBondContact O-CG 3.33Å; E424-Q428 PolarHBondContact O-N 3.25Å; E424-Q428 PolarHBondContact O-NE2 2.99Å; L425-Q428 CarbonylContact O-C 3.01Å; L425-Q428 PolarHBondContact O-N 2.77Å; W426-Q428 PolarHBondContact O-N 3.27Å; Q428-K430 VanDerWaalsContact C-N 3.34Å; Q428-K430 HydrophobicContact CB-CB 4.48Å; Q428-K430 HydrophobicContact CB-CD 3.94Å; Q428-K430 HydrophobicContact CB-CG 4.01Å; Q428-K631 WeakPolarHBondContact O-CE 3.31Å; Q428-K631 PolarHBondContact O-NZ 2.9Å
429	G	89.1	Confident	90.5	Very high	65 Å²	65	77.3 Å²	77.3	67%	0.67	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	20.6	-173.9	0	0	0	0	0	113.7	L425 W426 K427	L425-G429 PolarHBondContact O-N 3.07Å; W426-G429 PolarHBondContact O-N 3.45Å; K427-G429 PolarHBondContact O-N 3.17Å
430	K	90.6	Very high	90.5	Very high	123 Å²	123	77.5 Å²	77.5	54%	0.535	42%	0.416	S	S	.	.			trans	-109	1	-173.7	-63	177.1	-179.4	169.7	0	114	L425 Q428 I432	L425-K430 HydrophobicContact CD2-CB 4.37Å; L425-K430 PolarHBondContact O-N 3.18Å; Q428-K430 VanDerWaalsContact C-N 3.34Å; Q428-K430 HydrophobicContact CB-CB 4.48Å; Q428-K430 HydrophobicContact CB-CD 3.94Å; Q428-K430 HydrophobicContact CB-CG 4.01Å; K430-I432 WeakPolarHBondContact O-CG1 3.39Å; K430-I432 PolarHBondContact O-N 2.91Å; K430-I432 VanDerWaalsContact O-N 3.11Å
431	D	89.8	Confident	90.6	Very high	28 Å²	28	74.6 Å²	74.6	15%	0.15	40%	0.397	C	S	.	.			trans	-81.4	82.4	173.8	-174.3	-3.1	0	0	0	109.7	K395 R422 L425 W426 T433	K395-D431 WeakPolarHBondContact CE-OD2 3.49Å; K395-D431 IonicContact NZ-OD2 3.38Å; K395-D431 PolarHBondContact NZ-OD2 3.3Å; R422-D431 IonicContact CZ-OD1 3.63Å; R422-D431 IonicContact CZ-OD2 2.83Å; R422-D431 IonicContact NE-OD1 3.96Å; R422-D431 PolarHBondContact NE-OD1 2.82Å; R422-D431 IonicContact NE-OD2 2.99Å; R422-D431 PolarHBondContact NE-OD2 2.93Å; R422-D431 VanDerWaalsContact NH2-CG 3.3Å; R422-D431 IonicContact NH2-OD1 2.71Å; R422-D431 PolarHBondContact NH2-OD1 3.23Å; R422-D431 IonicContact NH2-OD2 3.43Å; R422-D431 PolarHBondContact NH2-OD2 3.18Å; L425-D431 PolarHBondContact O-N 3.28Å; W426-D431 HydrophobicContact CB-CB 3.84Å; D431-T433 PolarHBondContact O-N 2.77Å; D431-T433 VanDerWaalsContact O-N 3.13Å; D431-T433 VanDerWaalsContact OD1-CB 3.29Å; D431-T433 WeakPolarHBondContact OD1-CB 3.41Å; D431-T433 PolarHBondContact OD1-OG1 2.9Å
432	I	85.6	Confident	90.5	Very high	152 Å²	152	74.3 Å²	74.3	78%	0.779	38%	0.384	S	S	*	.			trans	-84.9	36.2	-177.1	-30.9	-179.1	0	0	0	111.3	K430 V434	K430-I432 WeakPolarHBondContact O-CG1 3.39Å; K430-I432 PolarHBondContact O-N 2.91Å; K430-I432 VanDerWaalsContact O-N 3.11Å; I432-V434 PolarHBondContact O-N 3.03Å
433	T	86.3	Confident	90.3	Very high	54 Å²	54	75.1 Å²	75.1	33%	0.331	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-69.7	116.7	-174.3	-66.5	0	0	0	0	110.9	N396 R422 D431	N396-T433 PolarHBondContact ND2-O 3.06Å; R422-T433 PolarHBondContact NH2-OG1 2.6Å; D431-T433 PolarHBondContact O-N 2.77Å; D431-T433 VanDerWaalsContact O-N 3.13Å; D431-T433 VanDerWaalsContact OD1-CB 3.29Å; D431-T433 WeakPolarHBondContact OD1-CB 3.41Å; D431-T433 PolarHBondContact OD1-OG1 2.9Å
434	V	87.3	Confident	90	Very high	129 Å²	129	75.6 Å²	75.6	78%	0.782	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-67.8	133.9	173.1	-177.9	0	0	0	0	108.9	I432 D436	I432-V434 PolarHBondContact O-N 3.03Å; V434-D436 PolarHBondContact O-N 2.75Å
435	L	90.4	Very high	89.8	Confident	39 Å²	39	71.6 Å²	71.6	20%	0.204	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-71.2	117.3	175	-63.5	-179.7	0	0	0	109.8	D392 Y393 N396	D392-L435 HydrophobicContact CB-CD2 3.89Å; D392-L435 WeakPolarHBondContact O-CD2 3.36Å; Y393-L435 HydrophobicContact CD1-CD1 4.02Å; Y393-L435 HydrophobicContact CD2-CD2 3.99Å; Y393-L435 HydrophobicContact CE1-CD1 4.16Å; Y393-L435 HydrophobicContact CE2-CD2 4.13Å; Y393-L435 HydrophobicContact CG-CD1 4.23Å; Y393-L435 HydrophobicContact CG-CD2 4.35Å; N396-L435 HydrophobicContact CB-CD1 4.26Å
436	D	89.9	Confident	89.5	Confident	85 Å²	85	72.4 Å²	72.4	46%	0.455	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-78.5	126.2	159.6	-174	13.3	0	0	0	109.2	Y393 V434 L438 K439	Y393-D436 PolarHBondContact OH-O 2.87Å; V434-D436 PolarHBondContact O-N 2.75Å; D436-L438 VanDerWaalsContact OD1-CB 3.28Å; D436-L438 WeakPolarHBondContact OD1-CB 3.31Å; D436-L438 PolarHBondContact OD1-N 2.71Å; D436-K439 HydrophobicContact CB-CB 4.24Å; D436-K439 VanDerWaalsContact OD2-CB 3.24Å; D436-K439 WeakPolarHBondContact OD2-CB 3.5Å; D436-K439 PolarHBondContact OD2-N 2.99Å
437	H	91.9	Very high	89.3	Confident	39 Å²	39	72.6 Å²	72.6	18%	0.181	40%	0.397	C	S	.	.	S	Bend	trans	-93.7	-10.2	174.8	-62	-59.6	0	0	0	112.3	H134 E308 Y393	H134-H437 PolarHBondContact CD2-O 3.4Å; E308-H437 HydrophobicContact CB-CB 4Å; Y393-H437 AromaticContact CE1-CE1 3.93Å; Y393-H437 AromaticContact CE1-ND1 3.71Å; Y393-H437 AromaticContact CZ-ND1 3.66Å; Y393-H437 WeakPolarHBondContact OH-CA 3.49Å; Y393-H437 PolarHBondContact OH-ND1 3.41Å
438	L	90.5	Very high	89.1	Confident	87 Å²	87	68 Å²	68	46%	0.455	38%	0.377	S	S	.	.	S	Bend	trans	-87.4	-41.8	177.8	-52.4	-179	0	0	0	111.7	H134 R135 D436 A440	H134-L438 PolarHBondContact NE2-O 3.46Å; R135-L438 VanDerWaalsContact NE-CD2 3.26Å; D436-L438 VanDerWaalsContact OD1-CB 3.28Å; D436-L438 WeakPolarHBondContact OD1-CB 3.31Å; D436-L438 PolarHBondContact OD1-N 2.71Å; L438-A440 PolarHBondContact O-N 2.79Å
439	K	90.8	Very high	88.8	Confident	111 Å²	111	66.8 Å²	66.8	48%	0.483	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-52.7	128.7	176.8	175.2	164.3	-176.1	175.4	0	112	H134 R389 D436 E442	H134-K439 PolarHBondContact NE2-O 2.81Å; R389-K439 WeakPolarHBondContact CD-O 3.37Å; D436-K439 HydrophobicContact CB-CB 4.24Å; D436-K439 VanDerWaalsContact OD2-CB 3.24Å; D436-K439 WeakPolarHBondContact OD2-CB 3.5Å; D436-K439 PolarHBondContact OD2-N 2.99Å; K439-E442 WeakPolarHBondContact CE-OE1 3.27Å; K439-E442 IonicContact NZ-OE1 3.69Å; K439-E442 PolarHBondContact NZ-OE1 2.86Å
440	A	91.7	Very high	88.5	Confident	29 Å²	29	66 Å²	66	24%	0.24	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-82.6	159.8	169.9	0	0	0	0	0	112	E129 L438	E129-A440 HydrophobicContact CB-CB 3.67Å; L438-A440 PolarHBondContact O-N 2.79Å
441	T	93.2	Very high	88	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.043	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-75	146.6	173	-163.7	0	0	0	0	112.5	V126 E129 T387 R389	V126-T441 HydrophobicContact CG2-CG2 3.94Å; E129-T441 HydrophobicContact CG-CG2 4.28Å; E129-T441 VanDerWaalsContact OE2-CB 3.29Å; E129-T441 WeakPolarHBondContact OE2-CB 3.27Å; E129-T441 WeakPolarHBondContact OE2-CG2 3.41Å; E129-T441 PolarHBondContact OE2-N 3.2Å; T387-T441 WeakPolarHBondContact CB-OG1 3.49Å; T387-T441 HydrophobicContact CG2-CG2 4.33Å; T387-T441 PolarHBondContact OG1-OG1 2.93Å; T387-T441 VanDerWaalsContact OG1-OG1 3.05Å; R389-T441 PolarHBondContact N-OG1 2.86Å
442	E	89.9	Confident	87.6	Confident	99 Å²	99	65 Å²	65	46%	0.463	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-91.2	157.1	165.4	-68.4	143.8	-121	0	0	109.2	L388 K439	L388-E442 HydrophobicContact CD1-CB 4.33Å; K439-E442 WeakPolarHBondContact CE-OE1 3.27Å; K439-E442 IonicContact NZ-OE1 3.69Å; K439-E442 PolarHBondContact NZ-OE1 2.86Å
443	L	87.2	Confident	87.2	Confident	69 Å²	69	64.3 Å²	64.3	36%	0.361	34%	0.34	S	S	.	.	S	Bend	trans	-73.2	-37.1	177.3	-174.1	72.8	0	0	0	112.2	A122 Q123 V126	A122-L443 HydrophobicContact CB-CD1 3.87Å; Q123-L443 HydrophobicContact CB-CD1 4.39Å; V126-L443 HydrophobicContact CG2-CB 3.98Å; V126-L443 HydrophobicContact CG2-CD1 4.1Å
444	S	86.1	Confident	86.6	Confident	41 Å²	41	67.8 Å²	67.8	29%	0.287	35%	0.352	S	S	.	.			trans	-151.5	156.9	-162.1	-101.9	0	0	0	0	111	E449 R452	S444-E449 WeakPolarHBondContact CA-OE2 3.44Å; S444-E449 WeakPolarHBondContact CB-OE2 3.4Å; S444-E449 PolarHBondContact OG-OE1 2.81Å; S444-E449 PolarHBondContact OG-OE2 3.36Å; S444-R452 PolarHBondContact OG-NH1 3.43Å
445	S	88.5	Confident	85.7	Confident	17 Å²	17	63.5 Å²	63.5	12%	0.119	32%	0.322	C	S	.	.			trans	-145.4	155.3	174.9	91.2	0	0	0	0	110.4	E447 L448 E449	S445-E447 VanDerWaalsContact CB-OE2 3.26Å; S445-E447 WeakPolarHBondContact CB-OE2 3.44Å; S445-E447 PolarHBondContact O-N 2.82Å; S445-E447 PolarHBondContact OG-N 3.44Å; S445-E447 PolarHBondContact OG-OE2 2.77Å; S445-L448 PolarHBondContact O-N 3.2Å; S445-L448 PolarHBondContact OG-N 3.14Å; S445-E449 PolarHBondContact N-OE2 2.9Å; S445-E449 VanDerWaalsContact N-OE2 3.13Å; S445-E449 VanDerWaalsContact O-CG 3.3Å; S445-E449 WeakPolarHBondContact O-CG 3.36Å; S445-E449 PolarHBondContact O-N 3Å
446	P	86.9	Confident	84.5	Confident	104 Å²	104	66.4 Å²	66.4	68%	0.675	34%	0.337	S	S	*	.	H	α-helix	trans	-52.2	-33.8	179.6	-27.2	35.7	0	0	0	113.7	S450	P446-S450 WeakPolarHBondContact O-CB 3.44Å; P446-S450 PolarHBondContact O-N 3.42Å
447	E	88.1	Confident	83.2	Confident	71 Å²	71	64.4 Å²	64.4	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-73.1	-42.8	177.6	-51.9	77.4	-170.2	0	0	112.3	C417 P420 S445 S450 W451	C417-E447 WeakPolarHBondContact O-CB 3.3Å; P420-E447 HydrophobicContact CG-CG 3.99Å; S445-E447 VanDerWaalsContact CB-OE2 3.26Å; S445-E447 WeakPolarHBondContact CB-OE2 3.44Å; S445-E447 PolarHBondContact O-N 2.82Å; S445-E447 PolarHBondContact OG-N 3.44Å; S445-E447 PolarHBondContact OG-OE2 2.77Å; E447-S450 PolarHBondContact O-N 3.15Å; E447-W451 WeakPolarHBondContact O-CB 3.3Å; E447-W451 PolarHBondContact O-N 2.65Å
448	L	85	Confident	82	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-43.1	174.3	-179.8	63.6	0	0	0	111.5	L250 M253 L388 L418 S445 W451 R452	L250-L448 HydrophobicContact CD2-CD1 3.5Å; L250-L448 HydrophobicContact CD2-CD2 3.83Å; L250-L448 HydrophobicContact CD2-CG 4.34Å; M253-L448 HydrophobicContact SD-CD1 4.24Å; L388-L448 HydrophobicContact CD2-CD2 4.43Å; L418-L448 HydrophobicContact CD2-CB 3.85Å; L418-L448 HydrophobicContact CD2-CD1 3.79Å; L418-L448 HydrophobicContact CD2-CG 4.41Å; S445-L448 PolarHBondContact O-N 3.2Å; S445-L448 PolarHBondContact OG-N 3.14Å; L448-W451 HydrophobicContact CD1-CE3 4.12Å; L448-W451 PolarHBondContact O-N 2.72Å; L448-R452 WeakPolarHBondContact O-CG 3.23Å; L448-R452 PolarHBondContact O-N 2.59Å
449	E	85.2	Confident	80.6	Confident	52 Å²	52	72.6 Å²	72.6	24%	0.243	36%	0.356	C	S	.	.	H	α-helix	trans	-68	-40.6	180	-53.7	-22.1	-62.4	0	0	111	S444 S445 R452 Q453	S444-E449 WeakPolarHBondContact CA-OE2 3.44Å; S444-E449 WeakPolarHBondContact CB-OE2 3.4Å; S444-E449 PolarHBondContact OG-OE1 2.81Å; S444-E449 PolarHBondContact OG-OE2 3.36Å; S445-E449 PolarHBondContact N-OE2 2.9Å; S445-E449 VanDerWaalsContact N-OE2 3.13Å; S445-E449 VanDerWaalsContact O-CG 3.3Å; S445-E449 WeakPolarHBondContact O-CG 3.36Å; S445-E449 PolarHBondContact O-N 3Å; E449-R452 PolarHBondContact O-N 3.22Å; E449-R452 WeakPolarHBondContact OE1-CD 3.13Å; E449-R452 IonicContact OE1-CZ 3.35Å; E449-R452 IonicContact OE1-NE 3.07Å; E449-R452 IonicContact OE1-NH1 2.65Å; E449-R452 PolarHBondContact OE1-NH1 3.35Å; E449-R452 IonicContact OE2-NH1 3.08Å; E449-R452 PolarHBondContact OE2-NH1 3.3Å; E449-Q453 WeakPolarHBondContact O-CB 3.5Å; E449-Q453 VanDerWaalsContact O-CG 3.29Å; E449-Q453 WeakPolarHBondContact O-CG 3.44Å; E449-Q453 PolarHBondContact O-N 2.82Å
450	S	83.7	Confident	79.1	Confident	49 Å²	49	72.7 Å²	72.7	34%	0.343	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-44.8	172.2	-176.6	0	0	0	0	111.8	P446 E447 Q453 Q454	P446-S450 WeakPolarHBondContact O-CB 3.44Å; P446-S450 PolarHBondContact O-N 3.42Å; E447-S450 PolarHBondContact O-N 3.15Å; S450-Q453 PolarHBondContact O-N 3.13Å; S450-Q454 WeakPolarHBondContact O-CB 3.46Å; S450-Q454 VanDerWaalsContact O-CG 3.22Å; S450-Q454 WeakPolarHBondContact O-CG 3.45Å; S450-Q454 PolarHBondContact O-N 2.79Å; S450-Q454 PolarHBondContact OG-NE2 2.65Å
451	W	81.1	Confident	78	Confident	31 Å²	31	75 Å²	75	12%	0.117	37%	0.366	C	S	.	.	H	α-helix	trans	-62	-47.2	175.3	174.2	80	0	0	0	112	M253 E257 E447 L448 Q453 Q454 R455	M253-W451 HydrophobicContact CB-CH2 4.34Å; M253-W451 HydrophobicContact CB-CZ2 4.35Å; M253-W451 HydrophobicContact CG-CE3 4.48Å; M253-W451 HydrophobicContact CG-CH2 3.57Å; M253-W451 HydrophobicContact CG-CZ2 3.96Å; M253-W451 HydrophobicContact CG-CZ3 3.86Å; M253-W451 HydrophobicContact SD-CD2 3.96Å; M253-W451 HydrophobicContact SD-CE3 3.77Å; M253-W451 HydrophobicContact SD-CH2 3.92Å; M253-W451 HydrophobicContact SD-CZ2 4.07Å; M253-W451 HydrophobicContact SD-CZ3 3.76Å; E257-W451 VanDerWaalsContact CD-NE1 3.32Å; E257-W451 HydrophobicContact CG-CZ2 3.81Å; E257-W451 WeakPolarHBondContact OE1-CZ2 3.37Å; E257-W451 PolarHBondContact OE1-NE1 3.17Å; E447-W451 WeakPolarHBondContact O-CB 3.3Å; E447-W451 PolarHBondContact O-N 2.65Å; L448-W451 HydrophobicContact CD1-CE3 4.12Å; L448-W451 PolarHBondContact O-N 2.72Å; W451-Q453 VanDerWaalsContact C-N 3.34Å; W451-Q453 PolarHBondContact O-N 2.95Å; W451-Q454 PolarHBondContact O-N 2.92Å; W451-R455 VanDerWaalsContact O-CB 3.27Å; W451-R455 WeakPolarHBondContact O-CB 3.42Å; W451-R455 PolarHBondContact O-N 2.77Å
452	R	79.9	Confident	76.7	Confident	98 Å²	98	79 Å²	79	37%	0.37	39%	0.387	S	S	.	.	H	α-helix	trans	-54.7	-48.2	175.3	-75.7	168.9	168.2	163.4	-3.9	111.3	S444 L448 E449 R455 I456	S444-R452 PolarHBondContact OG-NH1 3.43Å; L448-R452 WeakPolarHBondContact O-CG 3.23Å; L448-R452 PolarHBondContact O-N 2.59Å; E449-R452 PolarHBondContact O-N 3.22Å; E449-R452 WeakPolarHBondContact OE1-CD 3.13Å; E449-R452 IonicContact OE1-CZ 3.35Å; E449-R452 IonicContact OE1-NE 3.07Å; E449-R452 IonicContact OE1-NH1 2.65Å; E449-R452 PolarHBondContact OE1-NH1 3.35Å; E449-R452 IonicContact OE2-NH1 3.08Å; E449-R452 PolarHBondContact OE2-NH1 3.3Å; R452-R455 PolarHBondContact O-N 3.24Å; R452-I456 WeakPolarHBondContact O-CG1 3.29Å; R452-I456 PolarHBondContact O-N 3.27Å; R452-I456 VanDerWaalsContact O-N 3.14Å
453	Q	77.2	Confident	75.2	Confident	137 Å²	137	79.7 Å²	79.7	64%	0.64	39%	0.394	S	S	*	.	H	α-helix	trans	-66.2	-47.6	-179.8	-71.4	175.8	14.6	0	0	112.8	E449 S450 W451 R455 I456 A457	E449-Q453 WeakPolarHBondContact O-CB 3.5Å; E449-Q453 VanDerWaalsContact O-CG 3.29Å; E449-Q453 WeakPolarHBondContact O-CG 3.44Å; E449-Q453 PolarHBondContact O-N 2.82Å; S450-Q453 PolarHBondContact O-N 3.13Å; W451-Q453 VanDerWaalsContact C-N 3.34Å; W451-Q453 PolarHBondContact O-N 2.95Å; Q453-R455 PolarHBondContact O-N 3.42Å; Q453-I456 PolarHBondContact O-N 3.31Å; Q453-A457 PolarHBondContact O-N 3.05Å; Q453-A457 VanDerWaalsContact O-N 3.07Å
454	Q	73.6	Confident	74.1	Confident	128 Å²	128	82.3 Å²	82.3	60%	0.598	40%	0.404	S	S	*	.	H	α-helix	trans	-58.3	-39	177.3	-72.5	174.9	28.8	0	0	111.5	S450 W451 A457 Y458	S450-Q454 WeakPolarHBondContact O-CB 3.46Å; S450-Q454 VanDerWaalsContact O-CG 3.22Å; S450-Q454 WeakPolarHBondContact O-CG 3.45Å; S450-Q454 PolarHBondContact O-N 2.79Å; S450-Q454 PolarHBondContact OG-NE2 2.65Å; W451-Q454 PolarHBondContact O-N 2.92Å; Q454-A457 PolarHBondContact O-N 3.36Å; Q454-Y458 WeakPolarHBondContact O-CB 3.23Å; Q454-Y458 PolarHBondContact O-N 3.21Å
455	R	68.5	Low	73.3	Confident	38 Å²	38	86.8 Å²	86.8	14%	0.143	42%	0.418	C	S	.	.	H	α-helix	trans	-67.7	-39.1	178.4	-176	170.5	174.9	76.9	7.9	113.3	Q256 E257 W451 R452 Q453 Y458 R459	Q256-R455 VanDerWaalsContact O-CZ 3.3Å; Q256-R455 PolarHBondContact O-NH1 3.44Å; Q256-R455 PolarHBondContact O-NH2 3.05Å; Q256-R455 VanDerWaalsContact OE1-CZ 3.23Å; E257-R455 IonicContact OE1-CZ 3.38Å; E257-R455 IonicContact OE1-NH1 2.72Å; E257-R455 PolarHBondContact OE1-NH1 3.34Å; W451-R455 VanDerWaalsContact O-CB 3.27Å; W451-R455 WeakPolarHBondContact O-CB 3.42Å; W451-R455 PolarHBondContact O-N 2.77Å; R452-R455 PolarHBondContact O-N 3.24Å; Q453-R455 PolarHBondContact O-N 3.42Å; R455-Y458 PolarHBondContact O-N 2.83Å; R455-R459 PolarHBondContact O-N 2.94Å
456	I	65.1	Low	71.7	Confident	101 Å²	101	88.8 Å²	88.8	52%	0.518	44%	0.436	S	S	.	.	H	α-helix	trans	-61.8	-49.4	172.7	-68.2	164.5	0	0	0	110	R452 Q453 Y458 R459 Q460	R452-I456 WeakPolarHBondContact O-CG1 3.29Å; R452-I456 PolarHBondContact O-N 3.27Å; R452-I456 VanDerWaalsContact O-N 3.14Å; Q453-I456 PolarHBondContact O-N 3.31Å; I456-Y458 VanDerWaalsContact C-N 3.31Å; I456-Y458 PolarHBondContact O-N 3.25Å; I456-R459 PolarHBondContact O-N 3.39Å; I456-Q460 WeakPolarHBondContact O-CG 3.37Å; I456-Q460 PolarHBondContact O-N 2.75Å
457	A	63.9	Low	70.4	Confident	42 Å²	42	89.9 Å²	89.9	35%	0.347	43%	0.434	S	S	.	.	H	α-helix	trans	-60.6	-38.8	177.4	0	0	0	0	0	112.2	Q453 Q454 N461	Q453-A457 PolarHBondContact O-N 3.05Å; Q453-A457 VanDerWaalsContact O-N 3.07Å; Q454-A457 PolarHBondContact O-N 3.36Å; A457-N461 WeakPolarHBondContact O-CB 3.45Å; A457-N461 PolarHBondContact O-N 3.08Å; A457-N461 PolarHBondContact O-ND2 2.99Å
458	Y	66.6	Low	69.4	Low	152 Å²	152	92 Å²	92	60%	0.596	44%	0.443	S	S	*	.	H	α-helix	trans	-64.8	-46.2	176.3	-176.7	-100.1	0	0	0	112.5	Q454 R455 I456 N461 L462	Q454-Y458 WeakPolarHBondContact O-CB 3.23Å; Q454-Y458 PolarHBondContact O-N 3.21Å; R455-Y458 PolarHBondContact O-N 2.83Å; I456-Y458 VanDerWaalsContact C-N 3.31Å; I456-Y458 PolarHBondContact O-N 3.25Å; Y458-N461 PolarHBondContact O-N 2.75Å; Y458-L462 HydrophobicContact CD1-CD1 3.93Å; Y458-L462 HydrophobicContact CE1-CD1 3.41Å; Y458-L462 VanDerWaalsContact CE1-CD1 3.41Å; Y458-L462 HydrophobicContact CE1-CG 4.22Å; Y458-L462 PolarHBondContact O-N 3.32Å
459	R	60.7	Low	68.1	Low	147 Å²	147	98.8 Å²	98.8	56%	0.555	47%	0.473	S	S	*	.	H	α-helix	trans	-60.3	-45.5	174.8	-78.6	-176.3	169.7	-169.3	-3.9	111.8	R455 I456 N461 L462 L463	R455-R459 PolarHBondContact O-N 2.94Å; I456-R459 PolarHBondContact O-N 3.39Å; R459-N461 PolarHBondContact O-N 2.86Å; R459-L462 PolarHBondContact O-N 3.41Å; R459-L463 PolarHBondContact O-N 3.34Å
460	Q	59.7	Low	66.6	Low	113 Å²	113	101.7 Å²	101.7	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-61.1	-42.7	175.8	-72.5	177.9	-8.2	0	0	112.1	I456 L462 L463 Q464	I456-Q460 WeakPolarHBondContact O-CG 3.37Å; I456-Q460 PolarHBondContact O-N 2.75Å; Q460-L462 PolarHBondContact O-N 3.03Å; Q460-L463 PolarHBondContact O-N 2.79Å; Q460-Q464 WeakPolarHBondContact O-CG 3.48Å; Q460-Q464 PolarHBondContact O-N 2.97Å
461	N	68.6	Low	65.6	Low	76 Å²	76	106.6 Å²	106.6	41%	0.406	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-37.4	176.4	-90.4	-83.3	0	0	0	113	A457 Y458 R459 K465	A457-N461 WeakPolarHBondContact O-CB 3.45Å; A457-N461 PolarHBondContact O-N 3.08Å; A457-N461 PolarHBondContact O-ND2 2.99Å; Y458-N461 PolarHBondContact O-N 2.75Å; R459-N461 PolarHBondContact O-N 2.86Å; N461-K465 WeakPolarHBondContact O-CB 3.35Å; N461-K465 WeakPolarHBondContact O-CD 3.21Å; N461-K465 WeakPolarHBondContact O-CG 3.34Å; N461-K465 PolarHBondContact O-N 3.28Å
462	L	66	Low	64.5	Low	92 Å²	92	110.2 Å²	110.2	48%	0.482	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-45.4	173	-81.7	171.4	0	0	0	111.7	Y458 R459 Q460 K465 A466	Y458-L462 HydrophobicContact CD1-CD1 3.93Å; Y458-L462 HydrophobicContact CE1-CD1 3.41Å; Y458-L462 VanDerWaalsContact CE1-CD1 3.41Å; Y458-L462 HydrophobicContact CE1-CG 4.22Å; Y458-L462 PolarHBondContact O-N 3.32Å; R459-L462 PolarHBondContact O-N 3.41Å; Q460-L462 PolarHBondContact O-N 3.03Å; L462-K465 PolarHBondContact O-N 3Å; L462-A466 PolarHBondContact O-N 3.03Å
463	L	58.2	Low	63.2	Low	114 Å²	114	109.9 Å²	109.9	60%	0.597	53%	0.529	S	S	*	.	H	α-helix	trans	-61.8	-47	177.9	-119.8	161.2	0	0	0	111.6	R459 Q460 K465 A466 M467	R459-L463 PolarHBondContact O-N 3.34Å; Q460-L463 PolarHBondContact O-N 2.79Å; L463-K465 VanDerWaalsContact C-N 3.35Å; L463-K465 PolarHBondContact O-N 3.41Å; L463-A466 WeakPolarHBondContact O-CB 3.15Å; L463-A466 PolarHBondContact O-N 2.96Å; L463-M467 HydrophobicContact CD2-SD 4.37Å; L463-M467 WeakPolarHBondContact O-CG 3.35Å; L463-M467 PolarHBondContact O-N 2.91Å
464	Q	64.7	Low	62.2	Low	124 Å²	124	111.9 Å²	111.9	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-40.9	174.3	-73.3	-176.6	2.3	0	0	112.3	Q460 A466 M467 H468	Q460-Q464 WeakPolarHBondContact O-CG 3.48Å; Q460-Q464 PolarHBondContact O-N 2.97Å; Q464-A466 VanDerWaalsContact C-N 3.35Å; Q464-A466 PolarHBondContact O-N 2.87Å; Q464-M467 PolarHBondContact O-N 2.96Å; Q464-H468 VanDerWaalsContact O-CB 3.27Å; Q464-H468 WeakPolarHBondContact O-CB 3.46Å; Q464-H468 PolarHBondContact O-N 2.77Å
465	K	67.9	Low	61.3	Low	134 Å²	134	114.4 Å²	114.4	58%	0.583	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-36.7	175.5	-75.6	168.2	-175.6	176.2	0	112.4	N461 L462 L463 K469	N461-K465 WeakPolarHBondContact O-CB 3.35Å; N461-K465 WeakPolarHBondContact O-CD 3.21Å; N461-K465 WeakPolarHBondContact O-CG 3.34Å; N461-K465 PolarHBondContact O-N 3.28Å; L462-K465 PolarHBondContact O-N 3Å; L463-K465 VanDerWaalsContact C-N 3.35Å; L463-K465 PolarHBondContact O-N 3.41Å; K465-K469 WeakPolarHBondContact O-CG 3.41Å; K465-K469 PolarHBondContact O-N 3.03Å
466	A	55.2	Low	60.6	Low	60 Å²	60	118.2 Å²	118.2	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-48.6	173.6	0	0	0	0	0	111.7	L462 L463 Q464 H468 K469 M470	L462-A466 PolarHBondContact O-N 3.03Å; L463-A466 WeakPolarHBondContact O-CB 3.15Å; L463-A466 PolarHBondContact O-N 2.96Å; Q464-A466 VanDerWaalsContact C-N 3.35Å; Q464-A466 PolarHBondContact O-N 2.87Å; A466-H468 VanDerWaalsContact C-N 3.31Å; A466-H468 PolarHBondContact O-N 2.77Å; A466-K469 PolarHBondContact O-N 2.85Å; A466-M470 PolarHBondContact O-N 2.85Å
467	M	58.8	Low	60.2	Low	126 Å²	126	120.2 Å²	120.2	62%	0.621	56%	0.563	S	S	*	*	H	α-helix	trans	-61.7	-37.7	175.9	-66	178.3	82.6	0	0	112.2	L463 Q464 M470 K471	L463-M467 HydrophobicContact CD2-SD 4.37Å; L463-M467 WeakPolarHBondContact O-CG 3.35Å; L463-M467 PolarHBondContact O-N 2.91Å; Q464-M467 PolarHBondContact O-N 2.96Å; M467-M470 PolarHBondContact O-N 2.77Å; M467-K471 WeakPolarHBondContact O-CB 3.23Å; M467-K471 PolarHBondContact O-N 2.86Å
468	H	68.4	Low	59.6	Low	115 Å²	115	123.5 Å²	123.5	53%	0.532	57%	0.574	S	S	.	*	H	α-helix	trans	-67.1	-42.8	177	-165.6	98	0	0	0	111.9	Q464 A466 M470 K471 Q472	Q464-H468 VanDerWaalsContact O-CB 3.27Å; Q464-H468 WeakPolarHBondContact O-CB 3.46Å; Q464-H468 PolarHBondContact O-N 2.77Å; A466-H468 VanDerWaalsContact C-N 3.31Å; A466-H468 PolarHBondContact O-N 2.77Å; H468-M470 PolarHBondContact O-N 3.34Å; H468-K471 CarbonylContact O-C 3.56Å; H468-K471 PolarHBondContact O-N 3.28Å; H468-Q472 PolarHBondContact O-N 3.38Å
469	K	57.8	Low	59	Low	146 Å²	146	120.2 Å²	120.2	64%	0.635	56%	0.564	S	S	*	*	H	α-helix	trans	-59.2	-45.5	172	-78.4	-176.7	174.5	-173.2	0	111.7	K465 A466 K471 Q472 V473	K465-K469 WeakPolarHBondContact O-CG 3.41Å; K465-K469 PolarHBondContact O-N 3.03Å; A466-K469 PolarHBondContact O-N 2.85Å; K469-K471 VanDerWaalsContact C-N 3.28Å; K469-K471 PolarHBondContact O-N 3.04Å; K469-Q472 PolarHBondContact O-N 3.44Å; K469-V473 WeakPolarHBondContact O-CG2 3.19Å; K469-V473 PolarHBondContact O-N 2.76Å
470	M	54.2	Low	58.7	Low	112 Å²	112	119.2 Å²	119.2	55%	0.552	57%	0.566	S	S	*	*	H	α-helix	trans	-60.1	-37.7	176	-173.4	-179.1	178.7	0	0	112	A466 M467 H468 R474	A466-M470 PolarHBondContact O-N 2.85Å; M467-M470 PolarHBondContact O-N 2.77Å; H468-M470 PolarHBondContact O-N 3.34Å; M470-R474 PolarHBondContact O-N 3.09Å
471	K	62.4	Low	58.4	Low	153 Å²	153	116.5 Å²	116.5	67%	0.665	56%	0.557	S	S	*	*	H	α-helix	trans	-73.1	-33.9	175.8	-162.2	169.5	-175	174.2	0	113	M467 H468 K469 R475	M467-K471 WeakPolarHBondContact O-CB 3.23Å; M467-K471 PolarHBondContact O-N 2.86Å; H468-K471 CarbonylContact O-C 3.56Å; H468-K471 PolarHBondContact O-N 3.28Å; K469-K471 VanDerWaalsContact C-N 3.28Å; K469-K471 PolarHBondContact O-N 3.04Å; K471-R475 PolarHBondContact O-N 2.91Å; K471-R475 VanDerWaalsContact O-N 3.1Å
472	Q	57.4	Low	57.9	Low	107 Å²	107	117.6 Å²	117.6	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-46.8	170.8	-83.9	-176.1	-47.6	0	0	111.8	H468 K469 R474 R475 L476	H468-Q472 PolarHBondContact O-N 3.38Å; K469-Q472 PolarHBondContact O-N 3.44Å; Q472-R474 VanDerWaalsContact C-N 3.27Å; Q472-R474 PolarHBondContact O-N 2.83Å; Q472-R475 WeakPolarHBondContact O-CA 3.34Å; Q472-R475 WeakPolarHBondContact O-CB 3.48Å; Q472-R475 PolarHBondContact O-N 3.03Å; Q472-L476 WeakPolarHBondContact O-CG 3.49Å; Q472-L476 PolarHBondContact O-N 3.09Å
473	V	53.2	Low	57.4	Low	90 Å²	90	117.1 Å²	117.1	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-59.6	-38.3	177.5	172.3	0	0	0	0	111.5	K469 R475	K469-V473 WeakPolarHBondContact O-CG2 3.19Å; K469-V473 PolarHBondContact O-N 2.76Å; V473-R475 VanDerWaalsContact C-N 3.35Å
474	R	55.3	Low	57.1	Low	179 Å²	179	114 Å²	114	68%	0.675	54%	0.542	S	S	*	.	H	α-helix	trans	-67.7	-29.8	172.5	-73.1	-179.1	175.3	-172.4	-2.5	113.7	M470 Q472	M470-R474 PolarHBondContact O-N 3.09Å; Q472-R474 VanDerWaalsContact C-N 3.27Å; Q472-R474 PolarHBondContact O-N 2.83Å
475	R	55.5	Low	56.6	Low	181 Å²	181	111 Å²	111	68%	0.683	54%	0.538	S	S	*	.	H	α-helix	trans	-74.8	-43.1	175.9	-110.8	-175.8	176.4	-179	-2.8	112.6	K471 Q472 V473 K477 L478 E479	K471-R475 PolarHBondContact O-N 2.91Å; K471-R475 VanDerWaalsContact O-N 3.1Å; Q472-R475 WeakPolarHBondContact O-CA 3.34Å; Q472-R475 WeakPolarHBondContact O-CB 3.48Å; Q472-R475 PolarHBondContact O-N 3.03Å; V473-R475 VanDerWaalsContact C-N 3.35Å; R475-K477 VanDerWaalsContact C-N 3.3Å; R475-K477 PolarHBondContact O-N 2.67Å; R475-L478 WeakPolarHBondContact O-CA 3.3Å; R475-L478 WeakPolarHBondContact O-CB 3.37Å; R475-L478 PolarHBondContact O-N 2.99Å; R475-E479 PolarHBondContact O-N 3.12Å; R475-E479 VanDerWaalsContact O-N 3.07Å
476	L	52.6	Low	55.8	Low	118 Å²	118	112.1 Å²	112.1	62%	0.618	55%	0.545	S	S	*	.	H	α-helix	trans	-57.6	-43.2	-179.6	-70.1	167.7	0	0	0	111.6	Q472 L478 E479 E480	Q472-L476 WeakPolarHBondContact O-CG 3.49Å; Q472-L476 PolarHBondContact O-N 3.09Å; L476-L478 PolarHBondContact O-N 2.82Å; L476-E479 PolarHBondContact O-N 3.26Å; L476-E480 PolarHBondContact O-N 3.48Å
477	K	56.3	Low	55.9	Low	144 Å²	144	115.7 Å²	115.7	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-60.3	-26.6	173.4	-71.3	-165.8	169.9	-157.2	0	114.7	R475 V481	R475-K477 VanDerWaalsContact C-N 3.3Å; R475-K477 PolarHBondContact O-N 2.67Å; K477-V481 WeakPolarHBondContact O-CG2 3.42Å
478	L	52.6	Low	55.5	Low	110 Å²	110	112.9 Å²	112.9	58%	0.576	56%	0.555	S	S	*	*	H	α-helix	trans	-83.8	-32.2	178.4	-165.2	70.6	0	0	0	111.5	R475 L476 V481 K482	R475-L478 WeakPolarHBondContact O-CA 3.3Å; R475-L478 WeakPolarHBondContact O-CB 3.37Å; R475-L478 PolarHBondContact O-N 2.99Å; L476-L478 PolarHBondContact O-N 2.82Å; L478-V481 PolarHBondContact O-N 3.04Å; L478-K482 PolarHBondContact O-N 3.03Å
479	E	53.8	Low	55	Low	84 Å²	84	111.8 Å²	111.8	39%	0.393	55%	0.552	S	S	.	*	H	α-helix	trans	-72.9	-33.5	173.7	-125.1	69.6	-155.3	0	0	111.6	R475 L476 V481 K482 V483	R475-E479 PolarHBondContact O-N 3.12Å; R475-E479 VanDerWaalsContact O-N 3.07Å; L476-E479 PolarHBondContact O-N 3.26Å; E479-V481 VanDerWaalsContact C-N 3.28Å; E479-V481 PolarHBondContact O-N 2.98Å; E479-K482 WeakPolarHBondContact O-CB 3.25Å; E479-K482 PolarHBondContact O-N 2.77Å; E479-K482 VanDerWaalsContact O-N 3.15Å; E479-K482 WeakPolarHBondContact OE1-CD 3.37Å; E479-K482 WeakPolarHBondContact OE1-CE 3.48Å; E479-K482 IonicContact OE1-NZ 2.69Å; E479-K482 PolarHBondContact OE1-NZ 3.49Å; E479-V483 WeakPolarHBondContact O-CG2 3.25Å; E479-V483 PolarHBondContact O-N 3.2Å
480	E	55.1	Low	54.6	Low	126 Å²	126	114.3 Å²	114.3	59%	0.589	57%	0.566	S	S	*	*	H	α-helix	trans	-56.6	-41.2	168.1	-73.6	177.1	124.9	0	0	111.8	L476 V483 L484	L476-E480 PolarHBondContact O-N 3.48Å; E480-V483 PolarHBondContact O-N 3.33Å; E480-L484 WeakPolarHBondContact O-CG 3.08Å; E480-L484 PolarHBondContact O-N 3.36Å
481	V	53.3	Low	54.6	Low	56 Å²	56	112.5 Å²	112.5	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-68.7	-32.7	176.5	172.9	0	0	0	0	112.2	K477 L478 E479 A485 Y496	K477-V481 WeakPolarHBondContact O-CG2 3.42Å; L478-V481 PolarHBondContact O-N 3.04Å; E479-V481 VanDerWaalsContact C-N 3.28Å; E479-V481 PolarHBondContact O-N 2.98Å; V481-A485 PolarHBondContact O-N 3.18Å; V481-Y496 HydrophobicContact CG2-CE1 4.33Å
482	K	56.6	Low	54.4	Low	99 Å²	99	109.5 Å²	109.5	43%	0.43	55%	0.55	S	S	.	*	H	α-helix	trans	-67.3	-46.5	172.8	-77.7	-171	-174.8	171.7	0	112.8	L478 E479 L484 A485 E486	L478-K482 PolarHBondContact O-N 3.03Å; E479-K482 WeakPolarHBondContact O-CB 3.25Å; E479-K482 PolarHBondContact O-N 2.77Å; E479-K482 VanDerWaalsContact O-N 3.15Å; E479-K482 WeakPolarHBondContact OE1-CD 3.37Å; E479-K482 WeakPolarHBondContact OE1-CE 3.48Å; E479-K482 IonicContact OE1-NZ 2.69Å; E479-K482 PolarHBondContact OE1-NZ 3.49Å; K482-L484 PolarHBondContact O-N 2.69Å; K482-A485 WeakPolarHBondContact O-CA 3.43Å; K482-A485 WeakPolarHBondContact O-CB 3.39Å; K482-A485 PolarHBondContact O-N 2.72Å; K482-E486 PolarHBondContact O-N 2.73Å
483	V	56.1	Low	54	Low	81 Å²	81	107.5 Å²	107.5	49%	0.491	55%	0.551	S	S	.	*	H	α-helix	trans	-57.3	-41.1	-177.6	171	0	0	0	0	110.3	E479 E480 A485 E486 E487	E479-V483 WeakPolarHBondContact O-CG2 3.25Å; E479-V483 PolarHBondContact O-N 3.2Å; E480-V483 PolarHBondContact O-N 3.33Å; V483-A485 VanDerWaalsContact C-N 3.29Å; V483-A485 PolarHBondContact O-N 2.72Å; V483-E486 PolarHBondContact O-N 3.37Å; V483-E487 PolarHBondContact O-N 2.7Å
484	L	52.7	Low	54.1	Low	50 Å²	50	106.7 Å²	106.7	26%	0.262	55%	0.554	S	S	.	*	H	α-helix	trans	-65.8	-25.7	175.4	-66.4	170.6	0	0	0	114.3	E480 K482 L491 Y496	E480-L484 WeakPolarHBondContact O-CG 3.08Å; E480-L484 PolarHBondContact O-N 3.36Å; K482-L484 PolarHBondContact O-N 2.69Å; L484-L491 HydrophobicContact CB-CD1 4.06Å; L484-Y496 HydrophobicContact CD1-CE2 4.08Å
485	A	52.9	Low	54	Low	59 Å²	59	101.8 Å²	101.8	49%	0.488	54%	0.539	S	S	.	.	H	α-helix	trans	-84.2	-33.2	174.8	0	0	0	0	0	112.4	V481 K482 V483 E487 G488	V481-A485 PolarHBondContact O-N 3.18Å; K482-A485 WeakPolarHBondContact O-CA 3.43Å; K482-A485 WeakPolarHBondContact O-CB 3.39Å; K482-A485 PolarHBondContact O-N 2.72Å; V483-A485 VanDerWaalsContact C-N 3.29Å; V483-A485 PolarHBondContact O-N 2.72Å; A485-E487 VanDerWaalsContact C-N 3.27Å; A485-E487 PolarHBondContact O-N 3.2Å; A485-G488 PolarHBondContact O-N 3.15Å; A485-G488 VanDerWaalsContact O-N 3.15Å
486	E	51.9	Low	53.9	Low	158 Å²	158	97 Å²	97	74%	0.738	52%	0.521	S	S	*	.	H	α-helix	trans	-69.8	-23	175.9	-71.7	177.8	-172.4	0	0	112.5	K482 V483 G488	K482-E486 PolarHBondContact O-N 2.73Å; V483-E486 PolarHBondContact O-N 3.37Å; E486-G488 PolarHBondContact O-N 3.46Å
487	E	57.7	Low	54	Low	136 Å²	136	96 Å²	96	64%	0.636	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	7.1	168.8	-69.8	-173.1	151.6	0	0	114.1	V483 A485 I489	V483-E487 PolarHBondContact O-N 2.7Å; A485-E487 VanDerWaalsContact C-N 3.27Å; A485-E487 PolarHBondContact O-N 3.2Å; E487-I489 VanDerWaalsContact C-N 3.34Å; E487-I489 PolarHBondContact O-N 3.36Å
488	G	50.3	Low	54.3	Low	67 Å²	67	95.5 Å²	95.5	69%	0.691	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	11.9	173.3	0	0	0	0	0	114.8	A485 E486	A485-G488 PolarHBondContact O-N 3.15Å; A485-G488 VanDerWaalsContact O-N 3.15Å; E486-G488 PolarHBondContact O-N 3.46Å
489	I	56.8	Low	54.5	Low	91 Å²	91	95.1 Å²	95.1	47%	0.467	50%	0.503	S	S	.	.			trans	-91.7	108.4	174.2	-45	-180	0	0	0	108.2	E487 L491	E487-I489 VanDerWaalsContact C-N 3.34Å; E487-I489 PolarHBondContact O-N 3.36Å; I489-L491 HydrophobicContact CB-CG 4.48Å; I489-L491 HydrophobicContact CG2-CD1 4.39Å; I489-L491 HydrophobicContact CG2-CD2 4.4Å; I489-L491 HydrophobicContact CG2-CG 3.88Å; I489-L491 PolarHBondContact O-N 2.69Å
490	E	51	Low	54.7	Low	199 Å²	199	93.6 Å²	93.6	93%	0.93	50%	0.5	S	S	*	.			trans	-69.4	78	172.2	-74.1	-164.1	137.6	0	0	111	N492	E490-N492 PolarHBondContact O-N 2.73Å
491	L	52.7	Low	55	Low	74 Å²	74	92.9 Å²	92.9	39%	0.387	50%	0.496	S	S	.	.			trans	-79.7	105.7	171.8	-77.1	167.6	0	0	0	109.9	L484 I489 A493 Y496	L484-L491 HydrophobicContact CB-CD1 4.06Å; I489-L491 HydrophobicContact CB-CG 4.48Å; I489-L491 HydrophobicContact CG2-CD1 4.39Å; I489-L491 HydrophobicContact CG2-CD2 4.4Å; I489-L491 HydrophobicContact CG2-CG 3.88Å; I489-L491 PolarHBondContact O-N 2.69Å; L491-A493 PolarHBondContact O-N 2.99Å; L491-Y496 HydrophobicContact CD1-CD2 3.96Å; L491-Y496 HydrophobicContact CD1-CE2 4.27Å; L491-Y496 HydrophobicContact CD2-CD2 4.17Å
492	N	57.9	Low	55.5	Low	91 Å²	91	94.9 Å²	94.9	49%	0.487	50%	0.502	S	S	.	.			trans	-51.8	107.2	164.9	175	7.1	0	0	0	109.4	E490 A494 E495 Y496	E490-N492 PolarHBondContact O-N 2.73Å; N492-A494 VanDerWaalsContact C-N 3.26Å; N492-A494 PolarHBondContact O-N 3.05Å; N492-E495 HydrophobicContact CB-CB 3.88Å; N492-E495 PolarHBondContact ND2-OE2 3.27Å; N492-E495 WeakPolarHBondContact O-CA 3.16Å; N492-E495 WeakPolarHBondContact O-CB 3.43Å; N492-E495 PolarHBondContact O-N 3.02Å; N492-Y496 PolarHBondContact O-N 3.44Å
493	A	49.8	Very low	55.7	Low	64 Å²	64	98.4 Å²	98.4	53%	0.529	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-32.4	-167.7	0	0	0	0	0	113.5	L491 E495 Q497	L491-A493 PolarHBondContact O-N 2.99Å; A493-E495 VanDerWaalsContact C-N 3.3Å; A493-Q497 WeakPolarHBondContact O-CB 3.36Å; A493-Q497 PolarHBondContact O-N 3.43Å
494	A	54.6	Low	55.7	Low	73 Å²	73	100.8 Å²	100.8	60%	0.603	52%	0.518	S	S	*	.	H	α-helix	trans	-67.6	-32.6	174.3	0	0	0	0	0	112.2	N492 R498	N492-A494 VanDerWaalsContact C-N 3.26Å; N492-A494 PolarHBondContact O-N 3.05Å; A494-R498 WeakPolarHBondContact O-CB 3.28Å; A494-R498 PolarHBondContact O-N 3.08Å
495	E	53.6	Low	56.2	Low	77 Å²	77	101 Å²	101	36%	0.36	53%	0.528	S	S	.	.	H	α-helix	trans	-82.3	-37	-178	-166	144.4	-133.1	0	0	111.9	N492 A493 R498 Q499	N492-E495 HydrophobicContact CB-CB 3.88Å; N492-E495 PolarHBondContact ND2-OE2 3.27Å; N492-E495 WeakPolarHBondContact O-CA 3.16Å; N492-E495 WeakPolarHBondContact O-CB 3.43Å; N492-E495 PolarHBondContact O-N 3.02Å; A493-E495 VanDerWaalsContact C-N 3.3Å; E495-R498 PolarHBondContact O-N 3.34Å; E495-R498 IonicContact OE1-NH1 3.97Å; E495-R498 IonicContact OE1-NH2 2.94Å; E495-Q499 WeakPolarHBondContact O-CB 3.22Å; E495-Q499 VanDerWaalsContact O-CG 3.29Å; E495-Q499 WeakPolarHBondContact O-CG 3.41Å; E495-Q499 PolarHBondContact O-N 2.86Å
496	Y	54.1	Low	56.9	Low	79 Å²	79	103.6 Å²	103.6	31%	0.31	53%	0.53	S	S	.	.	H	α-helix	trans	-62.4	-46.6	168.8	-175.8	-94.6	0	0	0	111.5	V481 L484 L491 N492 R498 Q499 V500	V481-Y496 HydrophobicContact CG2-CE1 4.33Å; L484-Y496 HydrophobicContact CD1-CE2 4.08Å; L491-Y496 HydrophobicContact CD1-CD2 3.96Å; L491-Y496 HydrophobicContact CD1-CE2 4.27Å; L491-Y496 HydrophobicContact CD2-CD2 4.17Å; N492-Y496 PolarHBondContact O-N 3.44Å; Y496-R498 PolarHBondContact O-N 2.83Å; Y496-Q499 PolarHBondContact O-N 3.08Å; Y496-V500 HydrophobicContact CD1-CG2 4.31Å; Y496-V500 HydrophobicContact CE1-CG2 3.99Å; Y496-V500 WeakPolarHBondContact O-CG2 3.45Å; Y496-V500 PolarHBondContact O-N 2.57Å
497	Q	54.6	Low	57.5	Low	98 Å²	98	104.2 Å²	104.2	46%	0.458	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-45.1	176.3	-176.5	62.1	28.6	0	0	111.3	A493 Q499 V500 E501	A493-Q497 WeakPolarHBondContact O-CB 3.36Å; A493-Q497 PolarHBondContact O-N 3.43Å; Q497-Q499 PolarHBondContact O-N 3.19Å; Q497-V500 PolarHBondContact O-N 2.94Å; Q497-E501 PolarHBondContact NE2-OE1 2.96Å; Q497-E501 PolarHBondContact O-N 2.85Å
498	R	61.6	Low	57.4	Low	134 Å²	134	103.4 Å²	103.4	51%	0.506	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-42	175.8	-161.6	-175.7	76.5	-132.3	-5.7	111.9	A494 E495 Y496 V500 E501 E502	A494-R498 WeakPolarHBondContact O-CB 3.28Å; A494-R498 PolarHBondContact O-N 3.08Å; E495-R498 PolarHBondContact O-N 3.34Å; E495-R498 IonicContact OE1-NH1 3.97Å; E495-R498 IonicContact OE1-NH2 2.94Å; Y496-R498 PolarHBondContact O-N 2.83Å; R498-V500 VanDerWaalsContact C-N 3.3Å; R498-V500 PolarHBondContact O-N 3.17Å; R498-E501 PolarHBondContact O-N 3.29Å; R498-E502 WeakPolarHBondContact O-CB 3.23Å; R498-E502 PolarHBondContact O-N 2.96Å
499	Q	57	Low	58.1	Low	101 Å²	101	106 Å²	106	47%	0.472	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-30.9	176.1	-76.7	178.1	31.1	0	0	113.5	E495 Y496 Q497 R503	E495-Q499 WeakPolarHBondContact O-CB 3.22Å; E495-Q499 VanDerWaalsContact O-CG 3.29Å; E495-Q499 WeakPolarHBondContact O-CG 3.41Å; E495-Q499 PolarHBondContact O-N 2.86Å; Y496-Q499 PolarHBondContact O-N 3.08Å; Q497-Q499 PolarHBondContact O-N 3.19Å; Q499-R503 WeakPolarHBondContact O-CB 3.42Å; Q499-R503 WeakPolarHBondContact O-CG 3.47Å; Q499-R503 PolarHBondContact O-N 2.85Å
500	V	57.6	Low	58.5	Low	53 Å²	53	108 Å²	108	32%	0.321	52%	0.521	S	S	.	.	H	α-helix	trans	-70.1	-48.1	174.1	171.7	0	0	0	0	110.3	Y496 Q497 R498 E502 R503 E504	Y496-V500 HydrophobicContact CD1-CG2 4.31Å; Y496-V500 HydrophobicContact CE1-CG2 3.99Å; Y496-V500 WeakPolarHBondContact O-CG2 3.45Å; Y496-V500 PolarHBondContact O-N 2.57Å; Q497-V500 PolarHBondContact O-N 2.94Å; R498-V500 VanDerWaalsContact C-N 3.3Å; R498-V500 PolarHBondContact O-N 3.17Å; V500-E502 PolarHBondContact O-N 2.71Å; V500-R503 PolarHBondContact O-N 2.8Å; V500-E504 PolarHBondContact O-N 3.1Å
501	E	61.2	Low	59.1	Low	110 Å²	110	106.4 Å²	106.4	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-40.1	177.8	-70.1	170.1	-171	0	0	111.8	Q497 R498 E504 A505	Q497-E501 PolarHBondContact NE2-OE1 2.96Å; Q497-E501 PolarHBondContact O-N 2.85Å; R498-E501 PolarHBondContact O-N 3.29Å; E501-E504 PolarHBondContact O-N 2.84Å; E501-A505 WeakPolarHBondContact O-CB 3.4Å; E501-A505 PolarHBondContact O-N 3.4Å
502	E	64.8	Low	59.5	Low	99 Å²	99	107.6 Å²	107.6	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-37	174.8	-173	167.7	-165.7	0	0	112	R498 V500 A505 Q506	R498-E502 WeakPolarHBondContact O-CB 3.23Å; R498-E502 PolarHBondContact O-N 2.96Å; V500-E502 PolarHBondContact O-N 2.71Å; E502-A505 PolarHBondContact O-N 2.79Å; E502-Q506 WeakPolarHBondContact O-CG 3.39Å; E502-Q506 PolarHBondContact O-N 3.39Å
503	R	60.3	Low	60.1	Low	173 Å²	173	107.9 Å²	107.9	65%	0.653	51%	0.509	S	S	*	.	H	α-helix	trans	-69.5	-35.5	171.3	-88.2	179.1	159.8	174.9	-1.8	113.6	Q499 V500 R507	Q499-R503 WeakPolarHBondContact O-CB 3.42Å; Q499-R503 WeakPolarHBondContact O-CG 3.47Å; Q499-R503 PolarHBondContact O-N 2.85Å; V500-R503 PolarHBondContact O-N 2.8Å; R503-R507 WeakPolarHBondContact O-CB 3.29Å; R503-R507 WeakPolarHBondContact O-CD 3.26Å; R503-R507 VanDerWaalsContact O-CG 3.27Å; R503-R507 WeakPolarHBondContact O-CG 3.4Å; R503-R507 PolarHBondContact O-N 2.91Å; R503-R507 VanDerWaalsContact O-N 3.11Å
504	E	56.7	Low	61.3	Low	130 Å²	130	111 Å²	111	61%	0.607	51%	0.506	S	S	*	.	H	α-helix	trans	-71.3	-36.2	174.1	-68.6	-163.6	151.9	0	0	111.3	V500 E501 R507 K508	V500-E504 PolarHBondContact O-N 3.1Å; E501-E504 PolarHBondContact O-N 2.84Å; E504-R507 PolarHBondContact O-N 3.1Å; E504-K508 PolarHBondContact O-N 3.01Å; E504-K508 VanDerWaalsContact O-N 3.1Å
505	A	63.7	Low	61.6	Low	56 Å²	56	112.5 Å²	112.5	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-47.5	170.9	0	0	0	0	0	112.4	E501 E502 R507 K508 Q509	E501-A505 WeakPolarHBondContact O-CB 3.4Å; E501-A505 PolarHBondContact O-N 3.4Å; E502-A505 PolarHBondContact O-N 2.79Å; A505-R507 VanDerWaalsContact C-N 3.34Å; A505-R507 PolarHBondContact O-N 3.25Å; A505-K508 WeakPolarHBondContact O-CB 3.16Å; A505-K508 PolarHBondContact O-N 2.66Å; A505-K508 VanDerWaalsContact O-N 3.09Å; A505-Q509 PolarHBondContact O-N 2.87Å
506	Q	66.3	Low	62.3	Low	113 Å²	113	111.4 Å²	111.4	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-57.1	-44.5	174.3	-80.9	-176.3	-16.6	0	0	112.1	E502 K508 Q509 E510	E502-Q506 WeakPolarHBondContact O-CG 3.39Å; E502-Q506 PolarHBondContact O-N 3.39Å; Q506-K508 PolarHBondContact O-N 3.24Å; Q506-Q509 PolarHBondContact O-N 3.47Å; Q506-Q509 VanDerWaalsContact O-N 3.15Å; Q506-E510 PolarHBondContact O-N 3.09Å
507	R	65.4	Low	63.2	Low	171 Å²	171	113.3 Å²	113.3	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-65.3	-24	177.4	-75	170.2	170.3	-174.6	-1.8	113.9	R503 E504 A505	R503-R507 WeakPolarHBondContact O-CB 3.29Å; R503-R507 WeakPolarHBondContact O-CD 3.26Å; R503-R507 VanDerWaalsContact O-CG 3.27Å; R503-R507 WeakPolarHBondContact O-CG 3.4Å; R503-R507 PolarHBondContact O-N 2.91Å; R503-R507 VanDerWaalsContact O-N 3.11Å; E504-R507 PolarHBondContact O-N 3.1Å; A505-R507 VanDerWaalsContact C-N 3.34Å; A505-R507 PolarHBondContact O-N 3.25Å
508	K	55.8	Low	63.9	Low	119 Å²	119	113.9 Å²	113.9	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-76	-48.4	169.9	-176.8	177.8	176.6	-66.2	0	110.3	E504 A505 Q506 R511 E512	E504-K508 PolarHBondContact O-N 3.01Å; E504-K508 VanDerWaalsContact O-N 3.1Å; A505-K508 WeakPolarHBondContact O-CB 3.16Å; A505-K508 PolarHBondContact O-N 2.66Å; A505-K508 VanDerWaalsContact O-N 3.09Å; Q506-K508 PolarHBondContact O-N 3.24Å; K508-R511 WeakPolarHBondContact O-CB 3.22Å; K508-R511 PolarHBondContact O-N 3.37Å; K508-R511 VanDerWaalsContact O-N 3.12Å; K508-E512 VanDerWaalsContact CE-OE1 3.28Å; K508-E512 WeakPolarHBondContact CE-OE1 3.46Å; K508-E512 WeakPolarHBondContact CG-OE1 3.23Å; K508-E512 VanDerWaalsContact NZ-CD 3.34Å; K508-E512 IonicContact NZ-OE1 3.27Å; K508-E512 PolarHBondContact NZ-OE1 3.28Å; K508-E512 IonicContact NZ-OE2 3.62Å; K508-E512 PolarHBondContact NZ-OE2 2.68Å; K508-E512 PolarHBondContact O-N 2.93Å
509	Q	64.3	Low	63.7	Low	122 Å²	122	110 Å²	110	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-61.1	-45.7	179.2	-170.2	174.4	0.2	0	0	112.7	A505 Q506 R511 E512 E513	A505-Q509 PolarHBondContact O-N 2.87Å; Q506-Q509 PolarHBondContact O-N 3.47Å; Q506-Q509 VanDerWaalsContact O-N 3.15Å; Q509-R511 PolarHBondContact O-N 2.9Å; Q509-E512 PolarHBondContact O-N 3.45Å; Q509-E513 VanDerWaalsContact O-CB 3.31Å; Q509-E513 WeakPolarHBondContact O-CB 3.47Å; Q509-E513 PolarHBondContact O-N 2.99Å
510	E	66.4	Low	64.3	Low	132 Å²	132	111.2 Å²	111.2	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-57.6	-35.6	174.1	-75.8	-171.6	132.4	0	0	112.6	Q506 R514	Q506-E510 PolarHBondContact O-N 3.09Å; E510-R514 WeakPolarHBondContact O-CB 3.32Å; E510-R514 PolarHBondContact O-N 2.94Å
511	R	63.2	Low	65	Low	165 Å²	165	114.4 Å²	114.4	62%	0.623	54%	0.536	S	S	*	.	H	α-helix	trans	-72.5	-42.1	179.4	-174	-177.2	-67.1	-149.4	0.7	111.1	K508 Q509 R514 L515	K508-R511 WeakPolarHBondContact O-CB 3.22Å; K508-R511 PolarHBondContact O-N 3.37Å; K508-R511 VanDerWaalsContact O-N 3.12Å; Q509-R511 PolarHBondContact O-N 2.9Å; R511-R514 PolarHBondContact O-N 3.26Å; R511-L515 HydrophobicContact CG-CD1 4.32Å; R511-L515 VanDerWaalsContact O-CD1 3.29Å; R511-L515 WeakPolarHBondContact O-CD1 3.47Å; R511-L515 PolarHBondContact O-N 3.14Å
512	E	60.6	Low	65.1	Low	100 Å²	100	111.6 Å²	111.6	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-44.6	176.1	-73.7	164.2	-178.7	0	0	111	K508 Q509 R514 L515 A516	K508-E512 VanDerWaalsContact CE-OE1 3.28Å; K508-E512 WeakPolarHBondContact CE-OE1 3.46Å; K508-E512 WeakPolarHBondContact CG-OE1 3.23Å; K508-E512 VanDerWaalsContact NZ-CD 3.34Å; K508-E512 IonicContact NZ-OE1 3.27Å; K508-E512 PolarHBondContact NZ-OE1 3.28Å; K508-E512 IonicContact NZ-OE2 3.62Å; K508-E512 PolarHBondContact NZ-OE2 2.68Å; K508-E512 PolarHBondContact O-N 2.93Å; Q509-E512 PolarHBondContact O-N 3.45Å; E512-R514 VanDerWaalsContact C-N 3.29Å; E512-R514 PolarHBondContact O-N 2.76Å; E512-L515 PolarHBondContact O-N 2.96Å; E512-A516 PolarHBondContact O-N 2.82Å
513	E	71.4	Confident	65.1	Low	97 Å²	97	112.6 Å²	112.6	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-67.4	-27.6	176.6	-158.2	-170.5	-101.7	0	0	112.5	Q509 R517	Q509-E513 VanDerWaalsContact O-CB 3.31Å; Q509-E513 WeakPolarHBondContact O-CB 3.47Å; Q509-E513 PolarHBondContact O-N 2.99Å; E513-R517 PolarHBondContact O-N 3.41Å; E513-R517 PolarHBondContact O-NE 2.68Å; E513-R517 PolarHBondContact O-NH2 3.33Å; E513-R517 IonicContact OE2-CZ 2.66Å; E513-R517 IonicContact OE2-NH1 3.17Å; E513-R517 PolarHBondContact OE2-NH1 3.34Å; E513-R517 IonicContact OE2-NH2 3.94Å; E513-R517 PolarHBondContact OE2-NH2 2.89Å
514	R	74.5	Confident	65.6	Low	128 Å²	128	108.6 Å²	108.6	48%	0.483	53%	0.528	S	S	.	.	H	α-helix	trans	-71.6	-44.1	169.3	-163.1	-177.4	69.1	-119	-3.3	112.1	E510 R511 E512 A516 R517 E518	E510-R514 WeakPolarHBondContact O-CB 3.32Å; E510-R514 PolarHBondContact O-N 2.94Å; R511-R514 PolarHBondContact O-N 3.26Å; E512-R514 VanDerWaalsContact C-N 3.29Å; E512-R514 PolarHBondContact O-N 2.76Å; R514-A516 VanDerWaalsContact C-N 3.29Å; R514-A516 PolarHBondContact O-N 3.35Å; R514-R517 PolarHBondContact O-N 3.16Å; R514-E518 WeakPolarHBondContact CD-OE1 3.21Å; R514-E518 WeakPolarHBondContact CG-OE1 3.45Å; R514-E518 IonicContact NE-OE1 3.65Å; R514-E518 PolarHBondContact NE-OE1 2.77Å; R514-E518 WeakPolarHBondContact O-CG 3.39Å; R514-E518 PolarHBondContact O-N 3.36Å
515	L	59.9	Low	66.2	Low	106 Å²	106	104.9 Å²	104.9	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-59.2	-40.8	173	-97	93.2	0	0	0	111.7	R511 E512 R517 E518 A519	R511-L515 HydrophobicContact CG-CD1 4.32Å; R511-L515 VanDerWaalsContact O-CD1 3.29Å; R511-L515 WeakPolarHBondContact O-CD1 3.47Å; R511-L515 PolarHBondContact O-N 3.14Å; E512-L515 PolarHBondContact O-N 2.96Å; L515-R517 PolarHBondContact O-N 3.4Å; L515-E518 PolarHBondContact O-N 3.46Å; L515-A519 WeakPolarHBondContact O-CB 3.47Å; L515-A519 PolarHBondContact O-N 2.79Å
516	A	69.1	Low	66.2	Low	54 Å²	54	107.3 Å²	107.3	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-61	-42.3	176.8	0	0	0	0	0	112.5	E512 R514 A519 M520	E512-A516 PolarHBondContact O-N 2.82Å; R514-A516 VanDerWaalsContact C-N 3.29Å; R514-A516 PolarHBondContact O-N 3.35Å; A516-A519 PolarHBondContact O-N 3.18Å; A516-M520 WeakPolarHBondContact O-CG 3.46Å; A516-M520 PolarHBondContact O-N 2.89Å
517	R	71.9	Confident	66.5	Low	119 Å²	119	107 Å²	107	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-39.7	174.3	-78.2	178.2	-73.8	-120.2	-4.8	113	E513 R514 L515 A519 L521	E513-R517 PolarHBondContact O-N 3.41Å; E513-R517 PolarHBondContact O-NE 2.68Å; E513-R517 PolarHBondContact O-NH2 3.33Å; E513-R517 IonicContact OE2-CZ 2.66Å; E513-R517 IonicContact OE2-NH1 3.17Å; E513-R517 PolarHBondContact OE2-NH1 3.34Å; E513-R517 IonicContact OE2-NH2 3.94Å; E513-R517 PolarHBondContact OE2-NH2 2.89Å; R514-R517 PolarHBondContact O-N 3.16Å; L515-R517 PolarHBondContact O-N 3.4Å; R517-A519 VanDerWaalsContact C-N 3.3Å; R517-A519 PolarHBondContact O-N 3.1Å; R517-L521 WeakPolarHBondContact O-CG 3.24Å; R517-L521 PolarHBondContact O-N 3.22Å
518	E	69.3	Low	66.8	Low	109 Å²	109	104.3 Å²	104.3	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-34.9	174.1	-71.5	172.3	-155.1	0	0	111.4	R514 L515 A522	R514-E518 WeakPolarHBondContact CD-OE1 3.21Å; R514-E518 WeakPolarHBondContact CG-OE1 3.45Å; R514-E518 IonicContact NE-OE1 3.65Å; R514-E518 PolarHBondContact NE-OE1 2.77Å; R514-E518 WeakPolarHBondContact O-CG 3.39Å; R514-E518 PolarHBondContact O-N 3.36Å; L515-E518 PolarHBondContact O-N 3.46Å; E518-A522 PolarHBondContact O-N 3.35Å
519	A	58.6	Low	67.3	Low	52 Å²	52	105.1 Å²	105.1	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-71.7	-44.4	175.7	0	0	0	0	0	113.4	L515 A516 R517 L521 A522 L523	L515-A519 WeakPolarHBondContact O-CB 3.47Å; L515-A519 PolarHBondContact O-N 2.79Å; A516-A519 PolarHBondContact O-N 3.18Å; R517-A519 VanDerWaalsContact C-N 3.3Å; R517-A519 PolarHBondContact O-N 3.1Å; A519-L521 VanDerWaalsContact C-N 3.3Å; A519-L521 PolarHBondContact O-N 3.02Å; A519-A522 WeakPolarHBondContact O-CB 3.27Å; A519-A522 PolarHBondContact O-N 3.42Å; A519-A522 VanDerWaalsContact O-N 3.08Å; A519-L523 PolarHBondContact O-N 3.34Å
520	M	69.2	Low	67.2	Low	127 Å²	127	106.1 Å²	106.1	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-60.4	-40.3	175.3	-70.1	-160.5	-51.8	0	0	111.9	A516 A522 L523 E524	A516-M520 WeakPolarHBondContact O-CG 3.46Å; A516-M520 PolarHBondContact O-N 2.89Å; M520-A522 PolarHBondContact O-N 3.36Å; M520-L523 PolarHBondContact O-N 3.36Å; M520-E524 WeakPolarHBondContact O-CB 3.46Å; M520-E524 PolarHBondContact O-N 2.83Å
521	L	72.2	Confident	67.3	Low	120 Å²	120	105.2 Å²	105.2	63%	0.628	52%	0.519	S	S	*	.	H	α-helix	trans	-65.4	-25.2	175.9	-75.7	167.9	0	0	0	113.4	R517 A519 A525	R517-L521 WeakPolarHBondContact O-CG 3.24Å; R517-L521 PolarHBondContact O-N 3.22Å; A519-L521 VanDerWaalsContact C-N 3.3Å; A519-L521 PolarHBondContact O-N 3.02Å; L521-A525 WeakPolarHBondContact O-CB 3.35Å; L521-A525 PolarHBondContact O-N 2.73Å
522	A	63.3	Low	67.7	Low	52 Å²	52	103.4 Å²	103.4	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-76.2	-42.8	172.6	0	0	0	0	0	111.8	E518 A519 M520 A525 L526	E518-A522 PolarHBondContact O-N 3.35Å; A519-A522 WeakPolarHBondContact O-CB 3.27Å; A519-A522 PolarHBondContact O-N 3.42Å; A519-A522 VanDerWaalsContact O-N 3.08Å; M520-A522 PolarHBondContact O-N 3.36Å; A522-A525 WeakPolarHBondContact O-CB 3.19Å; A522-A525 PolarHBondContact O-N 3.02Å; A522-L526 WeakPolarHBondContact O-CG 3.37Å; A522-L526 PolarHBondContact O-N 2.82Å
523	L	64.7	Low	67.7	Low	119 Å²	119	101.4 Å²	101.4	62%	0.623	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-46.7	175.7	-69.1	168	0	0	0	111.7	A519 M520 A525 L526 E527	A519-L523 PolarHBondContact O-N 3.34Å; M520-L523 PolarHBondContact O-N 3.36Å; L523-A525 PolarHBondContact O-N 3.24Å; L523-L526 PolarHBondContact O-N 2.67Å; L523-L526 VanDerWaalsContact O-N 3.12Å; L523-E527 PolarHBondContact O-N 3.46Å
524	E	71.8	Confident	67.3	Low	90 Å²	90	99.6 Å²	99.6	42%	0.421	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-15	177.4	-149.5	-159.6	-120.1	0	0	112.7	M520 R528	M520-E524 WeakPolarHBondContact O-CB 3.46Å; M520-E524 PolarHBondContact O-N 2.83Å; E524-R528 WeakPolarHBondContact O-CG 3.31Å; E524-R528 PolarHBondContact O-NH1 3.27Å; E524-R528 IonicContact OE1-NH2 2.76Å; E524-R528 IonicContact OE2-CZ 2.97Å; E524-R528 IonicContact OE2-NH1 2.62Å; E524-R528 PolarHBondContact OE2-NH1 3.27Å; E524-R528 IonicContact OE2-NH2 3.24Å; E524-R528 PolarHBondContact OE2-NH2 2.86Å
525	A	68.6	Low	66.7	Low	51 Å²	51	99.1 Å²	99.1	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-84.3	-42.7	170.1	0	0	0	0	0	111.8	L521 A522 L523 R528 E529	L521-A525 WeakPolarHBondContact O-CB 3.35Å; L521-A525 PolarHBondContact O-N 2.73Å; A522-A525 WeakPolarHBondContact O-CB 3.19Å; A522-A525 PolarHBondContact O-N 3.02Å; L523-A525 PolarHBondContact O-N 3.24Å; A525-R528 CarbonylContact O-C 3.58Å; A525-R528 PolarHBondContact O-N 3.23Å; A525-E529 PolarHBondContact O-N 2.93Å; A525-E529 VanDerWaalsContact O-N 3.13Å
526	L	63.6	Low	66.8	Low	107 Å²	107	96.9 Å²	96.9	56%	0.56	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-44.6	176.6	-71	169.5	0	0	0	111.8	A522 L523 R528 E529 E530	A522-L526 WeakPolarHBondContact O-CG 3.37Å; A522-L526 PolarHBondContact O-N 2.82Å; L523-L526 PolarHBondContact O-N 2.67Å; L523-L526 VanDerWaalsContact O-N 3.12Å; L526-R528 PolarHBondContact O-N 2.66Å; L526-E529 CarbonylContact O-C 3.58Å; L526-E529 WeakPolarHBondContact O-CA 3.33Å; L526-E529 PolarHBondContact O-N 3.12Å; L526-E530 PolarHBondContact O-N 2.94Å
527	E	73.4	Confident	66.3	Low	107 Å²	107	97.1 Å²	97.1	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-57.4	-34.1	175.7	-171.5	-179.8	-163.9	0	0	111.9	L523 Q531	L523-E527 PolarHBondContact O-N 3.46Å; E527-Q531 WeakPolarHBondContact O-CB 3.26Å; E527-Q531 VanDerWaalsContact O-CG 3.29Å; E527-Q531 WeakPolarHBondContact O-CG 3.23Å; E527-Q531 PolarHBondContact O-N 3.28Å
528	R	70.3	Confident	65.6	Low	115 Å²	115	94.8 Å²	94.8	43%	0.434	53%	0.526	S	S	.	.	H	α-helix	trans	-82.3	-8.9	175.1	-68.1	-174.2	-170.4	105.5	-6.7	114.6	E524 A525 L526 K532	E524-R528 WeakPolarHBondContact O-CG 3.31Å; E524-R528 PolarHBondContact O-NH1 3.27Å; E524-R528 IonicContact OE1-NH2 2.76Å; E524-R528 IonicContact OE2-CZ 2.97Å; E524-R528 IonicContact OE2-NH1 2.62Å; E524-R528 PolarHBondContact OE2-NH1 3.27Å; E524-R528 IonicContact OE2-NH2 3.24Å; E524-R528 PolarHBondContact OE2-NH2 2.86Å; A525-R528 CarbonylContact O-C 3.58Å; A525-R528 PolarHBondContact O-N 3.23Å; L526-R528 PolarHBondContact O-N 2.66Å; R528-K532 WeakPolarHBondContact O-CD 3.32Å; R528-K532 WeakPolarHBondContact O-CE 3.44Å; R528-K532 VanDerWaalsContact O-CG 3.31Å; R528-K532 WeakPolarHBondContact O-CG 3.4Å; R528-K532 PolarHBondContact O-NZ 3.23Å
529	E	67.7	Low	65.1	Low	135 Å²	135	96.9 Å²	96.9	63%	0.631	53%	0.533	S	S	*	.	H	α-helix	trans	-92.2	-37.2	166	-68.7	-162.8	135.8	0	0	110.3	A525 L526 K532 A533	A525-E529 PolarHBondContact O-N 2.93Å; A525-E529 VanDerWaalsContact O-N 3.13Å; L526-E529 CarbonylContact O-C 3.58Å; L526-E529 WeakPolarHBondContact O-CA 3.33Å; L526-E529 PolarHBondContact O-N 3.12Å; E529-K532 PolarHBondContact O-N 2.69Å; E529-A533 WeakPolarHBondContact O-CB 3.46Å; E529-A533 PolarHBondContact O-N 3.25Å
530	E	61.7	Low	64.9	Low	143 Å²	143	98.3 Å²	98.3	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-62.8	-46.3	173.1	-172.7	170.2	-159.9	0	0	112.1	L526 K532 A533 A534	L526-E530 PolarHBondContact O-N 2.94Å; E530-K532 VanDerWaalsContact C-N 3.26Å; E530-K532 PolarHBondContact O-N 3.32Å; E530-A533 WeakPolarHBondContact O-CB 3.27Å; E530-A533 PolarHBondContact O-N 3.29Å; E530-A533 VanDerWaalsContact O-N 3.13Å; E530-A534 WeakPolarHBondContact O-CB 3.37Å; E530-A534 PolarHBondContact O-N 3.15Å
531	Q	68.1	Low	63.8	Low	114 Å²	114	96.5 Å²	96.5	53%	0.533	55%	0.55	S	S	.	*	H	α-helix	trans	-58.2	-36.7	173.4	-75.8	175.1	4.7	0	0	112.6	E527 E535	E527-Q531 WeakPolarHBondContact O-CB 3.26Å; E527-Q531 VanDerWaalsContact O-CG 3.29Å; E527-Q531 WeakPolarHBondContact O-CG 3.23Å; E527-Q531 PolarHBondContact O-N 3.28Å; Q531-E535 PolarHBondContact O-N 3.07Å
532	K	71.2	Confident	62.6	Low	126 Å²	126	97.5 Å²	97.5	55%	0.548	56%	0.556	S	S	.	*	H	α-helix	trans	-74.1	-35.5	175.9	-69.5	177.4	-165.7	118.5	0	112.4	R528 E529 E530 A534 E535 A536	R528-K532 WeakPolarHBondContact O-CD 3.32Å; R528-K532 WeakPolarHBondContact O-CE 3.44Å; R528-K532 VanDerWaalsContact O-CG 3.31Å; R528-K532 WeakPolarHBondContact O-CG 3.4Å; R528-K532 PolarHBondContact O-NZ 3.23Å; E529-K532 PolarHBondContact O-N 2.69Å; E530-K532 VanDerWaalsContact C-N 3.26Å; E530-K532 PolarHBondContact O-N 3.32Å; K532-A534 VanDerWaalsContact C-N 3.33Å; K532-E535 PolarHBondContact O-N 3.04Å; K532-A536 VanDerWaalsContact O-CB 3.3Å; K532-A536 WeakPolarHBondContact O-CB 3.5Å; K532-A536 PolarHBondContact O-N 3.25Å
533	A	61.9	Low	61.4	Low	59 Å²	59	100.4 Å²	100.4	49%	0.488	57%	0.573	S	S	.	*	H	α-helix	trans	-65.2	-39.6	173.4	0	0	0	0	0	110.8	E529 E530 A536 A537	E529-A533 WeakPolarHBondContact O-CB 3.46Å; E529-A533 PolarHBondContact O-N 3.25Å; E530-A533 WeakPolarHBondContact O-CB 3.27Å; E530-A533 PolarHBondContact O-N 3.29Å; E530-A533 VanDerWaalsContact O-N 3.13Å; A533-A536 PolarHBondContact O-N 2.85Å; A533-A537 VanDerWaalsContact O-CB 3.31Å; A533-A537 WeakPolarHBondContact O-CB 3.49Å; A533-A537 PolarHBondContact O-N 3.39Å
534	A	63.5	Low	60.3	Low	59 Å²	59	101 Å²	101	49%	0.488	58%	0.584	S	S	.	*	H	α-helix	trans	-64.5	-45.8	173.1	0	0	0	0	0	112.2	E530 K532 A536 A537 A538	E530-A534 WeakPolarHBondContact O-CB 3.37Å; E530-A534 PolarHBondContact O-N 3.15Å; K532-A534 VanDerWaalsContact C-N 3.33Å; A534-A536 VanDerWaalsContact C-N 3.29Å; A534-A536 PolarHBondContact O-N 2.99Å; A534-A537 PolarHBondContact O-N 3.13Å; A534-A538 WeakPolarHBondContact O-CB 3.48Å; A534-A538 PolarHBondContact O-N 2.83Å
535	E	61.9	Low	58.7	Low	117 Å²	117	103.2 Å²	103.2	55%	0.547	60%	0.604	S	S	.	*	H	α-helix	trans	-60.4	-36.5	172.4	-79.3	-158.2	124.9	0	0	113	Q531 K532 K539	Q531-E535 PolarHBondContact O-N 3.07Å; K532-E535 PolarHBondContact O-N 3.04Å; E535-K539 WeakPolarHBondContact O-CD 3.41Å; E535-K539 WeakPolarHBondContact O-CG 3.47Å; E535-K539 PolarHBondContact O-N 3.25Å
536	A	61.8	Low	56.9	Low	59 Å²	59	110.2 Å²	110.2	49%	0.488	63%	0.625	S	S	.	*	H	α-helix	trans	-72.4	-40.5	177.7	0	0	0	0	0	112	K532 A533 A534 K539 A540	K532-A536 VanDerWaalsContact O-CB 3.3Å; K532-A536 WeakPolarHBondContact O-CB 3.5Å; K532-A536 PolarHBondContact O-N 3.25Å; A533-A536 PolarHBondContact O-N 2.85Å; A534-A536 VanDerWaalsContact C-N 3.29Å; A534-A536 PolarHBondContact O-N 2.99Å; A536-K539 PolarHBondContact O-N 3.41Å; A536-A540 PolarHBondContact O-N 3.06Å
537	A	57.2	Low	55.3	Low	60 Å²	60	109.3 Å²	109.3	50%	0.496	63%	0.632	S	S	.	*	H	α-helix	trans	-65.5	-42.1	175.1	0	0	0	0	0	111.7	A533 A534 K539 A540 A541	A533-A537 VanDerWaalsContact O-CB 3.31Å; A533-A537 WeakPolarHBondContact O-CB 3.49Å; A533-A537 PolarHBondContact O-N 3.39Å; A534-A537 PolarHBondContact O-N 3.13Å; A537-K539 VanDerWaalsContact C-N 3.26Å; A537-K539 PolarHBondContact O-N 2.89Å; A537-A540 PolarHBondContact O-N 3.05Å; A537-A541 PolarHBondContact O-N 3.22Å
538	A	58.1	Low	53.2	Low	69 Å²	69	111.6 Å²	111.6	57%	0.57	64%	0.643	S	S	*	*	H	α-helix	trans	-59.3	-36.7	173.7	0	0	0	0	0	112.3	A534 A540	A534-A538 WeakPolarHBondContact O-CB 3.48Å; A534-A538 PolarHBondContact O-N 2.83Å; A538-A540 VanDerWaalsContact C-N 3.33Å
539	K	58	Low	51.1	Low	154 Å²	154	114.1 Å²	114.1	67%	0.67	66%	0.66	S	S	*	*	H	α-helix	trans	-76.3	-15.7	173.8	-72.7	165.2	-175.3	148.4	0	114.1	E535 A536 A537	E535-K539 WeakPolarHBondContact O-CD 3.41Å; E535-K539 WeakPolarHBondContact O-CG 3.47Å; E535-K539 PolarHBondContact O-N 3.25Å; A536-K539 PolarHBondContact O-N 3.41Å; A537-K539 VanDerWaalsContact C-N 3.26Å; A537-K539 PolarHBondContact O-N 2.89Å
540	A	54.3	Low	49	Very low	82 Å²	82	116.5 Å²	116.5	68%	0.678	67%	0.671	S	S	*	*	H	α-helix	trans	-93.5	-19.9	177.7	0	0	0	0	0	113.3	A536 A537 A538 D542	A536-A540 PolarHBondContact O-N 3.06Å; A537-A540 PolarHBondContact O-N 3.05Å; A538-A540 VanDerWaalsContact C-N 3.33Å; A540-D542 VanDerWaalsContact C-N 3.35Å
541	A	47	Very low	47.5	Very low	89 Å²	89	118.4 Å²	118.4	74%	0.736	68%	0.68	S	S	*	*	S	Bend	trans	-78.1	-15	179.7	0	0	0	0	0	114.3	A537	A537-A541 PolarHBondContact O-N 3.22Å
542	D	47.3	Very low	45.5	Very low	140 Å²	140	120 Å²	120	75%	0.749	70%	0.697	S	S	*	*	S	Bend	trans	-116.7	58.6	-166.7	-162.7	21.8	0	0	0	113.3	A540	A540-D542 VanDerWaalsContact C-N 3.35Å
543	S	37.1	Very low	43.3	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	71%	0.706	S	S	*	*			trans	-163	135.8	161.2	-82.1	0	0	0	0	112.2
544	P	41.3	Very low	41.5	Very low	131 Å²	131	124.3 Å²	124.3	85%	0.851	72%	0.716	S	S	*	*			trans	-113.7	174.6	-165.6	32.4	-15.2	0	0	0	116
545	V	39.5	Very low	39.6	Very low	138 Å²	138	130.9 Å²	130.9	84%	0.836	73%	0.734	S	S	*	*			trans	-94.7	140.4	-176.8	174.5	0	0	0	0	112.5
546	K	30.8	Very low	39.2	Very low	198 Å²	198	130.5 Å²	130.5	86%	0.861	74%	0.741	S	S	*	*			trans	-172.9	138.6	141.3	-109.5	163.7	-174.5	178	0	117.3
547	A	29.2	Very low	38.5	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	75%	0.754	S	S	*	*			trans	47.4	125.6	138.2	0	0	0	0	0	124.6
548	E	28.8	Very low	37.1	Very low	155 Å²	155	137.4 Å²	137.4	72%	0.724	77%	0.768	S	S	*	*			trans	29.3	134.9	132.9	-66.2	173.4	166.6	0	0	124.4
549	E	26.7	Very low	35.6	Very low	169 Å²	169	143 Å²	143	79%	0.79	78%	0.78	S	S	*	*			trans	37.7	118.5	146.4	-53.6	-169.2	171.5	0	0	122.8
550	Q	24.5	Very low	34.1	Very low	185 Å²	185	141.5 Å²	141.5	86%	0.864	78%	0.777	S	S	*	*				-178.8	173.6	95.6	-94.1	-168.4	-0.7	0	0	113.1
551	E	29.7	Very low	32.7	Very low	183 Å²	183	144.9 Å²	144.9	86%	0.855	78%	0.779	S	S	*	*			trans	-81.4	159.1	-176.6	-56.3	-177.7	122.5	0	0	114.4
552	V	25.1	Very low	31.8	Very low	146 Å²	146	146.3 Å²	146.3	89%	0.885	77%	0.774	S	S	*	*				169.9	154.8	121	155.5	0	0	0	0	111.1
553	D	25	Very low	31.1	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	77%	0.77	S	S	*	*			trans	-88.4	-179.2	-172.1	-178.8	32.1	0	0	0	114.6
554	I	24.6	Very low	30.9	Very low	136 Å²	136	144.8 Å²	144.8	70%	0.697	75%	0.753	S	S	*	*			trans	100.3	80.4	156.5	-46.6	179.4	0	0	0	118.4
555	K	23.1	Very low	30.6	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.857	73%	0.734	S	S	*	*				68.4	165.7	125.2	-81.7	-175.1	175.2	171.6	0	122.8
556	P	54.8	Low	30.3	Very low	109 Å²	109	145 Å²	145	71%	0.708	73%	0.729	S	S	*	*			trans	-115.1	-170.5	-156.6	46.7	-37	0	0	0	114.2
557	P	45.9	Very low	30.4	Very low	114 Å²	114	142.7 Å²	142.7	74%	0.74	72%	0.719	S	S	*	*				-154.2	170.1	86	41.2	-21.6	0	0	0	118.8
558	N	27.6	Very low	30.4	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	72%	0.715	S	S	*	*			trans	5.3	143.3	153	-51.9	-12.7	0	0	0	122.4
559	F	26.4	Very low	30.5	Very low	187 Å²	187	145 Å²	145	82%	0.82	72%	0.716	S	S	*	*				-156.6	176.7	110.7	-132.4	-121.4	0	0	0	115.3
560	M	26.7	Very low	30.7	Very low	123 Å²	123	144.8 Å²	144.8	61%	0.606	71%	0.712	S	S	*	*			trans	-56.5	171.4	-173.7	-76.8	151.7	56.5	0	0	116.7
561	E	25.4	Very low	30.8	Very low	152 Å²	152	143.3 Å²	143.3	71%	0.71	71%	0.705	S	S	*	*			cis	-157.6	143.9	7.2	-124.6	158.5	161.5	0	0	106.2
562	D	29.3	Very low	30.6	Very low	120 Å²	120	143.8 Å²	143.8	64%	0.642	70%	0.704	S	S	*	*			cis	94.7	154.4	37.5	-152.8	15.4	0	0	0	116.2	K565	D562-K565 WeakPolarHBondContact OD1-CE 3.45Å; D562-K565 IonicContact OD1-NZ 2.7Å; D562-K565 PolarHBondContact OD1-NZ 2.94Å
563	I	31.4	Very low	30.9	Very low	129 Å²	129	147.6 Å²	147.6	66%	0.662	70%	0.703	S	S	*	*			trans	81.5	134.2	166.1	-65.9	167.4	0	0	0	118.2
564	E	33.2	Very low	30.8	Very low	92 Å²	92	148 Å²	148	43%	0.43	70%	0.702	S	S	.	*			cis	-154.1	132.8	-27.3	-103.7	-75.9	110.2	0	0	106.2	K566	E564-K566 WeakPolarHBondContact OE2-CD 3.38Å; E564-K566 WeakPolarHBondContact OE2-CE 3.48Å; E564-K566 IonicContact OE2-NZ 3.25Å; E564-K566 PolarHBondContact OE2-NZ 2.74Å
565	K	34.7	Very low	30.9	Very low	106 Å²	106	145.9 Å²	145.9	46%	0.461	70%	0.699	S	S	.	*			cis	96.5	42.3	24.4	-56.8	174	-93.8	122.2	0	117.4	D562 K567	D562-K565 WeakPolarHBondContact OD1-CE 3.45Å; D562-K565 IonicContact OD1-NZ 2.7Å; D562-K565 PolarHBondContact OD1-NZ 2.94Å; K565-K567 WeakPolarHBondContact O-CD 3.4Å; K565-K567 WeakPolarHBondContact O-CE 3.29Å; K565-K567 PolarHBondContact O-NZ 2.65Å
566	K	34.1	Very low	31.1	Very low	168 Å²	168	143.1 Å²	143.1	73%	0.73	69%	0.694	S	S	*	*			trans	-125.1	123.1	162.9	-86.9	92.9	178	176.7	0	114.7	E564	E564-K566 WeakPolarHBondContact OE2-CD 3.38Å; E564-K566 WeakPolarHBondContact OE2-CE 3.48Å; E564-K566 IonicContact OE2-NZ 3.25Å; E564-K566 PolarHBondContact OE2-NZ 2.74Å
567	K	31.9	Very low	29.8	Very low	148 Å²	148	144.5 Å²	144.5	64%	0.643	69%	0.694	S	S	*	*			cis	93.5	162	39.4	-66.5	167	-179.6	142	0	111.8	K565	K565-K567 WeakPolarHBondContact O-CD 3.4Å; K565-K567 WeakPolarHBondContact O-CE 3.29Å; K565-K567 PolarHBondContact O-NZ 2.65Å
568	L	30.5	Very low	28.9	Very low	124 Å²	124	147.5 Å²	147.5	65%	0.649	70%	0.698	S	S	*	*			cis	-167.1	136.5	30.6	-166.9	70.3	0	0	0	116.3
569	K	30.5	Very low	28.9	Very low	167 Å²	167	143.5 Å²	143.5	73%	0.726	69%	0.692	S	S	*	*			trans	62	152	149.5	-72.8	172.9	-173.5	170.5	0	121.4
570	K	30.6	Very low	29.7	Very low	164 Å²	164	140.1 Å²	140.1	71%	0.713	69%	0.689	S	S	*	*			cis	88.1	150.8	41.4	-124.5	-175.3	174.1	-149.6	0	111.8
571	Q	25.9	Very low	29.7	Very low	154 Å²	154	141.2 Å²	141.2	72%	0.72	70%	0.696	S	S	*	*			cis	-159.5	166.9	14	-166.9	161.8	-28	0	0	114.8
572	K	26.7	Very low	29.7	Very low	194 Å²	194	139.1 Å²	139.1	84%	0.843	70%	0.698	S	S	*	*			trans	-64	153	-179.5	-172.6	-177	-169.2	178.1	0	119.6
573	R	30	Very low	29.5	Very low	225 Å²	225	137.1 Å²	137.1	85%	0.849	71%	0.706	S	S	*	*			trans	137.8	158.3	155.2	-88.9	-171.4	150.9	179.7	-7.3	111.9
574	M	23.7	Very low	29.2	Very low	149 Å²	149	139.5 Å²	139.5	73%	0.734	71%	0.711	S	S	*	*			cis	-144.3	-152	1.1	-137.3	169.5	77.5	0	0	113.8
575	S	27.1	Very low	28.9	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	73%	0.734	S	S	*	*			trans	-129.9	168	-159.7	52.7	0	0	0	0	115.3
576	N	26.5	Very low	28.5	Very low	138 Å²	138	148 Å²	148	74%	0.738	75%	0.753	S	S	*	*				148.7	167.5	117	-153.7	15.4	0	0	0	115.9
577	I	27.7	Very low	28	Very low	138 Å²	138	143.2 Å²	143.2	71%	0.708	75%	0.745	S	S	*	*			trans	76.9	123.8	162.1	-66.4	154.9	0	0	0	116.5
578	Q	28.1	Very low	27.7	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	75%	0.748	S	S	*	*				73.4	140	60.4	-119.1	90	3.4	0	0	114.3
579	G	27.5	Very low	27.7	Very low	65 Å²	65	147 Å²	147	67%	0.67	76%	0.759	S	S	*	*			cis	-161.2	-130	5.1	0	0	0	0	0	113.7
580	P	41.4	Very low	27.8	Very low	116 Å²	116	145.4 Å²	145.4	75%	0.753	75%	0.754	S	S	*	*				-136.9	-157.9	-102	38.8	-20.5	0	0	0	115.8
581	I	27.6	Very low	27.5	Very low	147 Å²	147	145 Å²	145	75%	0.754	75%	0.753	S	S	*	*			trans	80.3	123.9	166.7	-62.6	155.9	0	0	0	114.9
582	S	25	Very low	27.9	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	75%	0.752	S	S	*	*			cis	98.3	130.4	15.1	84.4	0	0	0	0	116.9
583	G	25.8	Very low	27.8	Very low	78 Å²	78	141 Å²	141	80%	0.804	75%	0.749	S	S	*	*			trans	123.3	104.1	159.6	0	0	0	0	0	115.9
584	F	24.4	Very low	27.6	Very low	178 Å²	178	135.5 Å²	135.5	78%	0.781	75%	0.745	S	S	*	*				-166.6	79.4	119.2	-159.2	-96.7	0	0	0	110.6	A587	F584-A587 HydrophobicContact CE1-CB 3.78Å; F584-A587 HydrophobicContact CZ-CB 3.7Å
585	E	26.4	Very low	27.7	Very low	192 Å²	192	132.7 Å²	132.7	90%	0.897	75%	0.745	S	S	*	*			trans	-129.4	64.9	171	-172.3	170.2	-150.3	0	0	109.3
586	E	26.5	Very low	27.5	Very low	186 Å²	186	135 Å²	135	87%	0.869	75%	0.751	S	S	*	*			trans	-166.5	75.5	168.2	-127.6	175	-156.5	0	0	111.2
587	A	24.6	Very low	27.5	Very low	67 Å²	67	139 Å²	139	55%	0.554	76%	0.756	S	S	*	*	S	Bend	trans	-166.1	16.3	165.1	0	0	0	0	0	117.5	F584	F584-A587 HydrophobicContact CE1-CB 3.78Å; F584-A587 HydrophobicContact CZ-CB 3.7Å
588	F	26	Very low	27.3	Very low	161 Å²	161	139.4 Å²	139.4	71%	0.706	76%	0.759	S	S	*	*			trans	-149.4	46.7	164.9	-137	-105.7	0	0	0	115.5	Q590	F588-Q590 HydrophobicContact CD1-CB 3.95Å; F588-Q590 HydrophobicContact CD2-CB 4.18Å; F588-Q590 HydrophobicContact CD2-CG 4.13Å; F588-Q590 HydrophobicContact CE1-CB 3.65Å; F588-Q590 HydrophobicContact CE2-CB 3.88Å; F588-Q590 HydrophobicContact CE2-CG 3.91Å; F588-Q590 HydrophobicContact CG-CB 4.22Å; F588-Q590 HydrophobicContact CZ-CB 3.6Å; F588-Q590 HydrophobicContact CZ-CG 4.15Å; F588-Q590 PolarHBondContact O-N 3.07Å
589	E	30.7	Very low	27.3	Very low	189 Å²	189	137 Å²	137	88%	0.883	76%	0.756	S	S	*	*			trans	-71.8	56	151.2	-162.1	175.5	-139.3	0	0	110.2	F591	E589-F591 VanDerWaalsContact C-N 3.33Å
590	Q	31.9	Very low	27.3	Very low	135 Å²	135	140.2 Å²	140.2	63%	0.631	76%	0.758	S	S	*	*			trans	-104.4	48.4	168.6	-67.3	-164	8.8	0	0	110.7	F588 A592	F588-Q590 HydrophobicContact CD1-CB 3.95Å; F588-Q590 HydrophobicContact CD2-CB 4.18Å; F588-Q590 HydrophobicContact CD2-CG 4.13Å; F588-Q590 HydrophobicContact CE1-CB 3.65Å; F588-Q590 HydrophobicContact CE2-CB 3.88Å; F588-Q590 HydrophobicContact CE2-CG 3.91Å; F588-Q590 HydrophobicContact CG-CB 4.22Å; F588-Q590 HydrophobicContact CZ-CB 3.6Å; F588-Q590 HydrophobicContact CZ-CG 4.15Å; F588-Q590 PolarHBondContact O-N 3.07Å; Q590-A592 PolarHBondContact O-N 3.27Å
591	F	24.4	Very low	26.6	Very low	156 Å²	156	140.1 Å²	140.1	68%	0.684	76%	0.755	S	S	*	*				24.9	98.5	127.7	-164.3	-84.8	0	0	0	116.8	E589 K593	E589-F591 VanDerWaalsContact C-N 3.33Å; F591-K593 PolarHBondContact O-N 3.43Å
592	A	33.2	Very low	26.5	Very low	86 Å²	86	138.3 Å²	138.3	71%	0.711	76%	0.756	S	S	*	*	S	Bend	trans	41.8	54.4	143.2	0	0	0	0	0	117.7	Q590	Q590-A592 PolarHBondContact O-N 3.27Å
593	K	26.3	Very low	26.6	Very low	176 Å²	176	137.9 Å²	137.9	77%	0.765	75%	0.753	S	S	*	*			trans	-149.8	141.6	156.1	-79.3	109.7	178.3	-174.5	0	106.9	F591	F591-K593 PolarHBondContact O-N 3.43Å
594	S	25.7	Very low	26.6	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	75%	0.752	S	S	*	*			cis	-163.6	158.3	3.9	46.2	0	0	0	0	111.7
595	A	24.9	Very low	26.6	Very low	90 Å²	90	139.3 Å²	139.3	74%	0.744	74%	0.742	S	S	*	*			trans	25.7	117.6	143.3	0	0	0	0	0	121.6
596	N	23.3	Very low	26.6	Very low	142 Å²	142	135.9 Å²	135.9	76%	0.759	73%	0.73	S	S	*	*				64.7	143.9	107.1	-150.2	1.1	0	0	0	121.1
597	R	25.4	Very low	26.6	Very low	222 Å²	222	132.9 Å²	132.9	84%	0.838	72%	0.716	S	S	*	*			trans	84	133.1	-179.9	-56.5	172.1	176.2	179.2	-2.6	114.7
598	N	25.2	Very low	26.6	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	73%	0.725	S	S	*	*			cis	101.4	158.8	29.5	-80.3	22.5	0	0	0	113.4
599	V	28	Very low	26.6	Very low	128 Å²	128	136.8 Å²	136.8	78%	0.776	73%	0.732	S	S	*	*			trans	89.7	135.5	167.6	-172.9	0	0	0	0	115.9
600	D	26.1	Very low	26.3	Very low	131 Å²	131	131.7 Å²	131.7	70%	0.701	72%	0.717	S	S	*	*			cis	-176.1	176.9	-39.8	-97	-41.9	0	0	0	108
601	T	27.6	Very low	25.9	Very low	114 Å²	114	133.8 Å²	133.8	70%	0.699	73%	0.729	S	S	*	*				-175.9	120.2	-50.6	-82.5	0	0	0	0	108.6
602	S	26.2	Very low	25.9	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	73%	0.731	S	S	*	*			trans	-150	112	162.5	28.8	0	0	0	0	110.1
603	S	25.4	Very low	25.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	73%	0.73	S	S	*	*				72.7	136	61.4	79.9	0	0	0	0	111.9
604	I	26.5	Very low	25.3	Very low	152 Å²	152	134.7 Å²	134.7	78%	0.779	73%	0.731	S	S	*	*			cis	-131.9	130.6	29.4	-68.3	168.4	0	0	0	108.4
605	K	25.1	Very low	25.2	Very low	134 Å²	134	135.3 Å²	135.3	58%	0.583	73%	0.73	S	S	*	*				68.5	151.8	74.1	-96.5	177.3	166	-72.2	0	114.6	E607	K605-E607 WeakPolarHBondContact CE-OE1 3.21Å; K605-E607 WeakPolarHBondContact CG-OE1 3.22Å; K605-E607 IonicContact NZ-OE1 2.71Å; K605-E607 PolarHBondContact NZ-OE1 3.4Å; K605-E607 IonicContact NZ-OE2 2.71Å; K605-E607 PolarHBondContact NZ-OE2 3.15Å
606	N	26.6	Very low	25.2	Very low	120 Å²	120	135 Å²	135	64%	0.642	73%	0.727	S	S	*	*			cis	-108.1	-138.2	9.2	-144.8	75.9	0	0	0	115.1
607	E	25.1	Very low	25.3	Very low	122 Å²	122	136.6 Å²	136.6	57%	0.57	73%	0.73	S	S	*	*			trans	-154.6	155.3	-153	-71.9	122.7	-163	0	0	109.9	K605	K605-E607 WeakPolarHBondContact CE-OE1 3.21Å; K605-E607 WeakPolarHBondContact CG-OE1 3.22Å; K605-E607 IonicContact NZ-OE1 2.71Å; K605-E607 PolarHBondContact NZ-OE1 3.4Å; K605-E607 IonicContact NZ-OE2 2.71Å; K605-E607 PolarHBondContact NZ-OE2 3.15Å
608	D	25.8	Very low	25.3	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	73%	0.726	S	S	*	*			cis	-136.7	-109.8	-12.7	-171.4	32.6	0	0	0	110.1
609	M	26.3	Very low	25.2	Very low	171 Å²	171	133.5 Å²	133.5	84%	0.842	73%	0.725	S	S	*	*			cis	-149.7	156.3	-0.7	-149.7	-165	89.9	0	0	111.4
610	S	23.4	Very low	24.9	Very low	81 Å²	81	133.1 Å²	133.1	57%	0.566	72%	0.722	S	S	*	*			trans	-133.7	172.6	-176.1	63.5	0	0	0	0	113.1
611	M	24	Very low	24.9	Very low	179 Å²	179	136.4 Å²	136.4	88%	0.882	73%	0.731	S	S	*	*			trans	-172.6	165.6	131.9	-105.3	-165.9	77.5	0	0	113.5
612	E	23.1	Very low	24.6	Very low	158 Å²	158	138 Å²	138	74%	0.738	74%	0.74	S	S	*	*			trans	-120.6	155.4	-164.7	-66.9	-173.6	118.2	0	0	115.4
613	I	25.2	Very low	24.5	Very low	132 Å²	132	141 Å²	141	68%	0.677	74%	0.74	S	S	*	*			trans	32.9	123.5	134.7	-52.2	164.2	0	0	0	119
614	N	23.6	Very low	24.3	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	74%	0.744	S	S	*	*			trans	159	154.4	138.2	-91.2	-60.4	0	0	0	110.1
615	T	22.7	Very low	24.2	Very low	123 Å²	123	144.7 Å²	144.7	76%	0.755	74%	0.742	S	S	*	*			cis	-155.7	165.8	-23.8	-115.4	0	0	0	0	109.7
616	A	24.7	Very low	24.1	Very low	83 Å²	83	146.2 Å²	146.2	69%	0.686	75%	0.753	S	S	*	*			trans	-51.6	157.9	-169.1	0	0	0	0	0	119.4
617	Q	25.8	Very low	24.3	Very low	175 Å²	175	145.6 Å²	145.6	82%	0.818	76%	0.756	S	S	*	*				-173.8	139.3	116.5	-99.3	168.8	24.3	0	0	116.3
618	Q	24.9	Very low	24.1	Very low	162 Å²	162	149.6 Å²	149.6	76%	0.757	77%	0.771	S	S	*	*			trans	55.3	130.4	143	-72.7	-174.2	-1.2	0	0	126.3
619	L	24	Very low	24.5	Very low	142 Å²	142	150.6 Å²	150.6	74%	0.743	77%	0.771	S	S	*	*			trans	87.6	126.1	136.9	-69.9	165.6	0	0	0	124.5
620	T	21.3	Very low	24.3	Very low	119 Å²	119	147.4 Å²	147.4	73%	0.73	76%	0.761	S	S	*	*			trans	68.6	106.3	146	45.8	0	0	0	0	124.3
621	F	24.8	Very low	25	Very low	200 Å²	200	149.2 Å²	149.2	88%	0.877	76%	0.759	S	S	*	*			trans	35.7	127	138.2	-82.2	-81.2	0	0	0	123.6
622	T	22.3	Very low	25.2	Very low	147 Å²	147	144.4 Å²	144.4	90%	0.902	73%	0.733	S	S	*	*				-156.6	-176.9	126.2	-1.2	0	0	0	0	113.4
623	K	23.6	Very low	25.3	Very low	175 Å²	175	140.8 Å²	140.8	76%	0.761	73%	0.725	S	S	*	*			trans	-96.8	149.9	-157	-72.1	175.1	178.1	169.8	0	116.7
624	M	22.5	Very low	25.5	Very low	157 Å²	157	141.1 Å²	141.1	77%	0.773	72%	0.718	S	S	*	*			trans	64.3	157.5	142.5	-72.5	179.1	-177.6	0	0	118.5
625	K	22.5	Very low	25.9	Very low	170 Å²	170	141 Å²	141	74%	0.739	71%	0.707	S	S	*	*			cis	-146.8	135	-6.8	-115.2	164.8	-178.7	179.7	0	105.8
626	M	24.5	Very low	26.5	Very low	167 Å²	167	142.1 Å²	142.1	82%	0.823	70%	0.703	S	S	*	*				48.9	145	98.7	-66.6	-69.5	-81.6	0	0	116.8
627	P	29.3	Very low	26.9	Very low	106 Å²	106	142.6 Å²	142.6	69%	0.688	70%	0.699	S	S	*	*			cis	-130.1	170.8	-2	41.3	-26.5	0	0	0	114.9
628	K	22	Very low	27.5	Very low	207 Å²	207	139.2 Å²	139.2	90%	0.9	69%	0.686	S	S	*	*			trans	-139.4	140.8	146.2	-79	-161.7	174.9	-178	0	110.3
629	E	33.9	Very low	28.5	Very low	160 Å²	160	133.3 Å²	133.3	75%	0.748	66%	0.663	S	S	*	*			trans	-65.8	148.6	179.6	-61.3	168.8	83.1	0	0	112.4
630	V	22.3	Very low	29.5	Very low	105 Å²	105	136 Å²	136	64%	0.636	67%	0.669	S	S	*	*			trans	-137.3	123.7	153.4	-175.9	0	0	0	0	107.3	K632	V630-K632 HydrophobicContact CG1-CD 3.82Å
631	K	38.1	Very low	30.6	Very low	119 Å²	119	135.2 Å²	135.2	52%	0.517	67%	0.665	S	S	.	*			trans	-82.2	-141.6	-177.7	-67.2	176.9	168	173.3	0	111	Q428	Q428-K631 WeakPolarHBondContact O-CE 3.31Å; Q428-K631 PolarHBondContact O-NZ 2.9Å
632	K	28.5	Very low	31.7	Very low	77 Å²	77	126.6 Å²	126.6	34%	0.335	63%	0.629	S	S	.	*			trans	85	157.7	159.5	-41.5	155.3	-176.3	174.6	0	115	V630 T749 E750 P751	V630-K632 HydrophobicContact CG1-CD 3.82Å; K632-T749 WeakPolarHBondContact CD-O 3.34Å; K632-T749 WeakPolarHBondContact CE-O 2.99Å; K632-T749 PolarHBondContact NZ-O 3.04Å; K632-T749 PolarHBondContact NZ-OG1 3.13Å; K632-E750 WeakPolarHBondContact CE-OE1 3.45Å; K632-E750 WeakPolarHBondContact CE-OE2 3.4Å; K632-E750 IonicContact NZ-OE1 3.16Å; K632-E750 PolarHBondContact NZ-OE1 2.72Å; K632-E750 IonicContact NZ-OE2 2.71Å; K632-E750 PolarHBondContact NZ-OE2 3.31Å; K632-P751 HydrophobicContact CG-CG 4.32Å
633	S	25.7	Very low	33.1	Very low	82 Å²	82	125 Å²	125	57%	0.573	61%	0.613	S	S	*	*			cis	-158.6	152.7	-23.6	170.1	0	0	0	0	109.2
634	R	28.7	Very low	34.9	Very low	140 Å²	140	118.6 Å²	118.6	53%	0.528	58%	0.584	S	S	.	*			trans	-62.3	145.5	165.5	-77.1	172.1	152.6	159.4	-10.6	112	S410 D412	S410-R634 PolarHBondContact OG-NE 3.04Å; S410-R634 PolarHBondContact OG-NH2 2.89Å; D412-R634 VanDerWaalsContact CB-NH2 3.3Å; D412-R634 VanDerWaalsContact CG-NH2 3.31Å; D412-R634 IonicContact OD1-CZ 3.59Å; D412-R634 VanDerWaalsContact OD1-CZ 3.24Å; D412-R634 IonicContact OD1-NH1 2.93Å; D412-R634 PolarHBondContact OD1-NH1 2.99Å; D412-R634 IonicContact OD1-NH2 3.61Å; D412-R634 PolarHBondContact OD1-NH2 3.08Å; D412-R634 IonicContact OD2-NH1 2.69Å
635	R	32.7	Very low	37	Very low	146 Å²	146	112.6 Å²	112.6	55%	0.551	56%	0.557	S	S	*	*				-175.7	141.5	128.9	-97.2	174	-160.2	-106	-1.6	109.8	M740	R635-M740 WeakPolarHBondContact CD-SD 3.48Å; R635-M740 PolarHBondContact NH1-SD 2.87Å; R635-M740 VanDerWaalsContact NH1-SD 3.36Å
636	H	34.9	Very low	38.8	Very low	145 Å²	145	105.4 Å²	105.4	67%	0.671	53%	0.528	S	S	*	.			trans	-83.5	156.6	169.5	-102.7	-91.4	0	0	0	111
637	P	32.8	Very low	40.6	Very low	94 Å²	94	101 Å²	101	61%	0.61	51%	0.508	S	S	*	.			trans	-69.3	128.3	171.9	-18.1	32.6	0	0	0	113	S639 D904	P637-S639 VanDerWaalsContact C-N 3.26Å; P637-D904 VanDerWaalsContact CA-CG 3.47Å; P637-D904 VanDerWaalsContact CA-OD1 3.27Å; P637-D904 WeakPolarHBondContact CA-OD1 3.35Å
638	L	37.3	Very low	42.4	Very low	104 Å²	104	98.1 Å²	98.1	55%	0.545	49%	0.49	S	S	.	.	S	Bend	trans	-72.6	-15.8	169.6	-60.9	171.2	0	0	0	112.9	M740 P902 D904	L638-M740 HydrophobicContact CD1-CE 4.49Å; L638-M740 HydrophobicContact CD1-SD 4.48Å; L638-P902 HydrophobicContact CD1-CB 4.44Å; L638-D904 WeakPolarHBondContact CB-OD1 3.18Å; L638-D904 PolarHBondContact N-OD1 3.06Å; L638-D904 PolarHBondContact N-OD2 2.92Å
639	S	47.8	Very low	44.8	Very low	38 Å²	38	90.8 Å²	90.8	27%	0.266	46%	0.46	S	S	.	.	S	Bend	trans	-156.2	159.7	-168.2	64.2	0	0	0	0	113.2	P637 D904	P637-S639 VanDerWaalsContact C-N 3.26Å; S639-D904 WeakPolarHBondContact CA-OD2 3.29Å; S639-D904 WeakPolarHBondContact CB-OD2 3.44Å; S639-D904 PolarHBondContact N-OD2 3.34Å; S639-D904 PolarHBondContact OG-OD2 3.46Å
640	K	44.6	Very low	46.7	Very low	199 Å²	199	84.9 Å²	84.9	87%	0.865	44%	0.435	S	S	*	.	S	Bend	trans	-63.1	129.6	159.3	-69.2	-172.3	178.2	-175.4	0	107.6
641	P	42.8	Very low	48.9	Very low	102 Å²	102	88.7 Å²	88.7	66%	0.662	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-58.7	144.2	-174.5	23.8	-34.1	0	0	0	110.8	M643	P641-M643 PolarHBondContact O-N 2.84Å
642	P	48.1	Very low	50	Low	19 Å²	19	86 Å²	86	12%	0.123	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-59.2	126.7	179.6	24.7	-33.4	0	0	0	109.5	R644 T880 Y907	P642-R644 PolarHBondContact O-N 3.36Å; P642-T880 HydrophobicContact CB-CG2 4.04Å; P642-Y907 HydrophobicContact CG-CD2 3.81Å; P642-Y907 HydrophobicContact CG-CG 4.28Å
643	M	51.8	Low	50.9	Low	114 Å²	114	88.3 Å²	88.3	56%	0.562	45%	0.448	S	S	*	.	S	Bend	trans	-53.9	-26.7	-177	-54.6	168.7	81.8	0	0	111.9	P641 H881 E882	P641-M643 PolarHBondContact O-N 2.84Å; M643-H881 PolarHBondContact SD-ND1 2.91Å; M643-E882 HydrophobicContact CB-CG 3.6Å; M643-E882 HydrophobicContact CE-CG 3.85Å; M643-E882 HydrophobicContact CG-CG 4.49Å; M643-E882 HydrophobicContact SD-CG 4.3Å
644	R	63.1	Low	51.7	Low	39 Å²	39	90.6 Å²	90.6	15%	0.147	46%	0.461	C	S	.	.	S	Bend	trans	-125.5	128.3	172.6	-171	176.2	177.6	-72.8	-12.3	111.7	P642 P646 S648 V650 T880	P642-R644 PolarHBondContact O-N 3.36Å; R644-P646 WeakPolarHBondContact O-CD 3.24Å; R644-S648 VanDerWaalsContact CZ-O 3.26Å; R644-S648 PolarHBondContact NH1-O 2.94Å; R644-S648 PolarHBondContact NH1-OG 2.81Å; R644-S648 PolarHBondContact NH2-O 2.94Å; R644-S648 PolarHBondContact NH2-OG 3.25Å; R644-V650 VanDerWaalsContact NH2-CG2 3.29Å; R644-T880 PolarHBondContact N-O 2.91Å
645	S	65.9	Low	52	Low	31 Å²	31	88.8 Å²	88.8	22%	0.217	47%	0.465	C	S	.	.			trans	-54.6	122.4	174.7	166.6	0	0	0	0	112.3	L647 S648 Y907	S645-L647 PolarHBondContact O-N 3.47Å; S645-L647 PolarHBondContact OG-N 3.5Å; S645-S648 PolarHBondContact O-N 3.23Å; S645-S648 PolarHBondContact O-OG 2.98Å; S645-Y907 WeakPolarHBondContact CB-OH 3.44Å; S645-Y907 WeakPolarHBondContact OG-CE1 3.39Å; S645-Y907 PolarHBondContact OG-OH 3.47Å; S645-Y907 VanDerWaalsContact OG-OH 3.1Å
646	P	59.5	Low	51.9	Low	19 Å²	19	87.4 Å²	87.4	12%	0.123	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-29.8	172.7	-29.8	35.2	0	0	0	115.2	R644 S648 P834 R856 T880 Y907	R644-P646 WeakPolarHBondContact O-CD 3.24Å; P646-S648 VanDerWaalsContact C-N 3.29Å; P646-S648 PolarHBondContact O-N 3.39Å; P646-P834 HydrophobicContact CB-CG 3.82Å; P646-R856 PolarHBondContact O-NH2 2.88Å; P646-T880 HydrophobicContact CG-CG2 4Å; P646-Y907 HydrophobicContact CG-CD1 4.09Å; P646-Y907 HydrophobicContact CG-CG 4.1Å
647	L	62.5	Low	51.9	Low	76 Å²	76	88.8 Å²	88.8	40%	0.398	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.6	177.1	-70.7	171.1	0	0	0	112.6	S645 P834 E835 Y907	S645-L647 PolarHBondContact O-N 3.47Å; S645-L647 PolarHBondContact OG-N 3.5Å; L647-P834 HydrophobicContact CD2-CB 3.69Å; L647-P834 HydrophobicContact CG-CB 4.34Å; L647-E835 HydrophobicContact CD2-CG 3.97Å; L647-Y907 HydrophobicContact CD1-CE1 4.1Å; L647-Y907 HydrophobicContact CG-CE1 4.28Å
648	S	67.7	Low	52	Low	44 Å²	44	92.9 Å²	92.9	31%	0.308	49%	0.489	S	S	.	.	S	Bend	trans	-76.5	135.8	175.7	67.8	0	0	0	0	110.7	R644 S645 P646	R644-S648 VanDerWaalsContact CZ-O 3.26Å; R644-S648 PolarHBondContact NH1-O 2.94Å; R644-S648 PolarHBondContact NH1-OG 2.81Å; R644-S648 PolarHBondContact NH2-O 2.94Å; R644-S648 PolarHBondContact NH2-OG 3.25Å; S645-S648 PolarHBondContact O-N 3.23Å; S645-S648 PolarHBondContact O-OG 2.98Å; P646-S648 VanDerWaalsContact C-N 3.29Å; P646-S648 PolarHBondContact O-N 3.39Å
649	I	72.9	Confident	51.8	Low	54 Å²	54	95.6 Å²	95.6	28%	0.277	50%	0.498	S	S	.	.			trans	-106.6	123.2	179	-58.4	172	0	0	0	109	P853 N855 R856 L859	I649-P853 HydrophobicContact CD1-CG 4.22Å; I649-N855 HydrophobicContact CD1-CB 3.69Å; I649-R856 HydrophobicContact CD1-CG 3.71Å; I649-R856 HydrophobicContact CG1-CG 4.37Å; I649-L859 HydrophobicContact CG2-CD1 4.28Å; I649-L859 HydrophobicContact CG2-CD2 4.4Å
650	V	73.5	Confident	51.2	Low	35 Å²	35	99.6 Å²	99.6	21%	0.212	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-77.8	129.6	168.7	-157.5	0	0	0	0	106.6	R644 Q652 Q878 A885	R644-V650 VanDerWaalsContact NH2-CG2 3.29Å; V650-Q652 PolarHBondContact O-N 2.98Å; V650-Q878 PolarHBondContact O-NE2 3.44Å; V650-A885 HydrophobicContact CB-CB 3.96Å; V650-A885 HydrophobicContact CG1-CB 3.94Å
651	K	68.8	Low	50.4	Low	185 Å²	185	94.6 Å²	94.6	80%	0.804	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-59.8	131.7	163.3	-71.9	-173.2	176.4	-176.5	0	107.8
652	Q	61.4	Low	49.9	Very low	63 Å²	63	94.5 Å²	94.5	29%	0.294	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-78.8	122.2	165.7	-60.9	-173.7	-60.6	0	0	106.5	V650 L859 A885 S887	V650-Q652 PolarHBondContact O-N 2.98Å; Q652-L859 HydrophobicContact CG-CD2 3.89Å; Q652-A885 HydrophobicContact CG-CB 4.32Å; Q652-A885 PolarHBondContact NE2-O 2.78Å; Q652-S887 PolarHBondContact NE2-OG 3.33Å
653	D	46.8	Very low	49	Very low	126 Å²	126	102.5 Å²	102.5	67%	0.674	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60.1	147.9	173.1	-64	-58.3	0	0	0	110	T655	D653-T655 PolarHBondContact O-N 3.2Å
654	P	42.6	Very low	47.8	Very low	129 Å²	129	104.7 Å²	104.7	84%	0.838	55%	0.554	S	S	*	*			trans	-74.6	64.4	176.1	32.9	-35.7	0	0	0	110.3	T656	P654-T656 PolarHBondContact O-N 2.87Å
655	T	33.8	Very low	46.3	Very low	102 Å²	102	108.4 Å²	108.4	63%	0.626	58%	0.584	S	S	*	*			trans	-57.7	124.9	176.9	54.2	0	0	0	0	110	D653 E657	D653-T655 PolarHBondContact O-N 3.2Å; T655-E657 PolarHBondContact O-N 3.14Å
656	T	32.2	Very low	44.7	Very low	118 Å²	118	112.7 Å²	112.7	72%	0.724	60%	0.602	S	S	*	*			trans	-46.2	132.8	179.5	-41.9	0	0	0	0	111.3	P654 K658 E659	P654-T656 PolarHBondContact O-N 2.87Å; T656-K658 PolarHBondContact O-N 3.18Å; T656-E659 PolarHBondContact O-N 2.92Å
657	E	33.8	Very low	43.7	Very low	174 Å²	174	116.1 Å²	116.1	81%	0.813	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-10.6	-166.3	-56.2	-172	126.2	0	0	115.4	T655 L660	T655-E657 PolarHBondContact O-N 3.14Å; E657-L660 PolarHBondContact O-N 3.34Å
658	K	34.5	Very low	42.4	Very low	180 Å²	180	116 Å²	116	78%	0.783	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-34	-174.8	-136	170.5	-174.2	176.6	0	114.2	T656 S661	T656-K658 PolarHBondContact O-N 3.18Å; K658-S661 PolarHBondContact O-OG 3.4Å
659	E	34	Very low	41.2	Very low	161 Å²	161	116.6 Å²	116.6	75%	0.752	63%	0.629	S	S	*	*	S	Bend	trans	-78.2	-19.7	179.4	-65.4	-158.8	137.6	0	0	113.3	T656 S661	T656-E659 PolarHBondContact O-N 2.92Å; E659-S661 PolarHBondContact O-N 3.39Å
660	L	34.3	Very low	39.8	Very low	121 Å²	121	115.6 Å²	115.6	63%	0.634	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	31.9	179.2	-156.7	70.1	0	0	0	112.7	E657	E657-L660 PolarHBondContact O-N 3.34Å
661	S	28.7	Very low	38.3	Very low	95 Å²	95	120.3 Å²	120.3	66%	0.664	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-8.3	-173.5	60.2	0	0	0	0	114.3	K658 E659 Q663	K658-S661 PolarHBondContact O-OG 3.4Å; E659-S661 PolarHBondContact O-N 3.39Å; S661-Q663 PolarHBondContact O-N 2.98Å; S661-Q663 VanDerWaalsContact O-N 3.14Å
662	S	31.4	Very low	37.2	Very low	100 Å²	100	119.9 Å²	119.9	70%	0.699	64%	0.639	S	S	*	*			trans	-79.7	92.4	171.8	54.1	0	0	0	0	111.1	M664	S662-M664 PolarHBondContact O-N 3.14Å
663	Q	29.9	Very low	36.9	Very low	187 Å²	187	118.8 Å²	118.8	87%	0.874	63%	0.634	S	S	*	*			trans	-59.2	112.3	166.9	-75.8	-174.1	-12.7	0	0	109.5	S661	S661-Q663 PolarHBondContact O-N 2.98Å; S661-Q663 VanDerWaalsContact O-N 3.14Å
664	M	27.4	Very low	37.3	Very low	159 Å²	159	117.1 Å²	117.1	78%	0.783	62%	0.622	S	S	*	*			trans	-61.2	137.8	157.8	-69.7	-88.8	76.5	0	0	107.8	S662 M666	S662-M664 PolarHBondContact O-N 3.14Å; M664-M666 PolarHBondContact O-N 3.34Å
665	P	31.5	Very low	38	Very low	118 Å²	118	116.1 Å²	116.1	77%	0.766	61%	0.606	S	S	*	*			trans	-56.4	118.6	179.9	-26.1	34.9	0	0	0	111.2	D667	P665-D667 PolarHBondContact O-N 3.24Å
666	M	32.3	Very low	39.5	Very low	121 Å²	121	111.6 Å²	111.6	60%	0.596	58%	0.578	S	S	*	*			trans	-63.3	100.6	167.5	-92.1	-73.1	-148.5	0	0	108.4	M664 M670	M664-M666 PolarHBondContact O-N 3.34Å; M666-M670 HydrophobicContact CE-SD 4.38Å; M666-M670 HydrophobicContact SD-CB 3.94Å; M666-M670 HydrophobicContact SD-SD 3.9Å
667	D	37.9	Very low	41.4	Very low	90 Å²	90	107.7 Å²	107.7	48%	0.481	55%	0.55	S	S	.	*			trans	-57.7	141	174.8	-169.2	-4.4	0	0	0	109.7	P665 S669 M670	P665-D667 PolarHBondContact O-N 3.24Å; D667-S669 PolarHBondContact O-N 2.84Å; D667-M670 PolarHBondContact O-N 3.29Å
668	S	34.3	Very low	42.7	Very low	74 Å²	74	101.8 Å²	101.8	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-52.7	-22.8	-173.5	65.4	0	0	0	0	114.1
669	S	44	Very low	44	Very low	57 Å²	57	98 Å²	98	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-37.5	175.8	-158.1	0	0	0	0	113.5	D667 K672	D667-S669 PolarHBondContact O-N 2.84Å; S669-K672 PolarHBondContact O-N 3.17Å
670	M	42.1	Very low	45.5	Very low	32 Å²	32	94.4 Å²	94.4	16%	0.158	49%	0.492	C	S	.	.	H	α-helix	trans	-72.6	-32.8	-179.8	-87.3	-160.6	161.8	0	0	113.3	M666 D667 K672 Q673 W677 I895	M666-M670 HydrophobicContact CE-SD 4.38Å; M666-M670 HydrophobicContact SD-CB 3.94Å; M666-M670 HydrophobicContact SD-SD 3.9Å; D667-M670 PolarHBondContact O-N 3.29Å; M670-K672 PolarHBondContact O-N 2.82Å; M670-Q673 PolarHBondContact O-N 3.21Å; M670-Q673 VanDerWaalsContact O-N 3.08Å; M670-W677 HydrophobicContact CE-CH2 4.42Å; M670-W677 HydrophobicContact CE-CZ2 4.18Å; M670-W677 HydrophobicContact SD-CZ2 4.34Å; M670-I895 HydrophobicContact CE-CB 3.8Å; M670-I895 HydrophobicContact CE-CG2 3.47Å; M670-I895 VanDerWaalsContact CE-CG2 3.47Å; M670-I895 HydrophobicContact CG-CG2 4.17Å
671	K	42.4	Very low	47.2	Very low	135 Å²	135	93.1 Å²	93.1	59%	0.587	49%	0.493	S	S	*	.	H	α-helix	trans	-63.9	-30.2	173.3	-68.3	-167.9	175.2	-173	0	112.7	Q673 E674	K671-Q673 PolarHBondContact O-N 2.95Å; K671-Q673 VanDerWaalsContact O-N 3.13Å; K671-E674 WeakPolarHBondContact CA-OE1 3.31Å; K671-E674 WeakPolarHBondContact O-CG 3.21Å
672	K	46.5	Very low	49.5	Very low	176 Å²	176	92 Å²	92	77%	0.765	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	1	174.3	-66.9	178.3	179.4	178.9	0	113.8	S669 M670	S669-K672 PolarHBondContact O-N 3.17Å; M670-K672 PolarHBondContact O-N 2.82Å
673	Q	54.6	Low	51.9	Low	40 Å²	40	89.9 Å²	89.9	19%	0.187	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	9.3	-176.5	-69.4	-173.8	-15.5	0	0	113.9	M670 K671 H675 L676	M670-Q673 PolarHBondContact O-N 3.21Å; M670-Q673 VanDerWaalsContact O-N 3.08Å; K671-Q673 PolarHBondContact O-N 2.95Å; K671-Q673 VanDerWaalsContact O-N 3.13Å; Q673-H675 VanDerWaalsContact C-N 3.29Å; Q673-H675 PolarHBondContact O-N 2.83Å; Q673-H675 VanDerWaalsContact O-N 3.17Å; Q673-L676 HydrophobicContact CB-CD1 4.03Å; Q673-L676 HydrophobicContact CG-CD1 4.01Å; Q673-L676 WeakPolarHBondContact O-CB 3.31Å; Q673-L676 PolarHBondContact O-N 3.2Å
674	E	55.2	Low	54.4	Low	90 Å²	90	83.5 Å²	83.5	42%	0.421	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-50.9	-42.6	-175.8	-73.1	169.6	-165.7	0	0	113.2	K671 L676 W677 H680	K671-E674 WeakPolarHBondContact CA-OE1 3.31Å; K671-E674 WeakPolarHBondContact O-CG 3.21Å; E674-L676 PolarHBondContact O-N 3.13Å; E674-W677 PolarHBondContact O-N 2.86Å; E674-W677 VanDerWaalsContact O-N 3.17Å; E674-H680 PolarHBondContact O-CD2 2.91Å
675	H	58.3	Low	57	Low	108 Å²	108	81.8 Å²	81.8	50%	0.5	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-66.8	-5	177.1	-54.3	-55.4	0	0	0	116.1	Q673 N683 A686	Q673-H675 VanDerWaalsContact C-N 3.29Å; Q673-H675 PolarHBondContact O-N 2.83Å; Q673-H675 VanDerWaalsContact O-N 3.17Å; H675-N683 HydrophobicContact CB-CB 4.34Å; H675-A686 HydrophobicContact CB-CB 4.02Å
676	L	65.1	Low	59.4	Low	7 Å²	7	77.2 Å²	77.2	4%	0.037	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-95.4	-7.5	175.8	-57.3	174.9	0	0	0	112.9	Q673 E674 A686 E687 F690 L811 R812	Q673-L676 HydrophobicContact CB-CD1 4.03Å; Q673-L676 HydrophobicContact CG-CD1 4.01Å; Q673-L676 WeakPolarHBondContact O-CB 3.31Å; Q673-L676 PolarHBondContact O-N 3.2Å; E674-L676 PolarHBondContact O-N 3.13Å; L676-A686 HydrophobicContact CD2-CB 4.21Å; L676-E687 HydrophobicContact CD2-CG 4.12Å; L676-F690 HydrophobicContact CD1-CB 3.7Å; L676-F690 HydrophobicContact CD1-CD1 4.24Å; L676-F690 HydrophobicContact CD1-CD2 3.43Å; L676-F690 VanDerWaalsContact CD1-CD2 3.43Å; L676-F690 HydrophobicContact CD1-CE2 4.07Å; L676-F690 HydrophobicContact CD1-CG 3.52Å; L676-F690 HydrophobicContact CD2-CB 3.98Å; L676-F690 HydrophobicContact CD2-CG 4.38Å; L676-F690 HydrophobicContact CG-CB 4.5Å; L676-L811 HydrophobicContact CB-CD1 3.88Å; L676-L811 CarbonylContact O-C 3.56Å; L676-R812 WeakPolarHBondContact O-CB 3.2Å; L676-R812 PolarHBondContact O-N 2.78Å
677	W	70.5	Confident	61.9	Low	36 Å²	36	71.5 Å²	71.5	14%	0.136	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-88.1	143.4	-178.9	-63.7	81.9	0	0	0	111.3	M670 E674 N679 H680 N810 C864	M670-W677 HydrophobicContact CE-CH2 4.42Å; M670-W677 HydrophobicContact CE-CZ2 4.18Å; M670-W677 HydrophobicContact SD-CZ2 4.34Å; E674-W677 PolarHBondContact O-N 2.86Å; E674-W677 VanDerWaalsContact O-N 3.17Å; W677-N679 PolarHBondContact O-N 3.22Å; W677-H680 PolarHBondContact O-N 3.36Å; W677-N810 WeakPolarHBondContact CA-O 3.32Å; W677-C864 HydrophobicContact CH2-CB 4.3Å; W677-C864 HydrophobicContact CZ3-CB 3.67Å
678	R	62.2	Low	64.2	Low	50 Å²	50	71 Å²	71	19%	0.189	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-23.9	177.4	-176.8	167.1	-145.4	-175.1	9.9	115.3	H680 E805 N810 L871 N872	R678-H680 VanDerWaalsContact C-N 3.27Å; R678-H680 PolarHBondContact O-N 3.17Å; R678-E805 IonicContact CZ-OE2 2.69Å; R678-E805 IonicContact NE-OE1 2.73Å; R678-E805 IonicContact NE-OE2 2.71Å; R678-E805 PolarHBondContact NE-OE2 3.13Å; R678-E805 IonicContact NH2-OE2 2.79Å; R678-E805 PolarHBondContact NH2-OE2 3Å; R678-N810 HydrophobicContact CB-CB 3.94Å; R678-N810 PolarHBondContact N-O 3.39Å; R678-L871 HydrophobicContact CG-CD2 4.41Å; R678-N872 PolarHBondContact NH1-O 3.05Å
679	N	62.3	Low	66.5	Low	102 Å²	102	70.7 Å²	70.7	55%	0.545	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.5	-177.4	-58.4	2.1	0	0	0	113.3	W677	W677-N679 PolarHBondContact O-N 3.22Å
680	H	65.9	Low	68.5	Low	84 Å²	84	69.1 Å²	69.1	39%	0.389	35%	0.349	S	S	.	.	S	Bend	trans	-117.7	162.2	176.1	-62.1	-94.7	0	0	0	110.9	E674 W677 R678	E674-H680 PolarHBondContact O-CD2 2.91Å; W677-H680 PolarHBondContact O-N 3.36Å; R678-H680 VanDerWaalsContact C-N 3.27Å; R678-H680 PolarHBondContact O-N 3.17Å
681	S	69.6	Low	70.7	Confident	95 Å²	95	67.8 Å²	67.8	66%	0.664	34%	0.342	S	S	*	.			trans	-63.2	148.7	179.7	46.6	0	0	0	0	112.6	N683	S681-N683 PolarHBondContact O-N 3.15Å; S681-N683 VanDerWaalsContact O-N 3.15Å
682	P	75.7	Confident	72.8	Confident	71 Å²	71	63 Å²	63	46%	0.461	33%	0.328	S	S	.	.			trans	-58.6	118.1	179.8	-21	30.8	0	0	0	111.9	V803	P682-V803 HydrophobicContact CB-CG1 4.41Å; P682-V803 HydrophobicContact CG-CB 4.47Å; P682-V803 HydrophobicContact CG-CG1 4.41Å
683	N	83.2	Confident	74.5	Confident	55 Å²	55	57.6 Å²	57.6	29%	0.294	32%	0.316	S	S	.	.			trans	-120.2	87.6	177.7	-173.1	-21.6	0	0	0	110.5	H675 S681 L685 A686 E687	H675-N683 HydrophobicContact CB-CB 4.34Å; S681-N683 PolarHBondContact O-N 3.15Å; S681-N683 VanDerWaalsContact O-N 3.15Å; N683-L685 PolarHBondContact O-N 3.05Å; N683-L685 PolarHBondContact OD1-N 3.49Å; N683-A686 HydrophobicContact CB-CB 3.91Å; N683-A686 WeakPolarHBondContact O-CB 3.33Å; N683-A686 PolarHBondContact O-N 2.87Å; N683-A686 VanDerWaalsContact O-N 3.09Å; N683-A686 PolarHBondContact OD1-N 3.41Å; N683-E687 PolarHBondContact O-N 3.35Å
684	F	82.6	Confident	75.8	Confident	53 Å²	53	56.1 Å²	56.1	23%	0.232	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-26.8	-178.6	-172.4	-102.6	0	0	0	113.3	K688 C772 W802	F684-K688 VanDerWaalsContact O-CB 3.24Å; F684-K688 WeakPolarHBondContact O-CB 3.23Å; F684-K688 PolarHBondContact O-N 2.89Å; F684-C772 HydrophobicContact CE2-CB 3.97Å; F684-C772 HydrophobicContact CZ-CB 3.78Å; F684-W802 HydrophobicContact CD2-CB 4.01Å; F684-W802 HydrophobicContact CD2-CG 4.32Å; F684-W802 HydrophobicContact CE2-CB 4.26Å; F684-W802 HydrophobicContact CE2-CG 4.16Å
685	L	81.6	Confident	77.2	Confident	123 Å²	123	52.3 Å²	52.3	64%	0.644	29%	0.294	S	S	*	.	H	α-helix	trans	-73.5	-38.5	175.4	-175	60.7	0	0	0	111.8	N683 K688 S689	N683-L685 PolarHBondContact O-N 3.05Å; N683-L685 PolarHBondContact OD1-N 3.49Å; L685-K688 PolarHBondContact O-N 3.32Å; L685-S689 WeakPolarHBondContact O-CB 3.29Å; L685-S689 PolarHBondContact O-N 2.82Å; L685-S689 PolarHBondContact O-OG 3.17Å
686	A	80.4	Confident	78.3	Confident	22 Å²	22	49.6 Å²	49.6	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-43.8	170.1	0	0	0	0	0	111.3	H675 L676 N683 K688 S689 F690	H675-A686 HydrophobicContact CB-CB 4.02Å; L676-A686 HydrophobicContact CD2-CB 4.21Å; N683-A686 HydrophobicContact CB-CB 3.91Å; N683-A686 WeakPolarHBondContact O-CB 3.33Å; N683-A686 PolarHBondContact O-N 2.87Å; N683-A686 VanDerWaalsContact O-N 3.09Å; N683-A686 PolarHBondContact OD1-N 3.41Å; A686-K688 PolarHBondContact O-N 3.04Å; A686-S689 PolarHBondContact O-N 2.92Å; A686-F690 WeakPolarHBondContact O-CB 3.43Å; A686-F690 PolarHBondContact O-N 2.92Å
687	E	85.5	Confident	79.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-60.4	-42.9	174.6	-67.9	-173.5	-148.6	0	0	112.1	L676 N683 S689 F690 N691 R796 R812 G813	L676-E687 HydrophobicContact CD2-CG 4.12Å; N683-E687 PolarHBondContact O-N 3.35Å; E687-S689 VanDerWaalsContact C-N 3.35Å; E687-F690 PolarHBondContact O-N 3.05Å; E687-N691 VanDerWaalsContact O-CB 3.29Å; E687-N691 WeakPolarHBondContact O-CB 3.48Å; E687-N691 PolarHBondContact O-N 3.47Å; E687-N691 PolarHBondContact O-ND2 3.12Å; E687-R796 IonicContact OE1-NH1 2.65Å; E687-R796 IonicContact OE2-CZ 3.8Å; E687-R796 IonicContact OE2-NH1 2.65Å; E687-R796 PolarHBondContact OE2-NH1 2.99Å; E687-R796 IonicContact OE2-NH2 3.12Å; E687-R796 PolarHBondContact OE2-NH2 2.89Å; E687-R812 HydrophobicContact CG-CB 3.9Å; E687-R812 WeakPolarHBondContact OE1-CB 3.31Å; E687-R812 IonicContact OE1-NH1 3.93Å; E687-R812 PolarHBondContact OE1-NH1 3.44Å; E687-G813 PolarHBondContact OE2-N 2.82Å
688	K	86.1	Confident	79.3	Confident	79 Å²	79	58.4 Å²	58.4	34%	0.343	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-39	175.7	-176.2	170.6	-175.3	155.5	0	112.1	F684 L685 A686 A692 C771 A773	F684-K688 VanDerWaalsContact O-CB 3.24Å; F684-K688 WeakPolarHBondContact O-CB 3.23Å; F684-K688 PolarHBondContact O-N 2.89Å; L685-K688 PolarHBondContact O-N 3.32Å; A686-K688 PolarHBondContact O-N 3.04Å; K688-A692 WeakPolarHBondContact O-CB 3.34Å; K688-A692 PolarHBondContact O-N 2.9Å; K688-C771 WeakPolarHBondContact CD-O 3.13Å; K688-C771 WeakPolarHBondContact CE-O 3.11Å; K688-C771 PolarHBondContact NZ-O 3.25Å; K688-A773 HydrophobicContact CG-CB 3.84Å
689	S	82.4	Confident	80.4	Confident	69 Å²	69	56.6 Å²	56.6	48%	0.483	33%	0.334	S	S	.	.	H	α-helix	trans	-68.4	-43.8	176.7	-57.1	0	0	0	0	111.7	L685 A686 E687 A692 A693	L685-S689 WeakPolarHBondContact O-CB 3.29Å; L685-S689 PolarHBondContact O-N 2.82Å; L685-S689 PolarHBondContact O-OG 3.17Å; A686-S689 PolarHBondContact O-N 2.92Å; E687-S689 VanDerWaalsContact C-N 3.35Å; S689-A692 PolarHBondContact O-N 3.18Å; S689-A693 WeakPolarHBondContact O-CB 3.31Å; S689-A693 PolarHBondContact O-N 3.49Å
690	F	85.8	Confident	81.6	Confident	23 Å²	23	54.5 Å²	54.5	10%	0.101	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-48.6	173	172.2	-105.2	0	0	0	112	L676 A686 E687 A692 A693 V694 L811	L676-F690 HydrophobicContact CD1-CB 3.7Å; L676-F690 HydrophobicContact CD1-CD1 4.24Å; L676-F690 HydrophobicContact CD1-CD2 3.43Å; L676-F690 VanDerWaalsContact CD1-CD2 3.43Å; L676-F690 HydrophobicContact CD1-CE2 4.07Å; L676-F690 HydrophobicContact CD1-CG 3.52Å; L676-F690 HydrophobicContact CD2-CB 3.98Å; L676-F690 HydrophobicContact CD2-CG 4.38Å; L676-F690 HydrophobicContact CG-CB 4.5Å; A686-F690 WeakPolarHBondContact O-CB 3.43Å; A686-F690 PolarHBondContact O-N 2.92Å; E687-F690 PolarHBondContact O-N 3.05Å; F690-A692 VanDerWaalsContact C-N 3.31Å; F690-A692 PolarHBondContact O-N 3.13Å; F690-A693 PolarHBondContact O-N 2.9Å; F690-V694 HydrophobicContact CD2-CG2 4.22Å; F690-V694 HydrophobicContact CE1-CG2 4.17Å; F690-V694 HydrophobicContact CE2-CG2 3.84Å; F690-V694 HydrophobicContact CZ-CG2 3.82Å; F690-V694 WeakPolarHBondContact O-CG2 3.32Å; F690-V694 PolarHBondContact O-N 3.37Å; F690-L811 HydrophobicContact CZ-CD2 4.34Å
691	N	89.5	Confident	82.8	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-40.4	176.7	-76.2	-13.7	0	0	0	112.5	E687 A695 C772 M774 G814	E687-N691 VanDerWaalsContact O-CB 3.29Å; E687-N691 WeakPolarHBondContact O-CB 3.48Å; E687-N691 PolarHBondContact O-N 3.47Å; E687-N691 PolarHBondContact O-ND2 3.12Å; N691-A695 VanDerWaalsContact O-CB 3.3Å; N691-A695 WeakPolarHBondContact O-CB 3.41Å; N691-A695 PolarHBondContact O-N 3.26Å; N691-C772 WeakPolarHBondContact CB-O 3.33Å; N691-C772 PolarHBondContact ND2-O 2.83Å; N691-M774 HydrophobicContact CB-CB 4.27Å; N691-G814 PolarHBondContact OD1-N 2.79Å
692	A	85.7	Confident	83.8	Confident	36 Å²	36	46.4 Å²	46.4	30%	0.298	27%	0.273	S	S	.	.	H	α-helix	trans	-68	-37.8	175.7	0	0	0	0	0	112.5	K688 S689 F690 A695 G696 A773	K688-A692 WeakPolarHBondContact O-CB 3.34Å; K688-A692 PolarHBondContact O-N 2.9Å; S689-A692 PolarHBondContact O-N 3.18Å; F690-A692 VanDerWaalsContact C-N 3.31Å; F690-A692 PolarHBondContact O-N 3.13Å; A692-A695 PolarHBondContact O-N 2.65Å; A692-G696 PolarHBondContact O-N 3.05Å; A692-A773 HydrophobicContact CB-CB 4.09Å
693	A	82.2	Confident	84.6	Confident	61 Å²	61	43 Å²	43	50%	0.504	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-46.9	174.5	0	0	0	0	0	111.8	S689 F690 A695 G696	S689-A693 WeakPolarHBondContact O-CB 3.31Å; S689-A693 PolarHBondContact O-N 3.49Å; F690-A693 PolarHBondContact O-N 2.9Å; A693-A695 VanDerWaalsContact C-N 3.29Å; A693-A695 PolarHBondContact O-N 2.76Å; A693-G696 PolarHBondContact O-N 3.21Å
694	V	82.4	Confident	84.9	Confident	10 Å²	10	40.4 Å²	40.4	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-36.7	175.9	171.3	0	0	0	0	111.6	F690 G696 L697 A702 Y710	F690-V694 HydrophobicContact CD2-CG2 4.22Å; F690-V694 HydrophobicContact CE1-CG2 4.17Å; F690-V694 HydrophobicContact CE2-CG2 3.84Å; F690-V694 HydrophobicContact CZ-CG2 3.82Å; F690-V694 WeakPolarHBondContact O-CG2 3.32Å; F690-V694 PolarHBondContact O-N 3.37Å; V694-G696 PolarHBondContact O-N 2.78Å; V694-L697 PolarHBondContact O-N 2.86Å; V694-A702 HydrophobicContact CG1-CB 4.07Å; V694-Y710 HydrophobicContact CG1-CE1 4.27Å; V694-Y710 HydrophobicContact CG2-CE1 4.21Å
695	A	85.1	Confident	85.2	Confident	10 Å²	10	38.1 Å²	38.1	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-21.5	174.7	0	0	0	0	0	113.9	N691 A692 A693 Q775	N691-A695 VanDerWaalsContact O-CB 3.3Å; N691-A695 WeakPolarHBondContact O-CB 3.41Å; N691-A695 PolarHBondContact O-N 3.26Å; A692-A695 PolarHBondContact O-N 2.65Å; A693-A695 VanDerWaalsContact C-N 3.29Å; A693-A695 PolarHBondContact O-N 2.76Å; A695-Q775 HydrophobicContact CB-CB 3.51Å; A695-Q775 PolarHBondContact O-NE2 3.05Å
696	G	81.1	Confident	85.5	Confident	50 Å²	50	32.5 Å²	32.5	52%	0.515	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-6.5	176.6	0	0	0	0	0	115	A692 A693 V694	A692-G696 PolarHBondContact O-N 3.05Å; A693-G696 PolarHBondContact O-N 3.21Å; V694-G696 PolarHBondContact O-N 2.78Å
697	L	81.7	Confident	85.8	Confident	89 Å²	89	33 Å²	33	47%	0.466	20%	0.196	S	C	.	.	S	Bend	trans	-99.8	132.4	179.1	-61.3	176.4	0	0	0	110.2	V694 Y700 Y710	V694-L697 PolarHBondContact O-N 2.86Å; L697-Y700 VanDerWaalsContact O-CA 3.3Å; L697-Y700 WeakPolarHBondContact O-CA 3.22Å; L697-Y700 PolarHBondContact O-N 3.17Å; L697-Y710 HydrophobicContact CD1-CD1 3.74Å; L697-Y710 HydrophobicContact CD1-CE1 4.22Å
698	E	75.1	Confident	85.3	Confident	140 Å²	140	35 Å²	35	65%	0.654	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	128.9	172.3	-172.4	-177.7	-171.6	0	0	110.1	Y700 C708	E698-Y700 HydrophobicContact CB-CE2 4.2Å; E698-Y700 HydrophobicContact CG-CE2 4.22Å; E698-C708 PolarHBondContact O-SG 3.39Å; E698-C708 VanDerWaalsContact O-SG 3.34Å
699	P	84.3	Confident	83.8	Confident	11 Å²	11	33.1 Å²	33.1	7%	0.071	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.2	26.4	18	39.9	-41	0	0	0	115.5	C701 C704 C708 L736	P699-C701 PolarHBondContact O-N 3.22Å; P699-C704 HydrophobicContact CB-CB 4.26Å; P699-C704 HydrophobicContact CG-CB 3.42Å; P699-C704 VanDerWaalsContact CG-CB 3.42Å; P699-C708 HydrophobicContact CG-CB 4.47Å; P699-L736 HydrophobicContact CB-CD1 3.84Å; P699-L736 HydrophobicContact CB-CG 4.01Å; P699-L736 HydrophobicContact CG-CD1 3.77Å; P699-L736 HydrophobicContact CG-CG 4.16Å
700	Y	87.6	Confident	82.4	Confident	58 Å²	58	32.6 Å²	32.6	23%	0.227	19%	0.194	C	C	.	.			trans	63.1	10.5	174.8	-44.4	-71.8	0	0	0	116	L697 E698 P727 Q775	L697-Y700 VanDerWaalsContact O-CA 3.3Å; L697-Y700 WeakPolarHBondContact O-CA 3.22Å; L697-Y700 PolarHBondContact O-N 3.17Å; E698-Y700 HydrophobicContact CB-CE2 4.2Å; E698-Y700 HydrophobicContact CG-CE2 4.22Å; Y700-P727 HydrophobicContact CD1-CG 4.08Å; Y700-P727 HydrophobicContact CD2-CG 3.98Å; Y700-P727 HydrophobicContact CE1-CG 3.81Å; Y700-P727 HydrophobicContact CE2-CG 3.7Å; Y700-P727 HydrophobicContact CG-CG 4.16Å; Y700-Q775 WeakPolarHBondContact O-CG 3.4Å; Y700-Q775 PolarHBondContact O-NE2 2.86Å
701	C	90.9	Very high	80.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.014	21%	0.213	C	C	.	.			trans	-128.1	126	177.7	162.2	0	0	0	0	110.9	P699 V703 C704 S705 L766 Q775 H777	P699-C701 PolarHBondContact O-N 3.22Å; C701-V703 PolarHBondContact O-N 3.38Å; C701-V703 PolarHBondContact SG-N 3.09Å; C701-C704 HydrophobicContact CB-CB 3.95Å; C701-C704 PolarHBondContact O-N 3.06Å; C701-C704 PolarHBondContact SG-N 2.72Å; C701-C704 VanDerWaalsContact SG-N 3.41Å; C701-S705 PolarHBondContact O-N 3.24Å; C701-L766 HydrophobicContact CB-CD2 4.19Å; C701-Q775 WeakPolarHBondContact CA-O 3.47Å; C701-H777 VanDerWaalsContact CB-ND1 3.29Å; C701-H777 WeakPolarHBondContact CB-ND1 3.33Å; C701-H777 PolarHBondContact SG-N 3.07Å; C701-H777 VanDerWaalsContact SG-N 3.39Å
702	A	90.8	Very high	77.7	Confident	8 Å²	8	44.8 Å²	44.8	7%	0.066	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	1.8	-179.1	0	0	0	0	0	115.5	V694 M774 Q775 V776	V694-A702 HydrophobicContact CG1-CB 4.07Å; A702-M774 HydrophobicContact CB-CG 4.4Å; A702-Q775 PolarHBondContact N-O 3.08Å; A702-V776 HydrophobicContact CB-CG1 4.27Å
703	V	92.6	Very high	75.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-45.5	170.3	-168.2	0	0	0	0	110	C701 S705 L706 V737 F742 V776 C780 A815 V827 I828 I831	C701-V703 PolarHBondContact O-N 3.38Å; C701-V703 PolarHBondContact SG-N 3.09Å; V703-S705 PolarHBondContact O-N 2.95Å; V703-L706 VanDerWaalsContact O-CB 3.32Å; V703-L706 WeakPolarHBondContact O-CB 3.25Å; V703-L706 PolarHBondContact O-N 3Å; V703-V737 HydrophobicContact CG1-CG2 4.21Å; V703-F742 HydrophobicContact CG1-CZ 4.43Å; V703-V776 HydrophobicContact CG2-CG1 3.91Å; V703-C780 HydrophobicContact CB-CB 4Å; V703-C780 HydrophobicContact CG1-CB 4.26Å; V703-C780 HydrophobicContact CG2-CB 4.24Å; V703-A815 HydrophobicContact CG2-CB 3.78Å; V703-V827 HydrophobicContact CG1-CB 4.36Å; V703-V827 HydrophobicContact CG1-CG1 3.67Å; V703-V827 HydrophobicContact CG2-CB 4.26Å; V703-V827 HydrophobicContact CG2-CG1 4.13Å; V703-I828 HydrophobicContact CB-CG2 4.42Å; V703-I828 HydrophobicContact CG1-CG2 4.09Å; V703-I831 HydrophobicContact CG1-CD1 3.75Å
704	C	90.4	Very high	72.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-63.4	-22.2	175	-66.3	0	0	0	0	113.7	P699 C701 L706 F707 L736 V737 H777 C780	P699-C704 HydrophobicContact CB-CB 4.26Å; P699-C704 HydrophobicContact CG-CB 3.42Å; P699-C704 VanDerWaalsContact CG-CB 3.42Å; C701-C704 HydrophobicContact CB-CB 3.95Å; C701-C704 PolarHBondContact O-N 3.06Å; C701-C704 PolarHBondContact SG-N 2.72Å; C701-C704 VanDerWaalsContact SG-N 3.41Å; C704-L706 PolarHBondContact O-N 2.96Å; C704-L706 VanDerWaalsContact O-N 3.13Å; C704-F707 PolarHBondContact O-N 3.27Å; C704-F707 VanDerWaalsContact O-N 3.15Å; C704-L736 HydrophobicContact CB-CB 3.99Å; C704-L736 HydrophobicContact CB-CG 4.31Å; C704-L736 PolarHBondContact SG-N 2.98Å; C704-V737 HydrophobicContact CB-CG2 4.5Å; C704-H777 PolarHBondContact SG-ND1 3.08Å; C704-C780 VanDerWaalsContact SG-SG 3.69Å
705	S	88.1	Confident	70.2	Confident	5 Å²	5	61.8 Å²	61.8	4%	0.035	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-64.3	-7.3	169.7	64.7	0	0	0	0	114.3	C701 V703 F707 C708 Y710 Q894	C701-S705 PolarHBondContact O-N 3.24Å; V703-S705 PolarHBondContact O-N 2.95Å; S705-F707 PolarHBondContact O-N 3.23Å; S705-C708 PolarHBondContact O-N 2.87Å; S705-Y710 WeakPolarHBondContact CB-OH 3.42Å; S705-Y710 PolarHBondContact OG-OH 3.16Å; S705-Q894 PolarHBondContact O-NE2 2.98Å; S705-Q894 PolarHBondContact OG-NE2 3.2Å; S705-Q894 VanDerWaalsContact OG-NE2 3.08Å
706	L	87.6	Confident	67.6	Low	4 Å²	4	66.5 Å²	66.5	2%	0.021	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-61.1	-33.1	168.2	180	60	0	0	0	112.1	V703 C704 I828 I831 V890 M900	V703-L706 VanDerWaalsContact O-CB 3.32Å; V703-L706 WeakPolarHBondContact O-CB 3.25Å; V703-L706 PolarHBondContact O-N 3Å; C704-L706 PolarHBondContact O-N 2.96Å; C704-L706 VanDerWaalsContact O-N 3.13Å; L706-I828 HydrophobicContact CB-CB 4.38Å; L706-I828 HydrophobicContact CB-CG2 3.97Å; L706-I828 HydrophobicContact CD1-CB 4.43Å; L706-I828 HydrophobicContact CD2-CB 4.44Å; L706-I831 HydrophobicContact CD2-CB 3.89Å; L706-I831 HydrophobicContact CD2-CD1 4.45Å; L706-I831 HydrophobicContact CD2-CG2 3.5Å; L706-I831 VanDerWaalsContact CD2-CG2 3.5Å; L706-V890 HydrophobicContact CD1-CG1 3.76Å; L706-M900 HydrophobicContact CD1-CE 3.84Å; L706-M900 HydrophobicContact CD1-SD 3.89Å
707	F	86.7	Confident	65.5	Low	32 Å²	32	69.2 Å²	69.2	14%	0.14	35%	0.346	C	S	.	.	S	Bend	trans	-104.6	4.5	-179.7	-56.9	-51.6	0	0	0	113.5	C704 S705 L736 V737 K901 P902 V909	C704-F707 PolarHBondContact O-N 3.27Å; C704-F707 VanDerWaalsContact O-N 3.15Å; S705-F707 PolarHBondContact O-N 3.23Å; F707-L736 WeakPolarHBondContact CD2-O 3.45Å; F707-V737 HydrophobicContact CD2-CG2 4.01Å; F707-V737 HydrophobicContact CE2-CB 4.23Å; F707-V737 HydrophobicContact CE2-CG1 4.16Å; F707-V737 HydrophobicContact CE2-CG2 3.94Å; F707-K901 VanDerWaalsContact CE1-C 3.43Å; F707-P902 HydrophobicContact CD1-CG 4.09Å; F707-P902 HydrophobicContact CD2-CG 3.86Å; F707-P902 HydrophobicContact CE1-CG 4.08Å; F707-P902 HydrophobicContact CE2-CG 3.83Å; F707-P902 HydrophobicContact CG-CG 3.99Å; F707-P902 HydrophobicContact CZ-CB 4.31Å; F707-P902 HydrophobicContact CZ-CG 3.94Å; F707-V909 HydrophobicContact CE1-CG1 4.22Å; F707-V909 HydrophobicContact CE1-CG2 4.05Å; F707-V909 HydrophobicContact CZ-CG2 4.03Å
708	C	74.4	Confident	63.2	Low	45 Å²	45	71.6 Å²	71.6	30%	0.304	36%	0.357	S	S	.	.	S	Bend	trans	-122.7	105.2	172.2	-170.4	0	0	0	0	110.1	E698 P699 S705 Y710 L736	E698-C708 PolarHBondContact O-SG 3.39Å; E698-C708 VanDerWaalsContact O-SG 3.34Å; P699-C708 HydrophobicContact CG-CB 4.47Å; S705-C708 PolarHBondContact O-N 2.87Å; C708-Y710 PolarHBondContact O-N 2.97Å; C708-L736 HydrophobicContact CB-CD1 4.47Å
709	S	56.1	Low	60.8	Low	39 Å²	39	70.9 Å²	70.9	27%	0.273	37%	0.368	S	S	.	.			trans	-73.7	124	-177.8	138.4	0	0	0	0	111.3	M711	S709-M711 PolarHBondContact O-N 3.35Å
710	Y	52	Low	58.5	Low	58 Å²	58	76.1 Å²	76.1	23%	0.227	39%	0.394	C	S	.	.	S	Bend	trans	-54.6	-17.9	-177.8	-58.8	-61	0	0	0	115.9	V694 L697 S705 C708 K712 Q894	V694-Y710 HydrophobicContact CG1-CE1 4.27Å; V694-Y710 HydrophobicContact CG2-CE1 4.21Å; L697-Y710 HydrophobicContact CD1-CD1 3.74Å; L697-Y710 HydrophobicContact CD1-CE1 4.22Å; S705-Y710 WeakPolarHBondContact CB-OH 3.42Å; S705-Y710 PolarHBondContact OG-OH 3.16Å; C708-Y710 PolarHBondContact O-N 2.97Å; Y710-K712 VanDerWaalsContact C-N 3.26Å; Y710-K712 PolarHBondContact O-N 3.22Å; Y710-K712 VanDerWaalsContact O-N 3.14Å; Y710-Q894 HydrophobicContact CD2-CG 4.17Å; Y710-Q894 HydrophobicContact CE2-CG 3.67Å; Y710-Q894 PolarHBondContact OH-NE2 3.05Å
711	M	41	Very low	55.6	Low	99 Å²	99	79.3 Å²	79.3	49%	0.488	42%	0.42	S	S	.	.	S	Bend	trans	-83.6	36.7	-179.6	-66	-57.2	-62.8	0	0	115.2	S709	S709-M711 PolarHBondContact O-N 3.35Å
712	K	36.8	Very low	53.2	Low	183 Å²	183	84.9 Å²	84.9	80%	0.796	46%	0.456	S	S	*	.			trans	-143.6	88.7	166.1	-83.4	-161.3	173.8	-169.2	0	112	Y710 N714	Y710-K712 VanDerWaalsContact C-N 3.26Å; Y710-K712 PolarHBondContact O-N 3.22Å; Y710-K712 VanDerWaalsContact O-N 3.14Å; K712-N714 PolarHBondContact O-N 3.26Å; K712-N714 VanDerWaalsContact O-N 3.09Å
713	P	31.6	Very low	50.5	Low	121 Å²	121	94 Å²	94	79%	0.786	50%	0.497	S	S	*	.			trans	-67	101.9	154.1	28.9	-31.5	0	0	0	108.2	R715	P713-R715 PolarHBondContact O-N 2.66Å
714	N	31	Very low	47.7	Very low	101 Å²	101	97 Å²	97	54%	0.54	52%	0.523	S	S	.	.			trans	-73.2	96.9	175.2	-173.3	27.8	0	0	0	109.4	K712 D716 V717	K712-N714 PolarHBondContact O-N 3.26Å; K712-N714 VanDerWaalsContact O-N 3.09Å; N714-D716 PolarHBondContact O-N 3.4Å; N714-V717 PolarHBondContact O-N 2.91Å
715	R	28.7	Very low	45.3	Very low	243 Å²	243	101 Å²	101	92%	0.917	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	2.2	-173.7	-126.3	-175.4	-172	-149.2	1.1	114.9	P713 V717	P713-R715 PolarHBondContact O-N 2.66Å; R715-V717 VanDerWaalsContact C-N 3.33Å
716	D	31	Very low	43.3	Very low	109 Å²	109	106.8 Å²	106.8	58%	0.583	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-2.6	171.8	-67.9	-24.5	0	0	0	113.2	N714 K928	N714-D716 PolarHBondContact O-N 3.4Å; D716-K928 VanDerWaalsContact CG-NZ 3.28Å; D716-K928 IonicContact OD1-NZ 2.87Å; D716-K928 PolarHBondContact OD1-NZ 3.01Å; D716-K928 IonicContact OD2-NZ 3.74Å; D716-K928 PolarHBondContact OD2-NZ 3.48Å
717	V	36.8	Very low	41.4	Very low	107 Å²	107	108.2 Å²	108.2	65%	0.648	59%	0.59	S	S	*	*	S	Bend	trans	-133	85.8	172.7	-170.1	0	0	0	0	111.8	N714 R715	N714-V717 PolarHBondContact O-N 2.91Å; R715-V717 VanDerWaalsContact C-N 3.33Å
718	I	34.5	Very low	40.3	Very low	139 Å²	139	115.1 Å²	115.1	71%	0.713	62%	0.615	S	S	*	*				-179.1	106.8	129.6	-88	152.4	0	0	0	107.1
719	S	24.9	Very low	39.8	Very low	125 Å²	125	116.7 Å²	116.7	87%	0.874	62%	0.618	S	S	*	*			trans	-152.2	71.7	145.1	-93.3	0	0	0	0	106.5
720	L	34.8	Very low	40.4	Very low	120 Å²	120	117.1 Å²	117.1	63%	0.628	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-65.9	132	156.6	-78.2	157.1	0	0	0	107	A724	L720-A724 HydrophobicContact CD1-CB 3.93Å; L720-A724 HydrophobicContact CD2-CB 3.99Å
721	T	27.1	Very low	41.7	Very low	126 Å²	126	118.8 Å²	118.8	77%	0.773	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-57.5	148.8	148.7	32.7	0	0	0	0	108.3
722	P	41	Very low	43.7	Very low	119 Å²	119	117 Å²	117	77%	0.773	64%	0.637	S	S	*	*	S	Bend	trans	-63.3	163.5	-155.8	22.9	-34.2	0	0	0	115.1
723	E	34.4	Very low	46.1	Very low	198 Å²	198	110.1 Å²	110.1	93%	0.925	61%	0.61	S	S	*	*			trans	86.9	9.9	168.6	-47	-152.7	130.7	0	0	119.9
724	A	33.2	Very low	48.7	Very low	64 Å²	64	112.5 Å²	112.5	53%	0.529	60%	0.603	S	S	.	*			trans	-89.9	119.6	158.7	0	0	0	0	0	111.2	L720	L720-A724 HydrophobicContact CD1-CB 3.93Å; L720-A724 HydrophobicContact CD2-CB 3.99Å
725	S	39.6	Very low	51.4	Low	85 Å²	85	109 Å²	109	59%	0.594	59%	0.586	S	S	*	*			trans	-76.4	138.5	-170.8	60.9	0	0	0	0	114.2
726	L	45.4	Very low	54.2	Low	126 Å²	126	101.1 Å²	101.1	66%	0.66	56%	0.562	S	S	*	*			trans	-42.2	140.6	163.1	-74.9	164.4	0	0	0	111.7	R728	L726-R728 WeakPolarHBondContact O-CG 3.33Å; L726-R728 PolarHBondContact O-N 2.86Å
727	P	49.6	Very low	56.9	Low	33 Å²	33	96.3 Å²	96.3	21%	0.214	54%	0.536	C	S	.	.			trans	-64.3	111	-177.6	24.3	-32.4	0	0	0	111.3	Y700 M731	Y700-P727 HydrophobicContact CD1-CG 4.08Å; Y700-P727 HydrophobicContact CD2-CG 3.98Å; Y700-P727 HydrophobicContact CE1-CG 3.81Å; Y700-P727 HydrophobicContact CE2-CG 3.7Å; Y700-P727 HydrophobicContact CG-CG 4.16Å; P727-M731 VanDerWaalsContact CA-SD 3.53Å; P727-M731 HydrophobicContact CB-CE 4.34Å; P727-M731 HydrophobicContact CB-SD 3.86Å
728	R	62.3	Low	59.1	Low	178 Å²	178	92.9 Å²	92.9	67%	0.672	52%	0.517	S	S	*	.			trans	-92.3	161.7	-175.9	-74.9	170.7	-171.9	-167.8	3.1	111.3	L726 G730 M731	L726-R728 WeakPolarHBondContact O-CG 3.33Å; L726-R728 PolarHBondContact O-N 2.86Å; R728-G730 PolarHBondContact O-N 3.16Å; R728-M731 PolarHBondContact O-N 2.82Å; R728-M731 VanDerWaalsContact O-N 3.14Å
729	H	64.1	Low	61.4	Low	77 Å²	77	87.4 Å²	87.4	36%	0.356	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	129.5	163.6	171.5	34.1	0	0	0	110.1	L766 R768	H729-L766 PolarHBondContact ND1-O 3.48Å; H729-R768 HydrophobicContact CB-CB 4.06Å
730	G	68.4	Low	64	Low	49 Å²	49	82.1 Å²	82.1	51%	0.505	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.2	-16.1	-173	0	0	0	0	0	114.2	R728 L765 L766	R728-G730 PolarHBondContact O-N 3.16Å; G730-L765 VanDerWaalsContact O-CD1 3.28Å; G730-L765 WeakPolarHBondContact O-CD1 3.45Å; G730-L766 PolarHBondContact N-O 2.97Å; G730-L766 VanDerWaalsContact N-O 3.15Å
731	M	80.5	Confident	66.3	Low	93 Å²	93	76.6 Å²	76.6	46%	0.458	42%	0.421	S	S	.	.			trans	-85.4	144.9	172.6	-66.6	-177.6	67.4	0	0	112.1	P727 R728 L766	P727-M731 VanDerWaalsContact CA-SD 3.53Å; P727-M731 HydrophobicContact CB-CE 4.34Å; P727-M731 HydrophobicContact CB-SD 3.86Å; R728-M731 PolarHBondContact O-N 2.82Å; R728-M731 VanDerWaalsContact O-N 3.14Å; M731-L766 WeakPolarHBondContact O-CB 3.2Å; M731-L766 PolarHBondContact O-N 2.94Å
732	S	82.7	Confident	69.1	Low	62 Å²	62	70.6 Å²	70.6	43%	0.434	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.3	172	-59	0	0	0	0	111.4	T763 S764	S732-T763 VanDerWaalsContact CB-OG1 3.28Å; S732-T763 WeakPolarHBondContact CB-OG1 3.25Å; S732-S764 VanDerWaalsContact CA-O 3.28Å; S732-S764 WeakPolarHBondContact CA-O 3.36Å
733	T	86.8	Confident	70.6	Confident	37 Å²	37	65.7 Å²	65.7	23%	0.227	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	164.6	173.7	67.5	0	0	0	0	110.5	P735 T763 S764 L766 H777	T733-P735 WeakPolarHBondContact O-CD 3.48Å; T733-T763 WeakPolarHBondContact O-CA 3.38Å; T733-S764 PolarHBondContact N-O 2.67Å; T733-S764 PolarHBondContact O-N 3.02Å; T733-L766 HydrophobicContact CG2-CD1 3.97Å; T733-H777 PolarHBondContact O-NE2 3.34Å; T733-H777 PolarHBondContact OG1-NE2 2.96Å
734	R	85.9	Confident	71.9	Confident	171 Å²	171	57.4 Å²	57.4	65%	0.645	32%	0.315	S	S	*	.			trans	-75.3	125.4	-176.6	-65.8	-165.6	163.8	163.8	-4.9	111.7	D761 G762 T763	R734-D761 PolarHBondContact NE-O 3.3Å; R734-D761 PolarHBondContact NH2-O 3.43Å; R734-G762 WeakPolarHBondContact CG-O 3.46Å; R734-T763 HydrophobicContact CG-CG2 3.8Å
735	P	88.1	Confident	72.9	Confident	27 Å²	27	55 Å²	55	18%	0.175	30%	0.297	C	S	.	.			trans	-64.6	137.8	173	-21.8	34.1	0	0	0	112.4	T733 H777 S779	T733-P735 WeakPolarHBondContact O-CD 3.48Å; P735-H777 HydrophobicContact CG-CB 4.35Å; P735-S779 WeakPolarHBondContact CG-OG 3.47Å
736	L	87.7	Confident	73	Confident	78 Å²	78	55.8 Å²	55.8	41%	0.408	31%	0.308	S	S	.	.	S	Bend	trans	-87	-9.7	173.7	-58.8	-168.7	0	0	0	113.7	P699 C704 F707 C708 P738	P699-L736 HydrophobicContact CB-CD1 3.84Å; P699-L736 HydrophobicContact CB-CG 4.01Å; P699-L736 HydrophobicContact CG-CD1 3.77Å; P699-L736 HydrophobicContact CG-CG 4.16Å; C704-L736 HydrophobicContact CB-CB 3.99Å; C704-L736 HydrophobicContact CB-CG 4.31Å; C704-L736 PolarHBondContact SG-N 2.98Å; F707-L736 WeakPolarHBondContact CD2-O 3.45Å; C708-L736 HydrophobicContact CB-CD1 4.47Å; L736-P738 WeakPolarHBondContact O-CD 3.28Å
737	V	86.8	Confident	72.8	Confident	8 Å²	8	55.6 Å²	55.6	5%	0.048	31%	0.312	C	S	.	.	S	Bend	trans	-94.4	113.1	-179.9	-177	0	0	0	0	109.9	V703 C704 F707 C741 F742 I831	V703-V737 HydrophobicContact CG1-CG2 4.21Å; C704-V737 HydrophobicContact CB-CG2 4.5Å; F707-V737 HydrophobicContact CD2-CG2 4.01Å; F707-V737 HydrophobicContact CE2-CB 4.23Å; F707-V737 HydrophobicContact CE2-CG1 4.16Å; F707-V737 HydrophobicContact CE2-CG2 3.94Å; V737-C741 HydrophobicContact CG1-CB 3.57Å; V737-F742 HydrophobicContact CB-CE2 4.16Å; V737-F742 HydrophobicContact CB-CZ 4.23Å; V737-F742 HydrophobicContact CG1-CD2 4.3Å; V737-F742 HydrophobicContact CG1-CE2 3.45Å; V737-F742 VanDerWaalsContact CG1-CE2 3.45Å; V737-F742 HydrophobicContact CG1-CZ 3.61Å; V737-I831 HydrophobicContact CG1-CD1 4Å
738	P	84.3	Confident	72.5	Confident	36 Å²	36	56.8 Å²	56.8	23%	0.234	32%	0.317	C	S	.	.			trans	-67.2	147.6	176.8	-21.4	35	0	0	0	112.1	L736 M740 C741 P902	L736-P738 WeakPolarHBondContact O-CD 3.28Å; P738-M740 PolarHBondContact O-N 2.67Å; P738-C741 VanDerWaalsContact O-CB 3.26Å; P738-C741 WeakPolarHBondContact O-CB 3.26Å; P738-C741 PolarHBondContact O-N 2.88Å; P738-P902 HydrophobicContact CG-CB 3.88Å; P738-P902 HydrophobicContact CG-CG 4.1Å
739	E	81.8	Confident	71.6	Confident	23 Å²	23	53.1 Å²	53.1	11%	0.107	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-55.3	-28	-176.6	-167.2	51.2	-136.3	0	0	114.5	C741 F742 P752 N755 R844	E739-C741 PolarHBondContact O-N 2.82Å; E739-F742 PolarHBondContact O-N 3.48Å; E739-P752 HydrophobicContact CG-CB 4.46Å; E739-N755 HydrophobicContact CG-CB 4.1Å; E739-N755 WeakPolarHBondContact OE2-CB 3.2Å; E739-N755 PolarHBondContact OE2-ND2 3.19Å; E739-R844 IonicContact OE1-CZ 3.76Å; E739-R844 IonicContact OE1-NH1 3.67Å; E739-R844 PolarHBondContact OE1-NH1 3.47Å; E739-R844 IonicContact OE1-NH2 3.97Å; E739-R844 PolarHBondContact OE1-NH2 3.43Å; E739-R844 IonicContact OE2-CZ 2.73Å; E739-R844 IonicContact OE2-NH1 3.64Å; E739-R844 IonicContact OE2-NH2 3.55Å; E739-R844 PolarHBondContact OE2-NH2 3.29Å
740	M	79.4	Confident	70.5	Confident	14 Å²	14	55.2 Å²	55.2	7%	0.069	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-53.9	-37.9	171.9	-77.1	158.4	56.3	0	0	113.4	R635 L638 P738 F742 S743 P752 W905 V908	R635-M740 WeakPolarHBondContact CD-SD 3.48Å; R635-M740 PolarHBondContact NH1-SD 2.87Å; R635-M740 VanDerWaalsContact NH1-SD 3.36Å; L638-M740 HydrophobicContact CD1-CE 4.49Å; L638-M740 HydrophobicContact CD1-SD 4.48Å; P738-M740 PolarHBondContact O-N 2.67Å; M740-F742 PolarHBondContact O-N 3.37Å; M740-S743 PolarHBondContact O-N 2.81Å; M740-P752 HydrophobicContact CG-CG 4.39Å; M740-W905 HydrophobicContact CE-CB 4.29Å; M740-V908 HydrophobicContact CB-CG1 4.05Å; M740-V908 HydrophobicContact CE-CG1 4.38Å
741	C	83.1	Confident	69.5	Low	4 Å²	4	55.2 Å²	55.2	3%	0.027	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-61.5	-18.7	-173.4	-68.4	0	0	0	0	113.8	V737 P738 E739 I831	V737-C741 HydrophobicContact CG1-CB 3.57Å; P738-C741 VanDerWaalsContact O-CB 3.26Å; P738-C741 WeakPolarHBondContact O-CB 3.26Å; P738-C741 PolarHBondContact O-N 2.88Å; E739-C741 PolarHBondContact O-N 2.82Å; C741-I831 HydrophobicContact CB-CG1 4.32Å; C741-I831 HydrophobicContact CB-CG2 3.74Å
742	F	85.2	Confident	68.2	Low	1 Å²	1	52 Å²	52	0%	0.004	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-102.1	-12.5	179.3	-55.4	-83.3	0	0	0	113.8	V703 V737 E739 M740 C780 V827 I831 F838 R844	V703-F742 HydrophobicContact CG1-CZ 4.43Å; V737-F742 HydrophobicContact CB-CE2 4.16Å; V737-F742 HydrophobicContact CB-CZ 4.23Å; V737-F742 HydrophobicContact CG1-CD2 4.3Å; V737-F742 HydrophobicContact CG1-CE2 3.45Å; V737-F742 VanDerWaalsContact CG1-CE2 3.45Å; V737-F742 HydrophobicContact CG1-CZ 3.61Å; E739-F742 PolarHBondContact O-N 3.48Å; M740-F742 PolarHBondContact O-N 3.37Å; F742-C780 HydrophobicContact CZ-CB 4.22Å; F742-V827 HydrophobicContact CE1-CG1 3.88Å; F742-I831 HydrophobicContact CD1-CD1 4.34Å; F742-I831 HydrophobicContact CD1-CG1 4.36Å; F742-I831 HydrophobicContact CE1-CD1 3.79Å; F742-I831 HydrophobicContact CE1-CG1 4.3Å; F742-I831 HydrophobicContact CZ-CD1 4.13Å; F742-F838 HydrophobicContact CB-CD2 4.09Å; F742-F838 HydrophobicContact CB-CE2 4.33Å; F742-F838 HydrophobicContact CD1-CD2 4.21Å; F742-F838 AromaticContact CD1-CE2 3.72Å; F742-F838 HydrophobicContact CD1-CE2 3.72Å; F742-F838 AromaticContact CD1-CZ 3.93Å; F742-F838 HydrophobicContact CD1-CZ 3.93Å; F742-F838 HydrophobicContact CE1-CZ 4.49Å; F742-F838 HydrophobicContact CG-CE2 4.45Å; F742-F838 WeakPolarHBondContact O-CD2 3.49Å; F742-R844 HydrophobicContact CD1-CG 4.21Å; F742-R844 HydrophobicContact CE1-CG 4.35Å; F742-R844 VanDerWaalsContact CG-CZ 3.44Å; F742-R844 VanDerWaalsContact CG-NH1 3.32Å
743	S	73.2	Confident	66.9	Low	16 Å²	16	51.9 Å²	51.9	11%	0.112	30%	0.299	C	S	.	.	S	Bend	trans	-100.9	6.4	-174.4	-60.1	0	0	0	0	113.9	M740 N748 P752	M740-S743 PolarHBondContact O-N 2.81Å; S743-N748 PolarHBondContact O-ND2 2.94Å; S743-P752 WeakPolarHBondContact OG-CA 3.4Å; S743-P752 VanDerWaalsContact OG-CB 3.23Å; S743-P752 WeakPolarHBondContact OG-CB 3.04Å
744	V	62.5	Low	65.4	Low	23 Å²	23	55 Å²	55	14%	0.139	32%	0.318	C	S	.	.			trans	-69.9	137.7	-177.9	-177.8	0	0	0	0	111.2	R837 V908	V744-R837 WeakPolarHBondContact O-CB 3.48Å; V744-V908 HydrophobicContact CG2-CB 4.02Å; V744-V908 HydrophobicContact CG2-CG1 3.3Å; V744-V908 HydrophobicContact CG2-CG2 3.52Å
745	G	53.3	Low	64.2	Low	14 Å²	14	47.4 Å²	47.4	14%	0.144	29%	0.29	C	S	.	.			trans	-169.6	145.8	165.2	0	0	0	0	0	108.4	V747 N748	G745-V747 PolarHBondContact O-N 3.28Å; G745-N748 PolarHBondContact O-N 2.64Å
746	A	41.8	Very low	62.9	Low	101 Å²	101	54.8 Å²	54.8	84%	0.835	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-3.5	-171.9	0	0	0	0	0	115.6
747	V	41.7	Very low	62	Low	123 Å²	123	51.7 Å²	51.7	75%	0.745	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-5.2	-178.8	-160.4	0	0	0	0	111.9	G745 T749	G745-V747 PolarHBondContact O-N 3.28Å; V747-T749 PolarHBondContact O-N 2.78Å; V747-T749 VanDerWaalsContact O-N 3.07Å
748	N	43.1	Very low	61.6	Low	58 Å²	58	54.2 Å²	54.2	31%	0.31	31%	0.312	S	S	.	.			trans	-77.3	100.1	-175.8	-79.1	2.6	0	0	0	111.3	S743 G745 E750	S743-N748 PolarHBondContact O-ND2 2.94Å; G745-N748 PolarHBondContact O-N 2.64Å; N748-E750 VanDerWaalsContact C-N 3.33Å
749	T	42.8	Very low	60.9	Low	101 Å²	101	54.4 Å²	54.4	62%	0.62	32%	0.32	S	S	*	.			trans	-91.1	6.8	165.6	62.6	0	0	0	0	112.4	K632 V747	K632-T749 WeakPolarHBondContact CD-O 3.34Å; K632-T749 WeakPolarHBondContact CE-O 2.99Å; K632-T749 PolarHBondContact NZ-O 3.04Å; K632-T749 PolarHBondContact NZ-OG1 3.13Å; V747-T749 PolarHBondContact O-N 2.78Å; V747-T749 VanDerWaalsContact O-N 3.07Å
750	E	41.9	Very low	60.2	Low	121 Å²	121	63.5 Å²	63.5	57%	0.565	36%	0.363	S	S	*	.	S	Bend	trans	-80.6	149.1	176.1	-66	-62.8	138.2	0	0	112.1	K632 N748	K632-E750 WeakPolarHBondContact CE-OE1 3.45Å; K632-E750 WeakPolarHBondContact CE-OE2 3.4Å; K632-E750 IonicContact NZ-OE1 3.16Å; K632-E750 PolarHBondContact NZ-OE1 2.72Å; K632-E750 IonicContact NZ-OE2 2.71Å; K632-E750 PolarHBondContact NZ-OE2 3.31Å; N748-E750 VanDerWaalsContact C-N 3.33Å
751	P	46.2	Very low	59.9	Low	48 Å²	48	66.9 Å²	66.9	31%	0.312	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-61.6	148.9	161.9	28.5	-35.6	0	0	0	110	K632	K632-P751 HydrophobicContact CG-CG 4.32Å
752	P	54.2	Low	59.7	Low	27 Å²	27	68.1 Å²	68.1	18%	0.175	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-58.3	127.3	165.7	26.5	-34	0	0	0	108.9	E739 M740 S743	E739-P752 HydrophobicContact CG-CB 4.46Å; M740-P752 HydrophobicContact CG-CG 4.39Å; S743-P752 WeakPolarHBondContact OG-CA 3.4Å; S743-P752 VanDerWaalsContact OG-CB 3.23Å; S743-P752 WeakPolarHBondContact OG-CB 3.04Å
753	P	54.7	Low	59.7	Low	59 Å²	59	69 Å²	69	38%	0.383	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-61.7	145.1	176.9	26.4	-34.2	0	0	0	110.3	N755 A841 I842	P753-N755 PolarHBondContact O-N 3.06Å; P753-N755 VanDerWaalsContact O-N 3.15Å; P753-A841 HydrophobicContact CG-CB 4.16Å; P753-I842 HydrophobicContact CB-CD1 4.08Å; P753-I842 HydrophobicContact CB-CG1 4.46Å; P753-I842 HydrophobicContact CG-CD1 3.78Å; P753-I842 HydrophobicContact CG-CG1 4.02Å
754	T	55.7	Low	60.5	Low	102 Å²	102	68.5 Å²	68.5	63%	0.626	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-64.8	117.3	178	-50.5	0	0	0	0	109.6	Y756	T754-Y756 VanDerWaalsContact O-CD2 3.23Å; T754-Y756 WeakPolarHBondContact O-CD2 3.05Å; T754-Y756 WeakPolarHBondContact O-CE2 3.19Å; T754-Y756 PolarHBondContact O-N 3.02Å
755	N	61.5	Low	61.7	Low	11 Å²	11	69 Å²	69	6%	0.059	40%	0.399	C	S	.	.			trans	-79.1	103	178.7	171.9	12.9	0	0	0	111.1	E739 P753 H757 I842 R844	E739-N755 HydrophobicContact CG-CB 4.1Å; E739-N755 WeakPolarHBondContact OE2-CB 3.2Å; E739-N755 PolarHBondContact OE2-ND2 3.19Å; P753-N755 PolarHBondContact O-N 3.06Å; P753-N755 VanDerWaalsContact O-N 3.15Å; N755-H757 PolarHBondContact O-N 3.07Å; N755-H757 VanDerWaalsContact OD1-CB 3.29Å; N755-H757 WeakPolarHBondContact OD1-CB 3.48Å; N755-H757 PolarHBondContact OD1-CD2 2.9Å; N755-H757 PolarHBondContact OD1-N 3.3Å; N755-I842 HydrophobicContact CB-CD1 4.25Å; N755-R844 PolarHBondContact ND2-NH2 3.06Å
756	Y	60.7	Low	63.5	Low	182 Å²	182	68.4 Å²	68.4	71%	0.714	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	11.5	179.5	-51.8	-79.9	0	0	0	114.7	T754	T754-Y756 VanDerWaalsContact O-CD2 3.23Å; T754-Y756 WeakPolarHBondContact O-CD2 3.05Å; T754-Y756 WeakPolarHBondContact O-CE2 3.19Å; T754-Y756 PolarHBondContact O-N 3.02Å
757	H	68.3	Low	65.8	Low	14 Å²	14	63.6 Å²	63.6	7%	0.065	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	12.8	-179.7	-48.5	-33.2	0	0	0	113	N755 S764 S779	N755-H757 PolarHBondContact O-N 3.07Å; N755-H757 VanDerWaalsContact OD1-CB 3.29Å; N755-H757 WeakPolarHBondContact OD1-CB 3.48Å; N755-H757 PolarHBondContact OD1-CD2 2.9Å; N755-H757 PolarHBondContact OD1-N 3.3Å; H757-S764 PolarHBondContact O-OG 3.41Å; H757-S779 WeakPolarHBondContact O-CB 3.33Å
758	I	77.6	Confident	68.1	Low	61 Å²	61	62.6 Å²	62.6	31%	0.313	34%	0.335	S	S	.	.	S	Bend	trans	-109.8	132	166.2	-56.7	177.8	0	0	0	106.7	T763	I758-T763 CarbonylContact C-O 3.59Å; I758-T763 WeakPolarHBondContact CA-O 3.44Å; I758-T763 WeakPolarHBondContact CG2-O 3.3Å
759	G	70.1	Confident	70.4	Confident	39 Å²	39	59.9 Å²	59.9	40%	0.402	32%	0.321	S	S	.	.			trans	-70.7	166.3	178.6	0	0	0	0	0	113	D761 G762 T763	G759-D761 PolarHBondContact O-N 2.98Å; G759-D761 VanDerWaalsContact O-N 3.15Å; G759-G762 WeakPolarHBondContact O-CA 3.41Å; G759-G762 PolarHBondContact O-N 3.27Å; G759-T763 PolarHBondContact N-O 2.89Å
760	E	66.6	Low	72.7	Confident	214 Å²	214	60.8 Å²	60.8	100%	1	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.4	179.9	-58.1	-175.3	155.8	0	0	113.1	G762	E760-G762 VanDerWaalsContact C-N 3.28Å
761	D	74.8	Confident	75	Confident	86 Å²	86	57 Å²	57	46%	0.46	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.9	173	71.7	-21.3	0	0	0	113.9	R734 G759 T763	R734-D761 PolarHBondContact NE-O 3.3Å; R734-D761 PolarHBondContact NH2-O 3.43Å; G759-D761 PolarHBondContact O-N 2.98Å; G759-D761 VanDerWaalsContact O-N 3.15Å; D761-T763 PolarHBondContact OD1-N 3.5Å; D761-T763 PolarHBondContact OD1-OG1 3.46Å; D761-T763 WeakPolarHBondContact OD2-CB 3.29Å; D761-T763 WeakPolarHBondContact OD2-CG2 3.15Å; D761-T763 PolarHBondContact OD2-OG1 2.84Å
762	G	78	Confident	77	Confident	30 Å²	30	54.8 Å²	54.8	31%	0.309	29%	0.288	S	S	.	.	S	Bend	trans	79.3	11.4	-175.1	0	0	0	0	0	115.1	R734 G759 E760	R734-G762 WeakPolarHBondContact CG-O 3.46Å; G759-G762 WeakPolarHBondContact O-CA 3.41Å; G759-G762 PolarHBondContact O-N 3.27Å; E760-G762 VanDerWaalsContact C-N 3.28Å
763	T	86.1	Confident	78.8	Confident	20 Å²	20	53.8 Å²	53.8	12%	0.123	28%	0.282	C	S	.	.			trans	-96.7	166.5	177.3	73.3	0	0	0	0	112.6	S732 T733 R734 I758 G759 D761	S732-T763 VanDerWaalsContact CB-OG1 3.28Å; S732-T763 WeakPolarHBondContact CB-OG1 3.25Å; T733-T763 WeakPolarHBondContact O-CA 3.38Å; R734-T763 HydrophobicContact CG-CG2 3.8Å; I758-T763 CarbonylContact C-O 3.59Å; I758-T763 WeakPolarHBondContact CA-O 3.44Å; I758-T763 WeakPolarHBondContact CG2-O 3.3Å; G759-T763 PolarHBondContact N-O 2.89Å; D761-T763 PolarHBondContact OD1-N 3.5Å; D761-T763 PolarHBondContact OD1-OG1 3.46Å; D761-T763 WeakPolarHBondContact OD2-CB 3.29Å; D761-T763 WeakPolarHBondContact OD2-CG2 3.15Å; D761-T763 PolarHBondContact OD2-OG1 2.84Å
764	S	88.4	Confident	80.5	Confident	4 Å²	4	51 Å²	51	3%	0.028	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.6	170.3	-167.8	0	0	0	0	110	S732 T733 H757 H777 S779	S732-S764 VanDerWaalsContact CA-O 3.28Å; S732-S764 WeakPolarHBondContact CA-O 3.36Å; T733-S764 PolarHBondContact N-O 2.67Å; T733-S764 PolarHBondContact O-N 3.02Å; H757-S764 PolarHBondContact O-OG 3.41Å; S764-H777 PolarHBondContact O-CD2 2.81Å; S764-S779 VanDerWaalsContact CB-OG 3.26Å; S764-S779 WeakPolarHBondContact CB-OG 3.39Å; S764-S779 WeakPolarHBondContact OG-CB 3.28Å; S764-S779 PolarHBondContact OG-N 3.41Å; S764-S779 PolarHBondContact OG-OG 2.97Å; S764-S779 VanDerWaalsContact OG-OG 3.11Å
765	L	88.9	Confident	82.2	Confident	35 Å²	35	46.7 Å²	46.7	18%	0.183	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	131.7	-175.5	-172.2	66.1	0	0	0	111.6	G730 I767 H777 A778	G730-L765 VanDerWaalsContact O-CD1 3.28Å; G730-L765 WeakPolarHBondContact O-CD1 3.45Å; L765-I767 HydrophobicContact CB-CG2 4.37Å; L765-I767 HydrophobicContact CD2-CG2 3.91Å; L765-I767 HydrophobicContact CG-CG2 3.93Å; L765-H777 WeakPolarHBondContact O-CA 3.36Å; L765-A778 PolarHBondContact O-N 3.46Å
766	L	90.1	Very high	83.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114.2	169.6	-72.1	172.8	0	0	0	110.6	C701 H729 G730 M731 T733	C701-L766 HydrophobicContact CB-CD2 4.19Å; H729-L766 PolarHBondContact ND1-O 3.48Å; G730-L766 PolarHBondContact N-O 2.97Å; G730-L766 VanDerWaalsContact N-O 3.15Å; M731-L766 WeakPolarHBondContact O-CB 3.2Å; M731-L766 PolarHBondContact O-N 2.94Å; T733-L766 HydrophobicContact CG2-CD1 3.97Å
767	I	90.2	Very high	85.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	138.4	-176	64.9	169.7	0	0	0	110	L765 Q775 V776 A778 L783 V788 W792	L765-I767 HydrophobicContact CB-CG2 4.37Å; L765-I767 HydrophobicContact CD2-CG2 3.91Å; L765-I767 HydrophobicContact CG-CG2 3.93Å; I767-Q775 VanDerWaalsContact O-CA 3.31Å; I767-Q775 WeakPolarHBondContact O-CA 3.43Å; I767-V776 HydrophobicContact CD1-CG2 4.08Å; I767-V776 HydrophobicContact CG1-CG2 3.72Å; I767-V776 WeakPolarHBondContact CG1-O 3.3Å; I767-V776 PolarHBondContact N-O 3.37Å; I767-V776 PolarHBondContact O-N 2.77Å; I767-A778 HydrophobicContact CD1-CB 4.22Å; I767-A778 HydrophobicContact CG2-CB 4.29Å; I767-L783 HydrophobicContact CD1-CB 4.43Å; I767-L783 HydrophobicContact CD1-CD1 3.44Å; I767-L783 VanDerWaalsContact CD1-CD1 3.44Å; I767-V788 HydrophobicContact CB-CG1 4.31Å; I767-V788 HydrophobicContact CD1-CG2 4.49Å; I767-V788 HydrophobicContact CG2-CB 4.41Å; I767-V788 HydrophobicContact CG2-CG1 3.75Å; I767-V788 HydrophobicContact CG2-CG2 4.41Å; I767-W792 HydrophobicContact CB-CE3 4.17Å; I767-W792 HydrophobicContact CB-CZ3 4.48Å; I767-W792 HydrophobicContact CD1-CD2 3.99Å; I767-W792 HydrophobicContact CD1-CE3 3.99Å; I767-W792 HydrophobicContact CD1-CH2 3.89Å; I767-W792 HydrophobicContact CD1-CZ2 3.93Å; I767-W792 HydrophobicContact CD1-CZ3 3.94Å; I767-W792 HydrophobicContact CG1-CE3 4.05Å; I767-W792 HydrophobicContact CG1-CH2 4.29Å; I767-W792 HydrophobicContact CG1-CZ3 3.92Å
768	R	91.3	Very high	86.3	Confident	103 Å²	103	36.8 Å²	36.8	39%	0.389	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.8	-174.6	-167.7	178.5	-176.3	-160.7	4.1	111.6	H729 K770 A773 M774 Q775	H729-R768 HydrophobicContact CB-CB 4.06Å; R768-K770 PolarHBondContact O-N 3.44Å; R768-A773 WeakPolarHBondContact CG-O 3.47Å; R768-A773 PolarHBondContact NE-O 3.06Å; R768-A773 VanDerWaalsContact NE-O 3.09Å; R768-M774 CarbonylContact C-O 3.41Å; R768-M774 WeakPolarHBondContact CA-O 3.5Å; R768-Q775 HydrophobicContact CB-CB 4.41Å; R768-Q775 HydrophobicContact CB-CG 4.24Å; R768-Q775 HydrophobicContact CG-CB 4.23Å
769	C	91.3	Very high	86.9	Confident	1 Å²	1	34 Å²	34	1%	0.007	18%	0.182	C	C	.	.			trans	-70.9	122.8	-179.1	174.6	0	0	0	0	110.8	C771 A773 M774 W792 C794	C769-C771 VanDerWaalsContact C-N 3.28Å; C769-C771 PolarHBondContact O-N 3.31Å; C769-A773 VanDerWaalsContact O-CA 3.27Å; C769-A773 WeakPolarHBondContact O-CA 3.27Å; C769-A773 PolarHBondContact O-N 2.83Å; C769-M774 HydrophobicContact CB-CB 4.49Å; C769-M774 PolarHBondContact N-O 2.7Å; C769-W792 WeakPolarHBondContact CA-O 3.26Å; C769-W792 HydrophobicContact CB-CE3 4.09Å; C769-W792 HydrophobicContact CB-CZ3 3.86Å; C769-C794 HydrophobicContact CB-CB 4.19Å; C769-C794 PolarHBondContact SG-N 2.83Å; C769-C794 VanDerWaalsContact SG-N 3.41Å; C769-C794 VanDerWaalsContact SG-SG 3.6Å
770	K	90.2	Very high	87.9	Confident	119 Å²	119	32.2 Å²	32.2	52%	0.517	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.2	-178.5	68.8	-168.6	177.4	-150.4	0	113.8	R768 S791 W792 T793	R768-K770 PolarHBondContact O-N 3.44Å; K770-S791 VanDerWaalsContact CD-O 3.31Å; K770-S791 WeakPolarHBondContact CD-O 3.5Å; K770-S791 WeakPolarHBondContact CE-O 3.49Å; K770-S791 PolarHBondContact NZ-O 2.73Å; K770-S791 PolarHBondContact NZ-OG 3.23Å; K770-W792 PolarHBondContact N-O 3.19Å; K770-T793 HydrophobicContact CD-CG2 4.16Å; K770-T793 HydrophobicContact CG-CG2 3.72Å
771	C	89.5	Confident	89.1	Confident	42 Å²	42	22.1 Å²	22.1	28%	0.284	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-59.7	-177	-56.8	0	0	0	0	112.3	K688 C769 C797	K688-C771 WeakPolarHBondContact CD-O 3.13Å; K688-C771 WeakPolarHBondContact CE-O 3.11Å; K688-C771 PolarHBondContact NZ-O 3.25Å; C769-C771 VanDerWaalsContact C-N 3.28Å; C769-C771 PolarHBondContact O-N 3.31Å; C771-C797 HydrophobicContact CB-CB 3.79Å
772	C	89.7	Confident	89.8	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.007	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	7.7	-171.7	70.7	0	0	0	0	115.1	F684 N691 M774	F684-C772 HydrophobicContact CE2-CB 3.97Å; F684-C772 HydrophobicContact CZ-CB 3.78Å; N691-C772 WeakPolarHBondContact CB-O 3.33Å; N691-C772 PolarHBondContact ND2-O 2.83Å; C772-M774 PolarHBondContact O-N 3.43Å
773	A	90.5	Very high	90.2	Very high	7 Å²	7	18.3 Å²	18.3	6%	0.058	9%	0.09	C	C	.	.			trans	60.3	0.3	178.2	0	0	0	0	0	117.4	K688 A692 R768 C769	K688-A773 HydrophobicContact CG-CB 3.84Å; A692-A773 HydrophobicContact CB-CB 4.09Å; R768-A773 WeakPolarHBondContact CG-O 3.47Å; R768-A773 PolarHBondContact NE-O 3.06Å; R768-A773 VanDerWaalsContact NE-O 3.09Å; C769-A773 VanDerWaalsContact O-CA 3.27Å; C769-A773 WeakPolarHBondContact O-CA 3.27Å; C769-A773 PolarHBondContact O-N 2.83Å
774	M	91	Very high	90	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.106	C	C	.	.			trans	-58.1	130.7	177.4	-177.7	-160.1	82.8	0	0	111.6	N691 A702 R768 C769 C772 V776 Y781 W792 C794 G814 A815	N691-M774 HydrophobicContact CB-CB 4.27Å; A702-M774 HydrophobicContact CB-CG 4.4Å; R768-M774 CarbonylContact C-O 3.41Å; R768-M774 WeakPolarHBondContact CA-O 3.5Å; C769-M774 HydrophobicContact CB-CB 4.49Å; C769-M774 PolarHBondContact N-O 2.7Å; C772-M774 PolarHBondContact O-N 3.43Å; M774-V776 HydrophobicContact CE-CG1 3.96Å; M774-V776 HydrophobicContact CE-CG2 4.03Å; M774-V776 HydrophobicContact CG-CG1 4.42Å; M774-V776 HydrophobicContact SD-CG1 4.45Å; M774-Y781 HydrophobicContact CE-CD2 4.43Å; M774-Y781 HydrophobicContact CE-CE2 4.22Å; M774-W792 HydrophobicContact CE-CH2 3.54Å; M774-W792 HydrophobicContact CE-CZ3 3.99Å; M774-C794 HydrophobicContact CE-CB 3.58Å; M774-C794 HydrophobicContact SD-CB 4.49Å; M774-G814 VanDerWaalsContact SD-O 3.37Å; M774-A815 WeakPolarHBondContact SD-CA 3.46Å; M774-A815 HydrophobicContact SD-CB 3.92Å
775	Q	92.5	Very high	89.3	Confident	10 Å²	10	24.3 Å²	24.3	5%	0.047	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.2	177.5	-164.8	169.7	-86.8	0	0	111.6	A695 Y700 C701 A702 I767 R768	A695-Q775 HydrophobicContact CB-CB 3.51Å; A695-Q775 PolarHBondContact O-NE2 3.05Å; Y700-Q775 WeakPolarHBondContact O-CG 3.4Å; Y700-Q775 PolarHBondContact O-NE2 2.86Å; C701-Q775 WeakPolarHBondContact CA-O 3.47Å; A702-Q775 PolarHBondContact N-O 3.08Å; I767-Q775 VanDerWaalsContact O-CA 3.31Å; I767-Q775 WeakPolarHBondContact O-CA 3.43Å; R768-Q775 HydrophobicContact CB-CB 4.41Å; R768-Q775 HydrophobicContact CB-CG 4.24Å; R768-Q775 HydrophobicContact CG-CB 4.23Å
776	V	93.3	Very high	88.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.6	-178.7	-68.2	0	0	0	0	111.2	A702 V703 I767 M774 Y781 W792 A815	A702-V776 HydrophobicContact CB-CG1 4.27Å; V703-V776 HydrophobicContact CG2-CG1 3.91Å; I767-V776 HydrophobicContact CD1-CG2 4.08Å; I767-V776 HydrophobicContact CG1-CG2 3.72Å; I767-V776 WeakPolarHBondContact CG1-O 3.3Å; I767-V776 PolarHBondContact N-O 3.37Å; I767-V776 PolarHBondContact O-N 2.77Å; M774-V776 HydrophobicContact CE-CG1 3.96Å; M774-V776 HydrophobicContact CE-CG2 4.03Å; M774-V776 HydrophobicContact CG-CG1 4.42Å; M774-V776 HydrophobicContact SD-CG1 4.45Å; V776-Y781 HydrophobicContact CG2-CG 4.16Å; V776-W792 HydrophobicContact CG2-CH2 3.92Å; V776-W792 HydrophobicContact CG2-CZ3 4.22Å; V776-A815 HydrophobicContact CG1-CB 4.22Å
777	H	91.9	Very high	87.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	138	160.1	-66.7	109.3	0	0	0	109.9	C701 C704 T733 P735 S764 L765 S779 C780 Y781	C701-H777 VanDerWaalsContact CB-ND1 3.29Å; C701-H777 WeakPolarHBondContact CB-ND1 3.33Å; C701-H777 PolarHBondContact SG-N 3.07Å; C701-H777 VanDerWaalsContact SG-N 3.39Å; C704-H777 PolarHBondContact SG-ND1 3.08Å; T733-H777 PolarHBondContact O-NE2 3.34Å; T733-H777 PolarHBondContact OG1-NE2 2.96Å; P735-H777 HydrophobicContact CG-CB 4.35Å; S764-H777 PolarHBondContact O-CD2 2.81Å; L765-H777 WeakPolarHBondContact O-CA 3.36Å; H777-S779 VanDerWaalsContact C-N 3.28Å; H777-S779 PolarHBondContact O-N 3.38Å; H777-C780 HydrophobicContact CB-CB 4.04Å; H777-C780 PolarHBondContact O-N 3.43Å; H777-Y781 PolarHBondContact O-N 3.36Å
778	A	90.6	Very high	86.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.5	-44	175.7	0	0	0	0	0	111.8	L765 I767 C780 Y781 G782 L783	L765-A778 PolarHBondContact O-N 3.46Å; I767-A778 HydrophobicContact CD1-CB 4.22Å; I767-A778 HydrophobicContact CG2-CB 4.29Å; A778-C780 VanDerWaalsContact C-N 3.3Å; A778-C780 PolarHBondContact O-N 3.35Å; A778-Y781 PolarHBondContact O-N 2.78Å; A778-G782 PolarHBondContact O-N 3.3Å; A778-L783 HydrophobicContact CB-CB 4.4Å; A778-L783 PolarHBondContact O-N 3.23Å
779	S	90.3	Very high	84.8	Confident	2 Å²	2	38 Å²	38	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-30.4	174.7	60.3	0	0	0	0	114.8	P735 H757 S764 H777 R844	P735-S779 WeakPolarHBondContact CG-OG 3.47Å; H757-S779 WeakPolarHBondContact O-CB 3.33Å; S764-S779 VanDerWaalsContact CB-OG 3.26Å; S764-S779 WeakPolarHBondContact CB-OG 3.39Å; S764-S779 WeakPolarHBondContact OG-CB 3.28Å; S764-S779 PolarHBondContact OG-N 3.41Å; S764-S779 PolarHBondContact OG-OG 2.97Å; S764-S779 VanDerWaalsContact OG-OG 3.11Å; H777-S779 VanDerWaalsContact C-N 3.28Å; H777-S779 PolarHBondContact O-N 3.38Å; S779-R844 PolarHBondContact O-NE 3.1Å; S779-R844 VanDerWaalsContact O-NE 3.12Å; S779-R844 PolarHBondContact O-NH2 2.96Å
780	C	91.3	Very high	83.4	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-85.3	-11.4	179.4	-67.4	0	0	0	0	113.9	V703 C704 F742 H777 A778	V703-C780 HydrophobicContact CB-CB 4Å; V703-C780 HydrophobicContact CG1-CB 4.26Å; V703-C780 HydrophobicContact CG2-CB 4.24Å; C704-C780 VanDerWaalsContact SG-SG 3.69Å; F742-C780 HydrophobicContact CZ-CB 4.22Å; H777-C780 HydrophobicContact CB-CB 4.04Å; H777-C780 PolarHBondContact O-N 3.43Å; A778-C780 VanDerWaalsContact C-N 3.3Å; A778-C780 PolarHBondContact O-N 3.35Å
781	Y	92.6	Very high	82.6	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-114.7	-4	176.8	-160.2	-100	0	0	0	113.3	M774 V776 H777 A778 L783 W792 C794 T795 A815 L816 K817 V827	M774-Y781 HydrophobicContact CE-CD2 4.43Å; M774-Y781 HydrophobicContact CE-CE2 4.22Å; V776-Y781 HydrophobicContact CG2-CG 4.16Å; H777-Y781 PolarHBondContact O-N 3.36Å; A778-Y781 PolarHBondContact O-N 2.78Å; Y781-L783 HydrophobicContact CD1-CD1 3.76Å; Y781-L783 HydrophobicContact CD1-CG 4.3Å; Y781-W792 HydrophobicContact CD1-CH2 4.08Å; Y781-W792 AromaticContact CD1-CZ2 3.7Å; Y781-W792 HydrophobicContact CD1-CZ2 3.7Å; Y781-W792 HydrophobicContact CE1-CH2 4.19Å; Y781-W792 AromaticContact CE1-CZ2 3.74Å; Y781-W792 HydrophobicContact CE1-CZ2 3.74Å; Y781-C794 HydrophobicContact CE1-CB 4.15Å; Y781-T795 PolarHBondContact OH-N 2.83Å; Y781-T795 VanDerWaalsContact OH-N 3.15Å; Y781-T795 PolarHBondContact OH-OG1 3.46Å; Y781-A815 HydrophobicContact CD2-CB 4.18Å; Y781-A815 HydrophobicContact CE2-CB 4.14Å; Y781-L816 PolarHBondContact OH-O 3.48Å; Y781-K817 HydrophobicContact CE1-CD 4.16Å; Y781-K817 HydrophobicContact CE2-CD 4.1Å; Y781-K817 HydrophobicContact CE2-CG 4.19Å; Y781-K817 VanDerWaalsContact O-CE 3.23Å; Y781-K817 WeakPolarHBondContact O-CE 3.38Å; Y781-K817 PolarHBondContact O-NZ 2.85Å; Y781-V827 HydrophobicContact CD2-CG2 4.2Å; Y781-V827 HydrophobicContact CE2-CG2 4.24Å
782	G	88.6	Confident	82.6	Confident	4 Å²	4	42.2 Å²	42.2	4%	0.041	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	49	173.7	0	0	0	0	0	113	A778 I842	A778-G782 PolarHBondContact O-N 3.3Å; G782-I842 WeakPolarHBondContact CA-O 3.45Å
783	L	87.2	Confident	82.6	Confident	33 Å²	33	43.8 Å²	43.8	17%	0.173	23%	0.225	C	C	.	.			trans	-129.3	136.7	-176.4	-69.7	169.5	0	0	0	111.4	I767 A778 Y781 V788 W792	I767-L783 HydrophobicContact CD1-CB 4.43Å; I767-L783 HydrophobicContact CD1-CD1 3.44Å; I767-L783 VanDerWaalsContact CD1-CD1 3.44Å; A778-L783 HydrophobicContact CB-CB 4.4Å; A778-L783 PolarHBondContact O-N 3.23Å; Y781-L783 HydrophobicContact CD1-CD1 3.76Å; Y781-L783 HydrophobicContact CD1-CG 4.3Å; L783-V788 HydrophobicContact CB-CG2 4.26Å; L783-W792 HydrophobicContact CD1-CD2 4.47Å; L783-W792 VanDerWaalsContact CD1-CE2 3.42Å; L783-W792 HydrophobicContact CD1-CH2 4.38Å; L783-W792 HydrophobicContact CD1-CZ2 3.38Å; L783-W792 VanDerWaalsContact CD1-NE1 3.28Å
784	K	81.6	Confident	82.7	Confident	107 Å²	107	43.7 Å²	43.7	47%	0.465	22%	0.224	S	C	.	.			trans	-79.4	128	179.9	-38	-161.3	173.3	-178.9	0	108.9	E786 S787	K784-E786 WeakPolarHBondContact CB-OE2 3.18Å; K784-E786 PolarHBondContact O-N 2.94Å; K784-E786 VanDerWaalsContact O-N 3.09Å; K784-S787 WeakPolarHBondContact O-CB 3.43Å; K784-S787 PolarHBondContact O-N 3.46Å; K784-S787 PolarHBondContact O-OG 2.87Å
785	P	73.1	Confident	82.6	Confident	43 Å²	43	45.2 Å²	45.2	28%	0.279	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-52	-36.6	-176.7	-27.9	35.5	0	0	0	113.8	S787 V788	P785-S787 VanDerWaalsContact C-N 3.26Å; P785-S787 PolarHBondContact O-N 3.47Å; P785-V788 PolarHBondContact O-N 2.94Å; P785-V788 VanDerWaalsContact O-N 3.11Å
786	E	70.3	Confident	82.6	Confident	123 Å²	123	44.8 Å²	44.8	58%	0.575	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-71.2	-22.3	-176.4	-45.7	68.6	-143.9	0	0	112.7	K784 R789	K784-E786 WeakPolarHBondContact CB-OE2 3.18Å; K784-E786 PolarHBondContact O-N 2.94Å; K784-E786 VanDerWaalsContact O-N 3.09Å; E786-R789 PolarHBondContact O-NE 2.95Å
787	S	69.6	Low	82.5	Confident	77 Å²	77	45.2 Å²	45.2	54%	0.538	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-83.9	-15.3	174.8	72.8	0	0	0	0	112.9	K784 P785 R789	K784-S787 WeakPolarHBondContact O-CB 3.43Å; K784-S787 PolarHBondContact O-N 3.46Å; K784-S787 PolarHBondContact O-OG 2.87Å; P785-S787 VanDerWaalsContact C-N 3.26Å; P785-S787 PolarHBondContact O-N 3.47Å; S787-R789 PolarHBondContact O-N 3.09Å
788	V	69.4	Low	82.4	Confident	21 Å²	21	49.6 Å²	49.6	13%	0.127	26%	0.261	C	S	.	.			trans	-96.5	71.6	178.9	-169.4	0	0	0	0	110.1	I767 L783 P785 W792	I767-V788 HydrophobicContact CB-CG1 4.31Å; I767-V788 HydrophobicContact CD1-CG2 4.49Å; I767-V788 HydrophobicContact CG2-CB 4.41Å; I767-V788 HydrophobicContact CG2-CG1 3.75Å; I767-V788 HydrophobicContact CG2-CG2 4.41Å; L783-V788 HydrophobicContact CB-CG2 4.26Å; P785-V788 PolarHBondContact O-N 2.94Å; P785-V788 VanDerWaalsContact O-N 3.11Å; V788-W792 HydrophobicContact CG1-CB 4.03Å; V788-W792 HydrophobicContact CG1-CG 4.38Å
789	R	57.4	Low	82.3	Confident	204 Å²	204	52.2 Å²	52.2	77%	0.77	28%	0.283	S	S	*	.			trans	-87.6	167.7	162.2	-53.1	-173.6	-163.9	-162.3	3.5	109.2	E786 S787	E786-R789 PolarHBondContact O-NE 2.95Å; S787-R789 PolarHBondContact O-N 3.09Å
790	D	61.5	Low	82.2	Confident	151 Å²	151	59.4 Å²	59.4	81%	0.807	32%	0.316	S	S	*	.	S	Bend	trans	-51	140.7	-158.3	-61.6	-77.7	0	0	0	116.4
791	S	72.9	Confident	81.9	Confident	69 Å²	69	60.1 Å²	60.1	48%	0.483	32%	0.322	S	S	.	.	S	Bend	trans	77.9	46.8	175.7	88	0	0	0	0	117.3	K770	K770-S791 VanDerWaalsContact CD-O 3.31Å; K770-S791 WeakPolarHBondContact CD-O 3.5Å; K770-S791 WeakPolarHBondContact CE-O 3.49Å; K770-S791 PolarHBondContact NZ-O 2.73Å; K770-S791 PolarHBondContact NZ-OG 3.23Å
792	W	88.7	Confident	81.3	Confident	30 Å²	30	65.9 Å²	65.9	11%	0.114	34%	0.344	C	S	.	.			trans	-58.5	151	175.9	177.3	70.4	0	0	0	116.3	I767 C769 K770 M774 V776 Y781 L783 V788 C794	I767-W792 HydrophobicContact CB-CE3 4.17Å; I767-W792 HydrophobicContact CB-CZ3 4.48Å; I767-W792 HydrophobicContact CD1-CD2 3.99Å; I767-W792 HydrophobicContact CD1-CE3 3.99Å; I767-W792 HydrophobicContact CD1-CH2 3.89Å; I767-W792 HydrophobicContact CD1-CZ2 3.93Å; I767-W792 HydrophobicContact CD1-CZ3 3.94Å; I767-W792 HydrophobicContact CG1-CE3 4.05Å; I767-W792 HydrophobicContact CG1-CH2 4.29Å; I767-W792 HydrophobicContact CG1-CZ3 3.92Å; C769-W792 WeakPolarHBondContact CA-O 3.26Å; C769-W792 HydrophobicContact CB-CE3 4.09Å; C769-W792 HydrophobicContact CB-CZ3 3.86Å; K770-W792 PolarHBondContact N-O 3.19Å; M774-W792 HydrophobicContact CE-CH2 3.54Å; M774-W792 HydrophobicContact CE-CZ3 3.99Å; V776-W792 HydrophobicContact CG2-CH2 3.92Å; V776-W792 HydrophobicContact CG2-CZ3 4.22Å; Y781-W792 HydrophobicContact CD1-CH2 4.08Å; Y781-W792 AromaticContact CD1-CZ2 3.7Å; Y781-W792 HydrophobicContact CD1-CZ2 3.7Å; Y781-W792 HydrophobicContact CE1-CH2 4.19Å; Y781-W792 AromaticContact CE1-CZ2 3.74Å; Y781-W792 HydrophobicContact CE1-CZ2 3.74Å; L783-W792 HydrophobicContact CD1-CD2 4.47Å; L783-W792 VanDerWaalsContact CD1-CE2 3.42Å; L783-W792 HydrophobicContact CD1-CH2 4.38Å; L783-W792 HydrophobicContact CD1-CZ2 3.38Å; L783-W792 VanDerWaalsContact CD1-NE1 3.28Å; V788-W792 HydrophobicContact CG1-CB 4.03Å; V788-W792 HydrophobicContact CG1-CG 4.38Å; W792-C794 HydrophobicContact CH2-CB 3.59Å; W792-C794 VanDerWaalsContact CZ2-CA 3.49Å; W792-C794 HydrophobicContact CZ2-CB 3.75Å; W792-C794 HydrophobicContact CZ3-CB 4.31Å
793	T	90.7	Very high	80.9	Confident	35 Å²	35	70.3 Å²	70.3	22%	0.215	37%	0.37	C	S	.	.			trans	-129	135.9	170	46.6	0	0	0	0	112	K770 T798	K770-T793 HydrophobicContact CD-CG2 4.16Å; K770-T793 HydrophobicContact CG-CG2 3.72Å; T793-T798 WeakPolarHBondContact CB-OG1 3.26Å; T793-T798 PolarHBondContact O-OG1 3.16Å; T793-T798 PolarHBondContact OG1-OG1 3.4Å
794	C	91.4	Very high	80.8	Confident	4 Å²	4	70.3 Å²	70.3	3%	0.027	37%	0.371	C	S	.	.			trans	-73.7	156.8	174.7	68.3	0	0	0	0	112.2	C769 M774 Y781 W792 R796 C797 T798	C769-C794 HydrophobicContact CB-CB 4.19Å; C769-C794 PolarHBondContact SG-N 2.83Å; C769-C794 VanDerWaalsContact SG-N 3.41Å; C769-C794 VanDerWaalsContact SG-SG 3.6Å; M774-C794 HydrophobicContact CE-CB 3.58Å; M774-C794 HydrophobicContact SD-CB 4.49Å; Y781-C794 HydrophobicContact CE1-CB 4.15Å; W792-C794 HydrophobicContact CH2-CB 3.59Å; W792-C794 VanDerWaalsContact CZ2-CA 3.49Å; W792-C794 HydrophobicContact CZ2-CB 3.75Å; W792-C794 HydrophobicContact CZ3-CB 4.31Å; C794-R796 PolarHBondContact O-N 2.82Å; C794-C797 WeakPolarHBondContact O-CA 3.31Å; C794-C797 PolarHBondContact O-N 3.31Å; C794-T798 PolarHBondContact O-N 3.13Å; C794-T798 PolarHBondContact O-OG1 3.04Å
795	T	90	Very high	80.9	Confident	33 Å²	33	67.6 Å²	67.6	20%	0.202	36%	0.36	C	S	.	.	H	α-helix	trans	-49.5	-42.1	-172	-47	0	0	0	0	112.9	Y781 C797 T798 A799 W824	Y781-T795 PolarHBondContact OH-N 2.83Å; Y781-T795 VanDerWaalsContact OH-N 3.15Å; Y781-T795 PolarHBondContact OH-OG1 3.46Å; T795-C797 PolarHBondContact O-N 3.38Å; T795-T798 PolarHBondContact O-N 2.93Å; T795-A799 VanDerWaalsContact O-CB 3.32Å; T795-A799 WeakPolarHBondContact O-CB 3.33Å; T795-A799 PolarHBondContact O-N 2.92Å; T795-W824 HydrophobicContact CG2-CH2 4.2Å; T795-W824 HydrophobicContact CG2-CZ3 4.36Å
796	R	91.8	Very high	81.7	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-37.5	176.6	-172.5	176.9	71	151	2.6	114.1	E687 C794 E800 A801 V804 W824	E687-R796 IonicContact OE1-NH1 2.65Å; E687-R796 IonicContact OE2-CZ 3.8Å; E687-R796 IonicContact OE2-NH1 2.65Å; E687-R796 PolarHBondContact OE2-NH1 2.99Å; E687-R796 IonicContact OE2-NH2 3.12Å; E687-R796 PolarHBondContact OE2-NH2 2.89Å; C794-R796 PolarHBondContact O-N 2.82Å; R796-E800 PolarHBondContact O-N 3.28Å; R796-A801 WeakPolarHBondContact CD-O 3.17Å; R796-A801 HydrophobicContact CG-CB 4.06Å; R796-A801 WeakPolarHBondContact CG-O 3.49Å; R796-A801 PolarHBondContact O-N 3.21Å; R796-V804 HydrophobicContact CG-CG2 4.08Å; R796-W824 VanDerWaalsContact CA-CH2 3.48Å; R796-W824 HydrophobicContact CB-CE3 4.34Å; R796-W824 HydrophobicContact CB-CH2 4.05Å; R796-W824 HydrophobicContact CB-CZ3 3.73Å; R796-W824 HydrophobicContact CG-CH2 4.45Å; R796-W824 HydrophobicContact CG-CZ3 4.32Å
797	C	90.8	Very high	82.7	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-82.4	-31.4	-180	-70.5	0	0	0	0	112.2	C771 C794 T795 E800	C771-C797 HydrophobicContact CB-CB 3.79Å; C794-C797 WeakPolarHBondContact O-CA 3.31Å; C794-C797 PolarHBondContact O-N 3.31Å; T795-C797 PolarHBondContact O-N 3.38Å; C797-E800 PolarHBondContact O-N 3.49Å
798	T	91.1	Very high	83.6	Confident	91 Å²	91	57.4 Å²	57.4	56%	0.558	30%	0.302	S	S	*	.	H	α-helix	trans	-67.5	-35.1	171.7	-51.9	0	0	0	0	111.8	T793 C794 T795 E800	T793-T798 WeakPolarHBondContact CB-OG1 3.26Å; T793-T798 PolarHBondContact O-OG1 3.16Å; T793-T798 PolarHBondContact OG1-OG1 3.4Å; C794-T798 PolarHBondContact O-N 3.13Å; C794-T798 PolarHBondContact O-OG1 3.04Å; T795-T798 PolarHBondContact O-N 2.93Å; T798-E800 VanDerWaalsContact C-N 3.3Å; T798-E800 PolarHBondContact O-N 3.14Å
799	A	87.8	Confident	84.6	Confident	56 Å²	56	56.5 Å²	56.5	46%	0.463	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	12.9	175.5	0	0	0	0	0	114.2	T795 A801 W824	T795-A799 VanDerWaalsContact O-CB 3.32Å; T795-A799 WeakPolarHBondContact O-CB 3.33Å; T795-A799 PolarHBondContact O-N 2.92Å; A799-A801 HydrophobicContact CB-CB 4.39Å; A799-A801 PolarHBondContact O-N 3.38Å; A799-W824 HydrophobicContact CB-CH2 4.23Å; A799-W824 HydrophobicContact CB-CZ2 4.27Å
800	E	87.8	Confident	85.7	Confident	153 Å²	153	47.1 Å²	47.1	72%	0.715	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	16.8	-177.9	-54.8	-163.5	149.2	0	0	116	R796 C797 T798 W802	R796-E800 PolarHBondContact O-N 3.28Å; C797-E800 PolarHBondContact O-N 3.49Å; T798-E800 VanDerWaalsContact C-N 3.3Å; T798-E800 PolarHBondContact O-N 3.14Å; E800-W802 VanDerWaalsContact C-CD1 3.47Å; E800-W802 PolarHBondContact O-N 3Å
801	A	85.4	Confident	86.7	Confident	16 Å²	16	40.3 Å²	40.3	13%	0.132	23%	0.226	C	C	.	.			trans	-81.8	51.2	-168	0	0	0	0	0	112.4	R796 A799 V803 V804 W824	R796-A801 WeakPolarHBondContact CD-O 3.17Å; R796-A801 HydrophobicContact CG-CB 4.06Å; R796-A801 WeakPolarHBondContact CG-O 3.49Å; R796-A801 PolarHBondContact O-N 3.21Å; A799-A801 HydrophobicContact CB-CB 4.39Å; A799-A801 PolarHBondContact O-N 3.38Å; A801-V803 VanDerWaalsContact C-N 3.31Å; A801-V803 PolarHBondContact O-N 3.34Å; A801-V804 HydrophobicContact CB-CG1 3.84Å; A801-V804 HydrophobicContact CB-CG2 4.17Å; A801-V804 WeakPolarHBondContact O-CG2 3.44Å; A801-V804 PolarHBondContact O-N 3.24Å; A801-W824 HydrophobicContact CB-CH2 4.32Å; A801-W824 HydrophobicContact CB-CZ2 3.62Å
802	W	80.1	Confident	87.3	Confident	123 Å²	123	37.5 Å²	37.5	47%	0.466	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-22.9	-166.4	-54.4	-10.7	0	0	0	114.3	F684 E800	F684-W802 HydrophobicContact CD2-CB 4.01Å; F684-W802 HydrophobicContact CD2-CG 4.32Å; F684-W802 HydrophobicContact CE2-CB 4.26Å; F684-W802 HydrophobicContact CE2-CG 4.16Å; E800-W802 VanDerWaalsContact C-CD1 3.47Å; E800-W802 PolarHBondContact O-N 3Å
803	V	80.9	Confident	87.1	Confident	97 Å²	97	36.1 Å²	36.1	59%	0.588	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.8	-179.4	-64.5	0	0	0	0	114.4	P682 A801 R812	P682-V803 HydrophobicContact CB-CG1 4.41Å; P682-V803 HydrophobicContact CG-CB 4.47Å; P682-V803 HydrophobicContact CG-CG1 4.41Å; A801-V803 VanDerWaalsContact C-N 3.31Å; A801-V803 PolarHBondContact O-N 3.34Å; V803-R812 PolarHBondContact O-NH1 2.78Å; V803-R812 PolarHBondContact O-NH2 2.93Å
804	V	84.7	Confident	87	Confident	33 Å²	33	35.1 Å²	35.1	20%	0.2	20%	0.196	C	C	.	.			trans	-70.7	157.2	-166.4	-51.3	0	0	0	0	114	R796 A801 W824	R796-V804 HydrophobicContact CG-CG2 4.08Å; A801-V804 HydrophobicContact CB-CG1 3.84Å; A801-V804 HydrophobicContact CB-CG2 4.17Å; A801-V804 WeakPolarHBondContact O-CG2 3.44Å; A801-V804 PolarHBondContact O-N 3.24Å; V804-W824 HydrophobicContact CB-CG 4Å; V804-W824 HydrophobicContact CG2-CB 4.06Å; V804-W824 HydrophobicContact CG2-CD2 3.68Å; V804-W824 HydrophobicContact CG2-CE3 4.41Å; V804-W824 HydrophobicContact CG2-CG 3.47Å; V804-W824 VanDerWaalsContact CG2-CG 3.47Å
805	E	84.1	Confident	87.1	Confident	49 Å²	49	35 Å²	35	23%	0.229	20%	0.195	C	C	.	.			trans	-126.3	152.9	-169.3	-58.1	-176.5	139.8	0	0	111.8	R678 C807 R812	R678-E805 IonicContact CZ-OE2 2.69Å; R678-E805 IonicContact NE-OE1 2.73Å; R678-E805 IonicContact NE-OE2 2.71Å; R678-E805 PolarHBondContact NE-OE2 3.13Å; R678-E805 IonicContact NH2-OE2 2.79Å; R678-E805 PolarHBondContact NH2-OE2 3Å; E805-C807 PolarHBondContact O-N 3.27Å; E805-R812 VanDerWaalsContact CD-NH2 3.29Å; E805-R812 IonicContact OE1-CZ 3.73Å; E805-R812 IonicContact OE1-NE 3.14Å; E805-R812 IonicContact OE1-NH2 2.69Å; E805-R812 PolarHBondContact OE1-NH2 2.86Å
806	C	90.1	Very high	87.2	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.007	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-71.5	118.6	171.4	177.3	0	0	0	0	111	L808 C809 L816 W824 H826	C806-L808 PolarHBondContact O-N 3.25Å; C806-L808 PolarHBondContact SG-N 3.09Å; C806-L808 VanDerWaalsContact SG-N 3.41Å; C806-C809 PolarHBondContact O-N 2.8Å; C806-C809 VanDerWaalsContact SG-SG 3.7Å; C806-L816 HydrophobicContact CB-CD2 4.13Å; C806-W824 CarbonylContact C-O 3.52Å; C806-W824 WeakPolarHBondContact CA-O 3.3Å; C806-H826 VanDerWaalsContact CB-CE1 3.4Å; C806-H826 WeakPolarHBondContact CB-CE1 3.27Å; C806-H826 VanDerWaalsContact CB-ND1 3.33Å; C806-H826 WeakPolarHBondContact CB-ND1 3.36Å; C806-H826 PolarHBondContact SG-N 2.91Å; C806-H826 PolarHBondContact SG-ND1 2.85Å
807	C	89.6	Confident	87.4	Confident	20 Å²	20	33.5 Å²	33.5	14%	0.135	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.7	176.7	61	0	0	0	0	114.8	E805 R823 W824	E805-C807 PolarHBondContact O-N 3.27Å; C807-R823 HydrophobicContact CB-CB 4.38Å; C807-W824 PolarHBondContact N-O 3.22Å; C807-W824 PolarHBondContact SG-O 2.96Å
808	L	90.4	Very high	87.5	Confident	8 Å²	8	36 Å²	36	4%	0.042	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-8.5	-177.8	-59.2	175.2	0	0	0	114	C806 A825 C829 V833 A836 V849 V852 G874 A875	C806-L808 PolarHBondContact O-N 3.25Å; C806-L808 PolarHBondContact SG-N 3.09Å; C806-L808 VanDerWaalsContact SG-N 3.41Å; L808-A825 HydrophobicContact CD1-CB 4.35Å; L808-C829 HydrophobicContact CB-CB 3.87Å; L808-C829 HydrophobicContact CD1-CB 3.82Å; L808-C829 HydrophobicContact CG-CB 4.48Å; L808-V833 HydrophobicContact CD1-CB 4.49Å; L808-V833 HydrophobicContact CD1-CG2 4.25Å; L808-A836 HydrophobicContact CD1-CB 4.16Å; L808-V849 HydrophobicContact CD1-CG1 4.22Å; L808-V849 HydrophobicContact CD2-CG1 4.26Å; L808-V849 HydrophobicContact CG-CG1 4.44Å; L808-V852 HydrophobicContact CD2-CG2 4.39Å; L808-G874 VanDerWaalsContact C-CA 3.44Å; L808-G874 CarbonylContact O-C 3.5Å; L808-G874 VanDerWaalsContact O-CA 3.23Å; L808-G874 WeakPolarHBondContact O-CA 3.17Å; L808-A875 HydrophobicContact CD2-CB 4.1Å; L808-A875 PolarHBondContact O-N 3.29Å; L808-A875 VanDerWaalsContact O-N 3.14Å
809	C	88.6	Confident	87.6	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.014	17%	0.172	C	C	.	.			trans	-162.4	165.4	-179.3	72.4	0	0	0	0	114	C806 L811 H826 H889 T891	C806-C809 PolarHBondContact O-N 2.8Å; C806-C809 VanDerWaalsContact SG-SG 3.7Å; C809-L811 PolarHBondContact O-N 3.38Å; C809-H826 PolarHBondContact SG-CE1 2.87Å; C809-H826 PolarHBondContact SG-ND1 2.98Å; C809-H889 HydrophobicContact CB-CB 4.01Å; C809-T891 VanDerWaalsContact CB-OG1 3.24Å; C809-T891 WeakPolarHBondContact CB-OG1 3.46Å; C809-T891 PolarHBondContact SG-OG1 3.18Å
810	N	81.1	Confident	87.7	Confident	7 Å²	7	32.4 Å²	32.4	4%	0.037	17%	0.17	C	C	.	.	S	Bend	trans	-92.4	21.9	-173.6	-64.2	-9	0	0	0	115.5	W677 R678	W677-N810 WeakPolarHBondContact CA-O 3.32Å; R678-N810 HydrophobicContact CB-CB 3.94Å; R678-N810 PolarHBondContact N-O 3.39Å
811	L	83.4	Confident	87.8	Confident	8 Å²	8	28.4 Å²	28.4	4%	0.042	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-108.8	148.7	-179.9	-170.4	71.8	0	0	0	111.5	L676 F690 C809 H826 T891 I895	L676-L811 HydrophobicContact CB-CD1 3.88Å; L676-L811 CarbonylContact O-C 3.56Å; F690-L811 HydrophobicContact CZ-CD2 4.34Å; C809-L811 PolarHBondContact O-N 3.38Å; L811-H826 PolarHBondContact O-CE1 2.97Å; L811-H826 VanDerWaalsContact O-CE1 3.26Å; L811-T891 HydrophobicContact CB-CG2 4.2Å; L811-T891 HydrophobicContact CD2-CG2 3.88Å; L811-I895 HydrophobicContact CD1-CD1 3.93Å; L811-I895 HydrophobicContact CD2-CD1 3.85Å
812	R	83.9	Confident	87.9	Confident	11 Å²	11	33.8 Å²	33.8	4%	0.042	18%	0.18	C	C	.	.			trans	-108.6	160	173.1	-67	177.9	159.3	-81.6	-8.4	112.5	L676 E687 V803 E805	L676-R812 WeakPolarHBondContact O-CB 3.2Å; L676-R812 PolarHBondContact O-N 2.78Å; E687-R812 HydrophobicContact CG-CB 3.9Å; E687-R812 WeakPolarHBondContact OE1-CB 3.31Å; E687-R812 IonicContact OE1-NH1 3.93Å; E687-R812 PolarHBondContact OE1-NH1 3.44Å; V803-R812 PolarHBondContact O-NH1 2.78Å; V803-R812 PolarHBondContact O-NH2 2.93Å; E805-R812 VanDerWaalsContact CD-NH2 3.29Å; E805-R812 IonicContact OE1-CZ 3.73Å; E805-R812 IonicContact OE1-NE 3.14Å; E805-R812 IonicContact OE1-NH2 2.69Å; E805-R812 PolarHBondContact OE1-NH2 2.86Å
813	G	84.9	Confident	88.4	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.01	18%	0.176	C	C	.	.	S	Bend	trans	90.5	-159.5	-173.7	0	0	0	0	0	113.2	E687 H826	E687-G813 PolarHBondContact OE2-N 2.82Å; G813-H826 PolarHBondContact O-CD2 3.18Å; G813-H826 PolarHBondContact O-NE2 3.13Å
814	G	89.1	Confident	89	Confident	14 Å²	14	29 Å²	29	14%	0.144	15%	0.151	C	C	.	.	S	Bend	trans	67.4	-171	177	0	0	0	0	0	115.6	N691 M774 L816	N691-G814 PolarHBondContact OD1-N 2.79Å; M774-G814 VanDerWaalsContact SD-O 3.37Å; G814-L816 PolarHBondContact O-N 2.8Å
815	A	93.1	Very high	89.4	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.008	14%	0.142	C	C	.	.			trans	-83.9	111.2	-179.1	0	0	0	0	0	111.6	V703 M774 V776 Y781 H826 V827	V703-A815 HydrophobicContact CG2-CB 3.78Å; M774-A815 WeakPolarHBondContact SD-CA 3.46Å; M774-A815 HydrophobicContact SD-CB 3.92Å; V776-A815 HydrophobicContact CG1-CB 4.22Å; Y781-A815 HydrophobicContact CD2-CB 4.18Å; Y781-A815 HydrophobicContact CE2-CB 4.14Å; A815-H826 CarbonylContact O-C 3.49Å; A815-H826 WeakPolarHBondContact O-CA 3.3Å; A815-V827 HydrophobicContact CB-CB 4.26Å; A815-V827 HydrophobicContact CB-CG2 4.04Å; A815-V827 PolarHBondContact O-N 3.01Å
816	L	93.3	Very high	89.8	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.6	-178.4	-73.2	161.7	0	0	0	111.4	Y781 C806 G814 W824 A825 H826	Y781-L816 PolarHBondContact OH-O 3.48Å; C806-L816 HydrophobicContact CB-CD2 4.13Å; G814-L816 PolarHBondContact O-N 2.8Å; L816-W824 HydrophobicContact CB-CE3 4.09Å; L816-W824 HydrophobicContact CD2-CB 4.49Å; L816-A825 WeakPolarHBondContact CA-O 3.29Å; L816-H826 WeakPolarHBondContact CD2-CD2 3.38Å
817	K	94.2	Very high	90	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	159	170	-68.3	-78.8	-133.5	178.3	0	108.9	Y781 W824 A825 V827 D843 R844 E845 V847	Y781-K817 HydrophobicContact CE1-CD 4.16Å; Y781-K817 HydrophobicContact CE2-CD 4.1Å; Y781-K817 HydrophobicContact CE2-CG 4.19Å; Y781-K817 VanDerWaalsContact O-CE 3.23Å; Y781-K817 WeakPolarHBondContact O-CE 3.38Å; Y781-K817 PolarHBondContact O-NZ 2.85Å; K817-W824 VanDerWaalsContact C-CE3 3.47Å; K817-W824 WeakPolarHBondContact O-CA 3.4Å; K817-A825 PolarHBondContact N-O 3.36Å; K817-A825 PolarHBondContact O-N 2.87Å; K817-V827 HydrophobicContact CG-CG2 3.86Å; K817-D843 WeakPolarHBondContact CE-O 3.37Å; K817-D843 PolarHBondContact NZ-O 2.76Å; K817-R844 VanDerWaalsContact CE-O 3.26Å; K817-R844 WeakPolarHBondContact CE-O 3.13Å; K817-E845 HydrophobicContact CB-CB 4.4Å; K817-E845 HydrophobicContact CD-CB 3.96Å; K817-E845 WeakPolarHBondContact CD-OE2 3.49Å; K817-E845 HydrophobicContact CG-CB 4.47Å; K817-E845 IonicContact NZ-OE1 3.47Å; K817-E845 PolarHBondContact NZ-OE1 3.11Å; K817-E845 IonicContact NZ-OE2 3.28Å; K817-E845 PolarHBondContact NZ-OE2 2.82Å; K817-V847 HydrophobicContact CB-CG2 4.3Å
818	M	93.4	Very high	90.2	Very high	63 Å²	63	24.8 Å²	24.8	31%	0.31	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	152.2	175.4	-79.1	175	60.8	0	0	111.8	R823 W824 P846 V847	M818-R823 WeakPolarHBondContact CA-O 3.37Å; M818-W824 HydrophobicContact CG-CD2 3.95Å; M818-W824 HydrophobicContact CG-CE3 4.12Å; M818-W824 HydrophobicContact CG-CH2 3.63Å; M818-W824 HydrophobicContact CG-CZ2 3.43Å; M818-W824 VanDerWaalsContact CG-CZ2 3.43Å; M818-W824 HydrophobicContact CG-CZ3 3.97Å; M818-W824 HydrophobicContact SD-CH2 4.29Å; M818-W824 HydrophobicContact SD-CZ2 3.99Å; M818-P846 WeakPolarHBondContact O-CA 3.31Å; M818-V847 PolarHBondContact O-N 2.93Å
819	T	92.9	Very high	90.3	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.018	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-96.5	165.5	170.8	54.7	0	0	0	0	112.3	D821 N822 R823 A825 V847 V849	T819-D821 WeakPolarHBondContact CB-OD1 3.46Å; T819-D821 PolarHBondContact O-N 3.07Å; T819-D821 PolarHBondContact OG1-OD1 3.04Å; T819-N822 PolarHBondContact O-N 3.47Å; T819-N822 VanDerWaalsContact O-N 3.16Å; T819-R823 PolarHBondContact N-O 2.87Å; T819-R823 VanDerWaalsContact OG1-CA 3.24Å; T819-R823 WeakPolarHBondContact OG1-CA 3.5Å; T819-R823 VanDerWaalsContact OG1-CB 3.32Å; T819-R823 WeakPolarHBondContact OG1-CB 3.44Å; T819-R823 PolarHBondContact OG1-N 2.88Å; T819-R823 PolarHBondContact OG1-O 2.97Å; T819-R823 VanDerWaalsContact OG1-O 3.07Å; T819-A825 HydrophobicContact CG2-CB 3.74Å; T819-V847 CarbonylContact C-O 3.56Å; T819-V847 WeakPolarHBondContact CA-O 3.45Å; T819-V847 WeakPolarHBondContact CB-O 3Å; T819-V847 HydrophobicContact CG2-CB 4.11Å; T819-V847 HydrophobicContact CG2-CG1 4.48Å; T819-V847 WeakPolarHBondContact CG2-O 3.34Å; T819-V849 HydrophobicContact CG2-CG1 3.97Å; T819-V849 HydrophobicContact CG2-CG2 4.15Å
820	T	91.3	Very high	90.4	Very high	67 Å²	67	24.5 Å²	24.5	41%	0.411	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.1	174.1	46.4	0	0	0	0	114.2	V839 P846 V847 D848	T820-V839 HydrophobicContact CG2-CG2 3.64Å; T820-P846 HydrophobicContact CG2-CB 4.32Å; T820-P846 HydrophobicContact CG2-CG 4.03Å; T820-V847 PolarHBondContact N-O 3.49Å; T820-D848 HydrophobicContact CG2-CB 3.81Å; T820-D848 WeakPolarHBondContact OG1-CA 3.41Å; T820-D848 PolarHBondContact OG1-OD1 3.17Å
821	D	88.9	Confident	90.9	Very high	69 Å²	69	24.4 Å²	24.4	37%	0.369	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	26.1	177.3	63.5	8	0	0	0	113.3	T819 R823	T819-D821 WeakPolarHBondContact CB-OD1 3.46Å; T819-D821 PolarHBondContact O-N 3.07Å; T819-D821 PolarHBondContact OG1-OD1 3.04Å; D821-R823 VanDerWaalsContact CG-NE 3.27Å; D821-R823 PolarHBondContact O-N 2.78Å; D821-R823 WeakPolarHBondContact OD1-CG 3.31Å; D821-R823 IonicContact OD1-CZ 3.1Å; D821-R823 IonicContact OD1-NE 2.68Å; D821-R823 PolarHBondContact OD1-NE 2.83Å; D821-R823 VanDerWaalsContact OD1-NE 3.09Å; D821-R823 IonicContact OD1-NH2 2.68Å; D821-R823 IonicContact OD2-CZ 3.46Å; D821-R823 IonicContact OD2-NE 3.36Å; D821-R823 PolarHBondContact OD2-NE 2.87Å; D821-R823 IonicContact OD2-NH2 2.7Å; D821-R823 PolarHBondContact OD2-NH2 2.88Å
822	N	87.8	Confident	91.2	Very high	129 Å²	129	24.3 Å²	24.3	69%	0.69	13%	0.127	S	C	*	.	S	Bend	trans	59.2	12.9	178	-63.3	-45.9	0	0	0	115.9	T819	T819-N822 PolarHBondContact O-N 3.47Å; T819-N822 VanDerWaalsContact O-N 3.16Å
823	R	91.4	Very high	91.6	Very high	100 Å²	100	23.8 Å²	23.8	38%	0.377	13%	0.125	S	C	.	.			trans	-85.1	-169	166.3	-54.5	-175.8	-68.4	168.7	-4.7	109.6	C807 M818 T819 D821	C807-R823 HydrophobicContact CB-CB 4.38Å; M818-R823 WeakPolarHBondContact CA-O 3.37Å; T819-R823 PolarHBondContact N-O 2.87Å; T819-R823 VanDerWaalsContact OG1-CA 3.24Å; T819-R823 WeakPolarHBondContact OG1-CA 3.5Å; T819-R823 VanDerWaalsContact OG1-CB 3.32Å; T819-R823 WeakPolarHBondContact OG1-CB 3.44Å; T819-R823 PolarHBondContact OG1-N 2.88Å; T819-R823 PolarHBondContact OG1-O 2.97Å; T819-R823 VanDerWaalsContact OG1-O 3.07Å; D821-R823 VanDerWaalsContact CG-NE 3.27Å; D821-R823 PolarHBondContact O-N 2.78Å; D821-R823 WeakPolarHBondContact OD1-CG 3.31Å; D821-R823 IonicContact OD1-CZ 3.1Å; D821-R823 IonicContact OD1-NE 2.68Å; D821-R823 PolarHBondContact OD1-NE 2.83Å; D821-R823 VanDerWaalsContact OD1-NE 3.09Å; D821-R823 IonicContact OD1-NH2 2.68Å; D821-R823 IonicContact OD2-CZ 3.46Å; D821-R823 IonicContact OD2-NE 3.36Å; D821-R823 PolarHBondContact OD2-NE 2.87Å; D821-R823 IonicContact OD2-NH2 2.7Å; D821-R823 PolarHBondContact OD2-NH2 2.88Å
824	W	92.3	Very high	91.6	Very high	19 Å²	19	25.3 Å²	25.3	7%	0.072	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.6	178.9	-68.6	76.7	0	0	0	110.8	T795 R796 A799 A801 V804 C806 C807 L816 K817 M818	T795-W824 HydrophobicContact CG2-CH2 4.2Å; T795-W824 HydrophobicContact CG2-CZ3 4.36Å; R796-W824 VanDerWaalsContact CA-CH2 3.48Å; R796-W824 HydrophobicContact CB-CE3 4.34Å; R796-W824 HydrophobicContact CB-CH2 4.05Å; R796-W824 HydrophobicContact CB-CZ3 3.73Å; R796-W824 HydrophobicContact CG-CH2 4.45Å; R796-W824 HydrophobicContact CG-CZ3 4.32Å; A799-W824 HydrophobicContact CB-CH2 4.23Å; A799-W824 HydrophobicContact CB-CZ2 4.27Å; A801-W824 HydrophobicContact CB-CH2 4.32Å; A801-W824 HydrophobicContact CB-CZ2 3.62Å; V804-W824 HydrophobicContact CB-CG 4Å; V804-W824 HydrophobicContact CG2-CB 4.06Å; V804-W824 HydrophobicContact CG2-CD2 3.68Å; V804-W824 HydrophobicContact CG2-CE3 4.41Å; V804-W824 HydrophobicContact CG2-CG 3.47Å; V804-W824 VanDerWaalsContact CG2-CG 3.47Å; C806-W824 CarbonylContact C-O 3.52Å; C806-W824 WeakPolarHBondContact CA-O 3.3Å; C807-W824 PolarHBondContact N-O 3.22Å; C807-W824 PolarHBondContact SG-O 2.96Å; L816-W824 HydrophobicContact CB-CE3 4.09Å; L816-W824 HydrophobicContact CD2-CB 4.49Å; K817-W824 VanDerWaalsContact C-CE3 3.47Å; K817-W824 WeakPolarHBondContact O-CA 3.4Å; M818-W824 HydrophobicContact CG-CD2 3.95Å; M818-W824 HydrophobicContact CG-CE3 4.12Å; M818-W824 HydrophobicContact CG-CH2 3.63Å; M818-W824 HydrophobicContact CG-CZ2 3.43Å; M818-W824 VanDerWaalsContact CG-CZ2 3.43Å; M818-W824 HydrophobicContact CG-CZ3 3.97Å; M818-W824 HydrophobicContact SD-CH2 4.29Å; M818-W824 HydrophobicContact SD-CZ2 3.99Å
825	A	93.4	Very high	91.6	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.5	176.3	0	0	0	0	0	110.9	L808 L816 K817 T819 V847	L808-A825 HydrophobicContact CD1-CB 4.35Å; L816-A825 WeakPolarHBondContact CA-O 3.29Å; K817-A825 PolarHBondContact N-O 3.36Å; K817-A825 PolarHBondContact O-N 2.87Å; T819-A825 HydrophobicContact CG2-CB 3.74Å; A825-V847 HydrophobicContact CB-CB 4.27Å; A825-V847 HydrophobicContact CB-CG1 4.1Å; A825-V847 HydrophobicContact CB-CG2 4.44Å
826	H	93.8	Very high	91.4	Very high	4 Å²	4	26 Å²	26	2%	0.019	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	139.2	169.3	-63.2	128.3	0	0	0	109.4	C806 C809 L811 G813 A815 L816 I828 C829 A830	C806-H826 VanDerWaalsContact CB-CE1 3.4Å; C806-H826 WeakPolarHBondContact CB-CE1 3.27Å; C806-H826 VanDerWaalsContact CB-ND1 3.33Å; C806-H826 WeakPolarHBondContact CB-ND1 3.36Å; C806-H826 PolarHBondContact SG-N 2.91Å; C806-H826 PolarHBondContact SG-ND1 2.85Å; C809-H826 PolarHBondContact SG-CE1 2.87Å; C809-H826 PolarHBondContact SG-ND1 2.98Å; L811-H826 PolarHBondContact O-CE1 2.97Å; L811-H826 VanDerWaalsContact O-CE1 3.26Å; G813-H826 PolarHBondContact O-CD2 3.18Å; G813-H826 PolarHBondContact O-NE2 3.13Å; A815-H826 CarbonylContact O-C 3.49Å; A815-H826 WeakPolarHBondContact O-CA 3.3Å; L816-H826 WeakPolarHBondContact CD2-CD2 3.38Å; H826-I828 HydrophobicContact CB-CG1 3.84Å; H826-I828 PolarHBondContact O-N 3.07Å; H826-C829 HydrophobicContact CB-CB 3.95Å; H826-C829 WeakPolarHBondContact O-CA 3.32Å; H826-C829 PolarHBondContact O-N 2.97Å; H826-A830 PolarHBondContact O-N 3.32Å
827	V	93.8	Very high	91.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-55	-41.2	172	-178.2	0	0	0	0	110.2	V703 F742 Y781 A815 K817 C829 A830 I831 F838	V703-V827 HydrophobicContact CG1-CB 4.36Å; V703-V827 HydrophobicContact CG1-CG1 3.67Å; V703-V827 HydrophobicContact CG2-CB 4.26Å; V703-V827 HydrophobicContact CG2-CG1 4.13Å; F742-V827 HydrophobicContact CE1-CG1 3.88Å; Y781-V827 HydrophobicContact CD2-CG2 4.2Å; Y781-V827 HydrophobicContact CE2-CG2 4.24Å; A815-V827 HydrophobicContact CB-CB 4.26Å; A815-V827 HydrophobicContact CB-CG2 4.04Å; A815-V827 PolarHBondContact O-N 3.01Å; K817-V827 HydrophobicContact CG-CG2 3.86Å; V827-C829 PolarHBondContact O-N 2.88Å; V827-A830 PolarHBondContact O-N 3.32Å; V827-I831 HydrophobicContact CG1-CD1 4.11Å; V827-I831 WeakPolarHBondContact O-CD1 3.16Å; V827-I831 VanDerWaalsContact O-CG1 3.31Å; V827-I831 WeakPolarHBondContact O-CG1 3.45Å; V827-I831 PolarHBondContact O-N 2.89Å; V827-F838 HydrophobicContact CG1-CE1 4.26Å; V827-F838 HydrophobicContact CG1-CZ 3.89Å
828	I	93.1	Very high	90.9	Very high	11 Å²	11	30.8 Å²	30.8	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-67.7	-30.3	175.3	59.9	168.7	0	0	0	114	V703 L706 H826 G832 T891 Q894	V703-I828 HydrophobicContact CB-CG2 4.42Å; V703-I828 HydrophobicContact CG1-CG2 4.09Å; L706-I828 HydrophobicContact CB-CB 4.38Å; L706-I828 HydrophobicContact CB-CG2 3.97Å; L706-I828 HydrophobicContact CD1-CB 4.43Å; L706-I828 HydrophobicContact CD2-CB 4.44Å; H826-I828 HydrophobicContact CB-CG1 3.84Å; H826-I828 PolarHBondContact O-N 3.07Å; I828-G832 PolarHBondContact O-N 2.95Å; I828-T891 HydrophobicContact CD1-CG2 4.01Å; I828-Q894 VanDerWaalsContact CD1-OE1 3.25Å
829	C	92.3	Very high	90.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-75.5	-35.1	173.8	-69.1	0	0	0	0	111.5	L808 H826 V827 G832 V833	L808-C829 HydrophobicContact CB-CB 3.87Å; L808-C829 HydrophobicContact CD1-CB 3.82Å; L808-C829 HydrophobicContact CG-CB 4.48Å; H826-C829 HydrophobicContact CB-CB 3.95Å; H826-C829 WeakPolarHBondContact O-CA 3.32Å; H826-C829 PolarHBondContact O-N 2.97Å; V827-C829 PolarHBondContact O-N 2.88Å; C829-G832 PolarHBondContact O-N 3.29Å; C829-V833 WeakPolarHBondContact O-CB 3.48Å; C829-V833 WeakPolarHBondContact O-CG2 3.47Å; C829-V833 PolarHBondContact O-N 2.84Å
830	A	92	Very high	90.1	Very high	4 Å²	4	34.6 Å²	34.6	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-67.1	-34.5	174.4	0	0	0	0	0	112.4	H826 V827 A836 F838 V847	H826-A830 PolarHBondContact O-N 3.32Å; V827-A830 PolarHBondContact O-N 3.32Å; A830-A836 HydrophobicContact CB-CB 4.48Å; A830-F838 HydrophobicContact CB-CE1 3.94Å; A830-F838 HydrophobicContact CB-CE2 3.93Å; A830-F838 HydrophobicContact CB-CZ 3.48Å; A830-F838 VanDerWaalsContact CB-CZ 3.48Å; A830-V847 HydrophobicContact CB-CG1 3.67Å; A830-V847 HydrophobicContact CB-CG2 4.11Å
831	I	91	Very high	89.7	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-71.8	-39.6	170.1	-64.6	159.5	0	0	0	111.6	V703 L706 V737 C741 F742 V827 F838 V909	V703-I831 HydrophobicContact CG1-CD1 3.75Å; L706-I831 HydrophobicContact CD2-CB 3.89Å; L706-I831 HydrophobicContact CD2-CD1 4.45Å; L706-I831 HydrophobicContact CD2-CG2 3.5Å; L706-I831 VanDerWaalsContact CD2-CG2 3.5Å; V737-I831 HydrophobicContact CG1-CD1 4Å; C741-I831 HydrophobicContact CB-CG1 4.32Å; C741-I831 HydrophobicContact CB-CG2 3.74Å; F742-I831 HydrophobicContact CD1-CD1 4.34Å; F742-I831 HydrophobicContact CD1-CG1 4.36Å; F742-I831 HydrophobicContact CE1-CD1 3.79Å; F742-I831 HydrophobicContact CE1-CG1 4.3Å; F742-I831 HydrophobicContact CZ-CD1 4.13Å; V827-I831 HydrophobicContact CG1-CD1 4.11Å; V827-I831 WeakPolarHBondContact O-CD1 3.16Å; V827-I831 VanDerWaalsContact O-CG1 3.31Å; V827-I831 WeakPolarHBondContact O-CG1 3.45Å; V827-I831 PolarHBondContact O-N 2.89Å; I831-F838 HydrophobicContact CG1-CE2 4.08Å; I831-F838 HydrophobicContact CG1-CZ 4.29Å; I831-V909 HydrophobicContact CG2-CG2 3.82Å
832	G	90.2	Very high	89.4	Confident	6 Å²	6	30.6 Å²	30.6	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-81.1	-32.2	-171.4	0	0	0	0	0	115.4	I828 C829 P834 I877	I828-G832 PolarHBondContact O-N 2.95Å; C829-G832 PolarHBondContact O-N 3.29Å; G832-P834 WeakPolarHBondContact O-CD 3.4Å; G832-I877 VanDerWaalsContact O-CG2 3.25Å; G832-I877 WeakPolarHBondContact O-CG2 3.32Å
833	V	90.6	Very high	89.3	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	14%	0.135	C	C	.	.	S	Bend	trans	-86.9	114.6	178.8	176.2	0	0	0	0	109.1	L808 C829 E835 A836 V852 A875 I877 V890	L808-V833 HydrophobicContact CD1-CB 4.49Å; L808-V833 HydrophobicContact CD1-CG2 4.25Å; C829-V833 WeakPolarHBondContact O-CB 3.48Å; C829-V833 WeakPolarHBondContact O-CG2 3.47Å; C829-V833 PolarHBondContact O-N 2.84Å; V833-E835 PolarHBondContact O-N 3.24Å; V833-A836 HydrophobicContact CB-CB 4.11Å; V833-A836 HydrophobicContact CG1-CB 4.32Å; V833-A836 PolarHBondContact O-N 2.99Å; V833-V852 HydrophobicContact CG1-CG1 4.27Å; V833-V852 HydrophobicContact CG1-CG2 4.01Å; V833-A875 HydrophobicContact CG1-CB 4.14Å; V833-A875 HydrophobicContact CG2-CB 4.16Å; V833-I877 HydrophobicContact CG2-CG2 4.43Å; V833-V890 HydrophobicContact CG2-CG2 4.03Å
834	P	85.9	Confident	89.2	Confident	33 Å²	33	22 Å²	22	21%	0.214	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.3	-169.1	-28.2	37.2	0	0	0	116.7	P646 L647 G832	P646-P834 HydrophobicContact CB-CG 3.82Å; L647-P834 HydrophobicContact CD2-CB 3.69Å; L647-P834 HydrophobicContact CG-CB 4.34Å; G832-P834 WeakPolarHBondContact O-CD 3.4Å
835	E	88.4	Confident	89	Confident	27 Å²	27	23.9 Å²	23.9	13%	0.126	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-0.3	178.9	-52.3	83.3	175.3	0	0	113.9	L647 V833 A851 V852 R856	L647-E835 HydrophobicContact CD2-CG 3.97Å; V833-E835 PolarHBondContact O-N 3.24Å; E835-A851 HydrophobicContact CB-CB 4.18Å; E835-A851 WeakPolarHBondContact CB-O 3.46Å; E835-V852 HydrophobicContact CB-CG2 4.15Å; E835-R856 IonicContact OE1-CZ 3.14Å; E835-R856 VanDerWaalsContact OE1-CZ 3.23Å; E835-R856 IonicContact OE1-NE 2.72Å; E835-R856 PolarHBondContact OE1-NE 2.85Å; E835-R856 IonicContact OE1-NH2 3.72Å; E835-R856 PolarHBondContact OE1-NH2 3.15Å; E835-R856 WeakPolarHBondContact OE2-CD 3.41Å; E835-R856 IonicContact OE2-CZ 2.74Å; E835-R856 IonicContact OE2-NE 2.73Å; E835-R856 PolarHBondContact OE2-NE 3.33Å; E835-R856 IonicContact OE2-NH2 3.93Å
836	A	89.1	Confident	88.8	Confident	2 Å²	2	26.3 Å²	26.3	2%	0.017	14%	0.142	C	C	.	.			trans	-82.8	144.1	166	0	0	0	0	0	109.3	L808 A830 V833 D848 V849 V852	L808-A836 HydrophobicContact CD1-CB 4.16Å; A830-A836 HydrophobicContact CB-CB 4.48Å; V833-A836 HydrophobicContact CB-CB 4.11Å; V833-A836 HydrophobicContact CG1-CB 4.32Å; V833-A836 PolarHBondContact O-N 2.99Å; A836-D848 WeakPolarHBondContact CA-O 3.45Å; A836-V849 HydrophobicContact CB-CG1 4.47Å; A836-V852 HydrophobicContact CB-CG2 4.46Å
837	R	87.4	Confident	88.8	Confident	93 Å²	93	26.1 Å²	26.1	35%	0.351	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.1	-179.7	63.3	-179.6	178.2	140.1	0.7	112.2	V744 V847 D848	V744-R837 WeakPolarHBondContact O-CB 3.48Å; R837-V847 CarbonylContact O-C 3.55Å; R837-V847 WeakPolarHBondContact O-CA 3.38Å; R837-D848 HydrophobicContact CG-CB 3.74Å; R837-D848 IonicContact CZ-OD2 2.79Å; R837-D848 PolarHBondContact N-O 3.35Å; R837-D848 IonicContact NE-OD2 2.99Å; R837-D848 PolarHBondContact NE-OD2 3.43Å; R837-D848 IonicContact NH2-OD2 3.7Å; R837-D848 PolarHBondContact NH2-OD2 3.22Å; R837-D848 PolarHBondContact O-N 3.26Å
838	F	89.1	Confident	88.6	Confident	11 Å²	11	26.4 Å²	26.4	5%	0.048	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.8	167.8	-58.2	-86.8	0	0	0	108.8	F742 V827 A830 I831 R844 V847	F742-F838 HydrophobicContact CB-CD2 4.09Å; F742-F838 HydrophobicContact CB-CE2 4.33Å; F742-F838 HydrophobicContact CD1-CD2 4.21Å; F742-F838 AromaticContact CD1-CE2 3.72Å; F742-F838 HydrophobicContact CD1-CE2 3.72Å; F742-F838 AromaticContact CD1-CZ 3.93Å; F742-F838 HydrophobicContact CD1-CZ 3.93Å; F742-F838 HydrophobicContact CE1-CZ 4.49Å; F742-F838 HydrophobicContact CG-CE2 4.45Å; F742-F838 WeakPolarHBondContact O-CD2 3.49Å; V827-F838 HydrophobicContact CG1-CE1 4.26Å; V827-F838 HydrophobicContact CG1-CZ 3.89Å; A830-F838 HydrophobicContact CB-CE1 3.94Å; A830-F838 HydrophobicContact CB-CE2 3.93Å; A830-F838 HydrophobicContact CB-CZ 3.48Å; A830-F838 VanDerWaalsContact CB-CZ 3.48Å; I831-F838 HydrophobicContact CG1-CE2 4.08Å; I831-F838 HydrophobicContact CG1-CZ 4.29Å; F838-R844 VanDerWaalsContact CD1-C 3.48Å; F838-R844 HydrophobicContact CD1-CB 4.01Å; F838-R844 WeakPolarHBondContact CD1-O 3.31Å; F838-R844 HydrophobicContact CE1-CB 4.09Å; F838-R844 WeakPolarHBondContact CE1-O 3.43Å; F838-V847 HydrophobicContact CD1-CG2 3.81Å; F838-V847 HydrophobicContact CE1-CG2 3.77Å
839	V	86.1	Confident	88.5	Confident	81 Å²	81	26.2 Å²	26.2	49%	0.491	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-49.1	-178.9	175.8	0	0	0	0	110.4	T820 P846 D848	T820-V839 HydrophobicContact CG2-CG2 3.64Å; V839-P846 HydrophobicContact CB-CG 4.03Å; V839-P846 HydrophobicContact CG2-CG 4.06Å; V839-P846 PolarHBondContact N-O 3.22Å; V839-D848 HydrophobicContact CG2-CB 3.85Å
840	N	84.7	Confident	88.3	Confident	65 Å²	65	30.7 Å²	30.7	35%	0.348	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	113	161.5	-175.1	-30.9	0	0	0	108.6	I842 D843 R844 E845	N840-I842 VanDerWaalsContact C-N 3.3Å; N840-I842 PolarHBondContact O-N 3.41Å; N840-I842 PolarHBondContact OD1-N 3.36Å; N840-D843 HydrophobicContact CB-CB 4.49Å; N840-D843 PolarHBondContact ND2-OD2 3.29Å; N840-D843 PolarHBondContact OD1-N 2.83Å; N840-D843 VanDerWaalsContact OD1-N 3.16Å; N840-R844 PolarHBondContact O-N 2.85Å; N840-E845 VanDerWaalsContact CB-O 3.26Å; N840-E845 WeakPolarHBondContact CB-O 3.41Å; N840-E845 PolarHBondContact N-O 2.72Å
841	A	82.4	Confident	88	Confident	19 Å²	19	33.1 Å²	33.1	16%	0.157	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-32.1	-179.5	0	0	0	0	0	112.5	P753 R844	P753-A841 HydrophobicContact CG-CB 4.16Å; A841-R844 WeakPolarHBondContact O-CD 3.42Å; A841-R844 PolarHBondContact O-NH1 3.06Å
842	I	83.1	Confident	87.8	Confident	32 Å²	32	33.2 Å²	33.2	16%	0.164	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-53.2	-177	-64.2	-63.6	0	0	0	111.6	P753 N755 G782 N840 R844	P753-I842 HydrophobicContact CB-CD1 4.08Å; P753-I842 HydrophobicContact CB-CG1 4.46Å; P753-I842 HydrophobicContact CG-CD1 3.78Å; P753-I842 HydrophobicContact CG-CG1 4.02Å; N755-I842 HydrophobicContact CB-CD1 4.25Å; G782-I842 WeakPolarHBondContact CA-O 3.45Å; N840-I842 VanDerWaalsContact C-N 3.3Å; N840-I842 PolarHBondContact O-N 3.41Å; N840-I842 PolarHBondContact OD1-N 3.36Å; I842-R844 VanDerWaalsContact O-CD 3.31Å; I842-R844 WeakPolarHBondContact O-CD 3.41Å; I842-R844 PolarHBondContact O-N 2.92Å; I842-R844 PolarHBondContact O-NE 3.02Å
843	D	85.1	Confident	87.6	Confident	49 Å²	49	35 Å²	35	26%	0.262	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-3.6	-175.4	-57.5	-47.2	0	0	0	112.8	K817 N840 E845	K817-D843 WeakPolarHBondContact CE-O 3.37Å; K817-D843 PolarHBondContact NZ-O 2.76Å; N840-D843 HydrophobicContact CB-CB 4.49Å; N840-D843 PolarHBondContact ND2-OD2 3.29Å; N840-D843 PolarHBondContact OD1-N 2.83Å; N840-D843 VanDerWaalsContact OD1-N 3.16Å; D843-E845 PolarHBondContact O-N 3.31Å
844	R	90.4	Very high	87.1	Confident	1 Å²	1	40.8 Å²	40.8	0%	0.004	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	29.2	-179.9	-37.4	-51.6	-170.5	-178.6	6.4	113.7	E739 F742 N755 S779 K817 F838 N840 A841 I842	E739-R844 IonicContact OE1-CZ 3.76Å; E739-R844 IonicContact OE1-NH1 3.67Å; E739-R844 PolarHBondContact OE1-NH1 3.47Å; E739-R844 IonicContact OE1-NH2 3.97Å; E739-R844 PolarHBondContact OE1-NH2 3.43Å; E739-R844 IonicContact OE2-CZ 2.73Å; E739-R844 IonicContact OE2-NH1 3.64Å; E739-R844 IonicContact OE2-NH2 3.55Å; E739-R844 PolarHBondContact OE2-NH2 3.29Å; F742-R844 HydrophobicContact CD1-CG 4.21Å; F742-R844 HydrophobicContact CE1-CG 4.35Å; F742-R844 VanDerWaalsContact CG-CZ 3.44Å; F742-R844 VanDerWaalsContact CG-NH1 3.32Å; N755-R844 PolarHBondContact ND2-NH2 3.06Å; S779-R844 PolarHBondContact O-NE 3.1Å; S779-R844 VanDerWaalsContact O-NE 3.12Å; S779-R844 PolarHBondContact O-NH2 2.96Å; K817-R844 VanDerWaalsContact CE-O 3.26Å; K817-R844 WeakPolarHBondContact CE-O 3.13Å; F838-R844 VanDerWaalsContact CD1-C 3.48Å; F838-R844 HydrophobicContact CD1-CB 4.01Å; F838-R844 WeakPolarHBondContact CD1-O 3.31Å; F838-R844 HydrophobicContact CE1-CB 4.09Å; F838-R844 WeakPolarHBondContact CE1-O 3.43Å; N840-R844 PolarHBondContact O-N 2.85Å; A841-R844 WeakPolarHBondContact O-CD 3.42Å; A841-R844 PolarHBondContact O-NH1 3.06Å; I842-R844 VanDerWaalsContact O-CD 3.31Å; I842-R844 WeakPolarHBondContact O-CD 3.41Å; I842-R844 PolarHBondContact O-N 2.92Å; I842-R844 PolarHBondContact O-NE 3.02Å
845	E	87.1	Confident	86.9	Confident	58 Å²	58	44.5 Å²	44.5	27%	0.271	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	163	177.5	69.1	-159.7	133	0	0	113	K817 N840 D843	K817-E845 HydrophobicContact CB-CB 4.4Å; K817-E845 HydrophobicContact CD-CB 3.96Å; K817-E845 WeakPolarHBondContact CD-OE2 3.49Å; K817-E845 HydrophobicContact CG-CB 4.47Å; K817-E845 IonicContact NZ-OE1 3.47Å; K817-E845 PolarHBondContact NZ-OE1 3.11Å; K817-E845 IonicContact NZ-OE2 3.28Å; K817-E845 PolarHBondContact NZ-OE2 2.82Å; N840-E845 VanDerWaalsContact CB-O 3.26Å; N840-E845 WeakPolarHBondContact CB-O 3.41Å; N840-E845 PolarHBondContact N-O 2.72Å; D843-E845 PolarHBondContact O-N 3.31Å
846	P	90	Very high	86.7	Confident	50 Å²	50	43.2 Å²	43.2	33%	0.325	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-64.2	165.8	-22.1	30	-35.9	0	0	0	111.8	M818 T820 V839	M818-P846 WeakPolarHBondContact O-CA 3.31Å; T820-P846 HydrophobicContact CG2-CB 4.32Å; T820-P846 HydrophobicContact CG2-CG 4.03Å; V839-P846 HydrophobicContact CB-CG 4.03Å; V839-P846 HydrophobicContact CG2-CG 4.06Å; V839-P846 PolarHBondContact N-O 3.22Å
847	V	92.3	Very high	86.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	117.3	173.5	-179.2	0	0	0	0	109.6	K817 M818 T819 T820 A825 A830 R837 F838 V849	K817-V847 HydrophobicContact CB-CG2 4.3Å; M818-V847 PolarHBondContact O-N 2.93Å; T819-V847 CarbonylContact C-O 3.56Å; T819-V847 WeakPolarHBondContact CA-O 3.45Å; T819-V847 WeakPolarHBondContact CB-O 3Å; T819-V847 HydrophobicContact CG2-CB 4.11Å; T819-V847 HydrophobicContact CG2-CG1 4.48Å; T819-V847 WeakPolarHBondContact CG2-O 3.34Å; T820-V847 PolarHBondContact N-O 3.49Å; A825-V847 HydrophobicContact CB-CB 4.27Å; A825-V847 HydrophobicContact CB-CG1 4.1Å; A825-V847 HydrophobicContact CB-CG2 4.44Å; A830-V847 HydrophobicContact CB-CG1 3.67Å; A830-V847 HydrophobicContact CB-CG2 4.11Å; R837-V847 CarbonylContact O-C 3.55Å; R837-V847 WeakPolarHBondContact O-CA 3.38Å; F838-V847 HydrophobicContact CD1-CG2 3.81Å; F838-V847 HydrophobicContact CE1-CG2 3.77Å; V847-V849 HydrophobicContact CG1-CG1 3.94Å
848	D	90.3	Very high	86.1	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.4	169.3	178.9	29.1	0	0	0	110.6	T820 A836 R837 V839 S850	T820-D848 HydrophobicContact CG2-CB 3.81Å; T820-D848 WeakPolarHBondContact OG1-CA 3.41Å; T820-D848 PolarHBondContact OG1-OD1 3.17Å; A836-D848 WeakPolarHBondContact CA-O 3.45Å; R837-D848 HydrophobicContact CG-CB 3.74Å; R837-D848 IonicContact CZ-OD2 2.79Å; R837-D848 PolarHBondContact N-O 3.35Å; R837-D848 IonicContact NE-OD2 2.99Å; R837-D848 PolarHBondContact NE-OD2 3.43Å; R837-D848 IonicContact NH2-OD2 3.7Å; R837-D848 PolarHBondContact NH2-OD2 3.22Å; R837-D848 PolarHBondContact O-N 3.26Å; V839-D848 HydrophobicContact CG2-CB 3.85Å; D848-S850 VanDerWaalsContact CG-OG 3.26Å; D848-S850 VanDerWaalsContact OD1-CB 3.23Å; D848-S850 WeakPolarHBondContact OD1-CB 3.48Å; D848-S850 PolarHBondContact OD1-N 3.17Å; D848-S850 PolarHBondContact OD1-OG 3.03Å; D848-S850 PolarHBondContact OD2-OG 3.46Å; D848-S850 VanDerWaalsContact OD2-OG 3.1Å
849	V	90.5	Very high	85.9	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.042	26%	0.26	C	S	.	.			trans	-122.2	5.1	179.3	-63.3	0	0	0	0	112.4	L808 T819 A836 V847 A851 V852	L808-V849 HydrophobicContact CD1-CG1 4.22Å; L808-V849 HydrophobicContact CD2-CG1 4.26Å; L808-V849 HydrophobicContact CG-CG1 4.44Å; T819-V849 HydrophobicContact CG2-CG1 3.97Å; T819-V849 HydrophobicContact CG2-CG2 4.15Å; A836-V849 HydrophobicContact CB-CG1 4.47Å; V847-V849 HydrophobicContact CG1-CG1 3.94Å; V849-A851 VanDerWaalsContact C-N 3.26Å; V849-A851 PolarHBondContact O-N 3.23Å; V849-V852 HydrophobicContact CB-CG2 4.28Å; V849-V852 WeakPolarHBondContact O-CB 3.41Å; V849-V852 WeakPolarHBondContact O-CG2 3.39Å; V849-V852 PolarHBondContact O-N 3.43Å; V849-V852 VanDerWaalsContact O-N 3.14Å
850	S	87.8	Confident	85.8	Confident	94 Å²	94	47.2 Å²	47.2	66%	0.657	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.4	-177.7	59.5	0	0	0	0	113.4	D848 V852	D848-S850 VanDerWaalsContact CG-OG 3.26Å; D848-S850 VanDerWaalsContact OD1-CB 3.23Å; D848-S850 WeakPolarHBondContact OD1-CB 3.48Å; D848-S850 PolarHBondContact OD1-N 3.17Å; D848-S850 PolarHBondContact OD1-OG 3.03Å; D848-S850 PolarHBondContact OD2-OG 3.46Å; D848-S850 VanDerWaalsContact OD2-OG 3.1Å; S850-V852 VanDerWaalsContact C-N 3.28Å; S850-V852 PolarHBondContact O-N 3.01Å
851	A	86.5	Confident	85.8	Confident	54 Å²	54	44.3 Å²	44.3	45%	0.446	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.9	179.4	0	0	0	0	0	114.5	E835 V849 P853	E835-A851 HydrophobicContact CB-CB 4.18Å; E835-A851 WeakPolarHBondContact CB-O 3.46Å; V849-A851 VanDerWaalsContact C-N 3.26Å; V849-A851 PolarHBondContact O-N 3.23Å; A851-P853 VanDerWaalsContact O-CD 3.22Å; A851-P853 WeakPolarHBondContact O-CD 3.25Å
852	V	87.7	Confident	86	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.042	26%	0.257	C	S	.	.			trans	-75	108	-177.6	179.7	0	0	0	0	110.5	L808 V833 E835 A836 V849 S850 K857 A875	L808-V852 HydrophobicContact CD2-CG2 4.39Å; V833-V852 HydrophobicContact CG1-CG1 4.27Å; V833-V852 HydrophobicContact CG1-CG2 4.01Å; E835-V852 HydrophobicContact CB-CG2 4.15Å; A836-V852 HydrophobicContact CB-CG2 4.46Å; V849-V852 HydrophobicContact CB-CG2 4.28Å; V849-V852 WeakPolarHBondContact O-CB 3.41Å; V849-V852 WeakPolarHBondContact O-CG2 3.39Å; V849-V852 PolarHBondContact O-N 3.43Å; V849-V852 VanDerWaalsContact O-N 3.14Å; S850-V852 VanDerWaalsContact C-N 3.28Å; S850-V852 PolarHBondContact O-N 3.01Å; V852-K857 WeakPolarHBondContact O-CE 3.39Å; V852-A875 HydrophobicContact CG1-CB 3.65Å
853	P	84.8	Confident	86	Confident	45 Å²	45	47 Å²	47	29%	0.292	26%	0.261	S	S	.	.			trans	-74.2	149.3	-168.8	31.6	-35.9	0	0	0	111.7	I649 A851 N855 R856	I649-P853 HydrophobicContact CD1-CG 4.22Å; A851-P853 VanDerWaalsContact O-CD 3.22Å; A851-P853 WeakPolarHBondContact O-CD 3.25Å; P853-N855 PolarHBondContact O-N 2.79Å; P853-N855 VanDerWaalsContact O-N 3.1Å; P853-R856 HydrophobicContact CG-CG 4.17Å; P853-R856 PolarHBondContact O-N 3.07Å
854	E	80.6	Confident	85.5	Confident	121 Å²	121	45.9 Å²	45.9	57%	0.565	26%	0.257	S	S	*	.	H	α-helix	trans	-58.3	-29.6	-179.9	-155	55.3	-136.1	0	0	112.5	R856 K857 S858	E854-R856 PolarHBondContact O-N 3.17Å; E854-R856 VanDerWaalsContact O-N 3.09Å; E854-K857 PolarHBondContact O-N 3.34Å; E854-K857 WeakPolarHBondContact OE2-CD 3.49Å; E854-K857 WeakPolarHBondContact OE2-CE 3.42Å; E854-K857 IonicContact OE2-NZ 3.4Å; E854-K857 PolarHBondContact OE2-NZ 2.98Å; E854-S858 PolarHBondContact O-N 2.8Å; E854-S858 PolarHBondContact O-OG 3.21Å
855	N	81.2	Confident	84.5	Confident	111 Å²	111	50.6 Å²	50.6	59%	0.594	28%	0.279	S	S	*	.	H	α-helix	trans	-58.6	-17.1	172.7	-68.5	-21.2	0	0	0	114.8	I649 P853 S858 L859	I649-N855 HydrophobicContact CD1-CB 3.69Å; P853-N855 PolarHBondContact O-N 2.79Å; P853-N855 VanDerWaalsContact O-N 3.1Å; N855-S858 PolarHBondContact O-OG 2.9Å; N855-L859 WeakPolarHBondContact O-CG 3.42Å
856	R	84.9	Confident	83.1	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-90.5	-26.1	169.8	-74.9	-164.1	-171.2	-74.8	-5.9	114	P646 I649 E835 P853 E854 A875 C876	P646-R856 PolarHBondContact O-NH2 2.88Å; I649-R856 HydrophobicContact CD1-CG 3.71Å; I649-R856 HydrophobicContact CG1-CG 4.37Å; E835-R856 IonicContact OE1-CZ 3.14Å; E835-R856 VanDerWaalsContact OE1-CZ 3.23Å; E835-R856 IonicContact OE1-NE 2.72Å; E835-R856 PolarHBondContact OE1-NE 2.85Å; E835-R856 IonicContact OE1-NH2 3.72Å; E835-R856 PolarHBondContact OE1-NH2 3.15Å; E835-R856 WeakPolarHBondContact OE2-CD 3.41Å; E835-R856 IonicContact OE2-CZ 2.74Å; E835-R856 IonicContact OE2-NE 2.73Å; E835-R856 PolarHBondContact OE2-NE 3.33Å; E835-R856 IonicContact OE2-NH2 3.93Å; P853-R856 HydrophobicContact CG-CG 4.17Å; P853-R856 PolarHBondContact O-N 3.07Å; E854-R856 PolarHBondContact O-N 3.17Å; E854-R856 VanDerWaalsContact O-N 3.09Å; R856-A875 HydrophobicContact CB-CB 4.19Å; R856-C876 PolarHBondContact O-N 3Å
857	K	82.6	Confident	81	Confident	56 Å²	56	53.2 Å²	53.2	24%	0.243	30%	0.298	C	S	.	.	H	α-helix	trans	-80.2	-30.9	178.8	-52.7	-178.6	-147.2	150.2	0	110.1	V852 E854 R873	V852-K857 WeakPolarHBondContact O-CE 3.39Å; E854-K857 PolarHBondContact O-N 3.34Å; E854-K857 WeakPolarHBondContact OE2-CD 3.49Å; E854-K857 WeakPolarHBondContact OE2-CE 3.42Å; E854-K857 IonicContact OE2-NZ 3.4Å; E854-K857 PolarHBondContact OE2-NZ 2.98Å; K857-R873 HydrophobicContact CB-CB 4.44Å; K857-R873 WeakPolarHBondContact CB-O 3.4Å; K857-R873 WeakPolarHBondContact O-CB 3.3Å; K857-R873 WeakPolarHBondContact O-CD 3.18Å
858	S	80.6	Confident	79	Confident	63 Å²	63	57.4 Å²	57.4	44%	0.441	32%	0.321	S	S	.	.	S	Bend	trans	-72	-26.1	176.4	63	0	0	0	0	114.7	E854 N855 R873	E854-S858 PolarHBondContact O-N 2.8Å; E854-S858 PolarHBondContact O-OG 3.21Å; N855-S858 PolarHBondContact O-OG 2.9Å; S858-R873 PolarHBondContact O-NH1 2.91Å; S858-R873 VanDerWaalsContact O-NH1 3.11Å
859	L	85	Confident	76.8	Confident	13 Å²	13	62 Å²	62	7%	0.068	35%	0.351	C	S	.	.	S	Bend	trans	-54.4	145.2	178.4	-75.4	173.7	0	0	0	113.4	I649 Q652 N855 C876 Q878	I649-L859 HydrophobicContact CG2-CD1 4.28Å; I649-L859 HydrophobicContact CG2-CD2 4.4Å; Q652-L859 HydrophobicContact CG-CD2 3.89Å; N855-L859 WeakPolarHBondContact O-CG 3.42Å; L859-C876 HydrophobicContact CB-CB 3.79Å; L859-C876 HydrophobicContact CD1-CB 3.94Å; L859-Q878 HydrophobicContact CD1-CG 4.23Å
860	K	83.6	Confident	74.6	Confident	138 Å²	138	66.4 Å²	66.4	60%	0.6	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-88.2	122.6	176.6	-65	-179	-179.8	178.8	0	110.7	S887	K860-S887 PolarHBondContact O-OG 3.05Å
861	C	86.3	Confident	73	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.027	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-77.4	120.9	173.7	175.8	0	0	0	0	110.8	F863 C864 H865 S887	C861-F863 PolarHBondContact O-N 3.13Å; C861-F863 VanDerWaalsContact O-N 3.08Å; C861-C864 VanDerWaalsContact CB-SG 3.55Å; C861-H865 WeakPolarHBondContact O-CA 3.35Å; C861-H865 PolarHBondContact O-N 3.37Å; C861-H865 VanDerWaalsContact O-N 3.08Å; C861-S887 WeakPolarHBondContact CA-O 3.46Å
862	V	85.6	Confident	71.3	Confident	53 Å²	53	68.3 Å²	68.3	32%	0.321	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	11.8	-176.4	-56.8	0	0	0	0	115.4	H865 T886 S887 F888	V862-H865 PolarHBondContact O-NE2 3.32Å; V862-T886 HydrophobicContact CG1-CG2 4.32Å; V862-T886 HydrophobicContact CG2-CG2 3.97Å; V862-S887 PolarHBondContact N-O 3.1Å; V862-F888 HydrophobicContact CG2-CD1 3.96Å
863	F	82.8	Confident	70.2	Confident	55 Å²	55	71.3 Å²	71.3	24%	0.241	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-45.5	176.9	-61.3	-59.6	0	0	0	112.1	C861 F888 C892 A896 V898 H914	C861-F863 PolarHBondContact O-N 3.13Å; C861-F863 VanDerWaalsContact O-N 3.08Å; F863-F888 HydrophobicContact CD2-CB 3.7Å; F863-F888 HydrophobicContact CD2-CD1 4.39Å; F863-F888 HydrophobicContact CD2-CG 4.25Å; F863-F888 HydrophobicContact CE2-CB 3.84Å; F863-F888 AromaticContact CE2-CD1 3.68Å; F863-F888 HydrophobicContact CE2-CD1 3.68Å; F863-F888 HydrophobicContact CE2-CE1 4.49Å; F863-F888 AromaticContact CE2-CG 3.85Å; F863-F888 HydrophobicContact CE2-CG 3.85Å; F863-F888 HydrophobicContact CZ-CD1 4.45Å; F863-C892 HydrophobicContact CB-CB 4.14Å; F863-C892 HydrophobicContact CD2-CB 4.14Å; F863-A896 HydrophobicContact CD1-CB 3.83Å; F863-A896 HydrophobicContact CD2-CB 4.06Å; F863-A896 HydrophobicContact CE1-CB 3.57Å; F863-A896 HydrophobicContact CE2-CB 3.81Å; F863-A896 HydrophobicContact CG-CB 4.08Å; F863-A896 HydrophobicContact CZ-CB 3.57Å; F863-V898 HydrophobicContact CE2-CG2 3.74Å; F863-V898 HydrophobicContact CZ-CG2 3.84Å; F863-H914 AromaticContact CZ-CE1 3.81Å
864	C	76	Confident	69.8	Low	26 Å²	26	69.2 Å²	69.2	18%	0.176	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.6	-179.7	76.1	0	0	0	0	114	W677 C861 T866 H889	W677-C864 HydrophobicContact CH2-CB 4.3Å; W677-C864 HydrophobicContact CZ3-CB 3.67Å; C861-C864 VanDerWaalsContact CB-SG 3.55Å; C864-T866 WeakPolarHBondContact O-CA 3.4Å; C864-T866 PolarHBondContact O-N 3.04Å; C864-T866 PolarHBondContact O-OG1 2.99Å; C864-T866 PolarHBondContact SG-OG1 3.08Å; C864-H889 PolarHBondContact SG-CE1 3.2Å
865	H	67.8	Low	70.2	Confident	100 Å²	100	63.5 Å²	63.5	46%	0.463	35%	0.347	S	S	.	.			trans	39.7	34.8	170.6	-67.1	-79	0	0	0	115.7	C861 V862 T867	C861-H865 WeakPolarHBondContact O-CA 3.35Å; C861-H865 PolarHBondContact O-N 3.37Å; C861-H865 VanDerWaalsContact O-N 3.08Å; V862-H865 PolarHBondContact O-NE2 3.32Å; H865-T867 PolarHBondContact O-N 3.34Å
866	T	57.9	Low	70.6	Confident	34 Å²	34	58.2 Å²	58.2	21%	0.209	32%	0.319	C	S	.	.			trans	-71.6	100.7	-162.4	-49	0	0	0	0	110.9	C864	C864-T866 WeakPolarHBondContact O-CA 3.4Å; C864-T866 PolarHBondContact O-N 3.04Å; C864-T866 PolarHBondContact O-OG1 2.99Å; C864-T866 PolarHBondContact SG-OG1 3.08Å
867	T	46.9	Very low	70.9	Confident	129 Å²	129	58.4 Å²	58.4	79%	0.791	32%	0.32	S	S	*	.			trans	-73.9	-27.9	-171.1	41.5	0	0	0	0	113.5	H865 P869	H865-T867 PolarHBondContact O-N 3.34Å; T867-P869 WeakPolarHBondContact O-CD 3.33Å
868	N	50	Low	71.3	Confident	88 Å²	88	56.2 Å²	56.2	47%	0.471	31%	0.31	S	S	.	.			trans	-68.8	122.1	-174.6	-160.7	-11.9	0	0	0	111.6	S870	N868-S870 PolarHBondContact OD1-OG 3.35Å; N868-S870 VanDerWaalsContact OD1-OG 3.1Å
869	P	43.8	Very low	71.8	Confident	104 Å²	104	53.2 Å²	53.2	68%	0.675	29%	0.29	S	S	*	.	S	Bend	trans	-72.5	-25.3	-179.1	-19.9	33.9	0	0	0	114.8	T867	T867-P869 WeakPolarHBondContact O-CD 3.33Å
870	S	44.6	Very low	71.8	Confident	99 Å²	99	53 Å²	53	69%	0.692	29%	0.289	S	S	*	.	S	Bend	trans	-83.9	-11.8	-167.5	58	0	0	0	0	115.4	N868	N868-S870 PolarHBondContact OD1-OG 3.35Å; N868-S870 VanDerWaalsContact OD1-OG 3.1Å
871	L	53.2	Low	71.7	Confident	78 Å²	78	50.1 Å²	50.1	41%	0.408	28%	0.277	S	S	.	.	S	Bend	trans	-98.5	121.1	-178	-148.5	75.4	0	0	0	110.7	R678 R873	R678-L871 HydrophobicContact CG-CD2 4.41Å; L871-R873 PolarHBondContact O-N 3.29Å
872	N	52	Low	71	Confident	110 Å²	110	54.9 Å²	54.9	59%	0.588	30%	0.299	S	S	*	.			trans	-35	102.1	-177.4	-102.7	-65.8	0	0	0	113.1	R678 G874	R678-N872 PolarHBondContact NH1-O 3.05Å; N872-G874 PolarHBondContact O-N 3.23Å
873	R	63.5	Low	70.4	Confident	70 Å²	70	59.6 Å²	59.6	26%	0.264	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-75.2	118.6	-177.7	-66.2	-174.7	176.7	-175.4	2.5	110.2	K857 S858 L871	K857-R873 HydrophobicContact CB-CB 4.44Å; K857-R873 WeakPolarHBondContact CB-O 3.4Å; K857-R873 WeakPolarHBondContact O-CB 3.3Å; K857-R873 WeakPolarHBondContact O-CD 3.18Å; S858-R873 PolarHBondContact O-NH1 2.91Å; S858-R873 VanDerWaalsContact O-NH1 3.11Å; L871-R873 PolarHBondContact O-N 3.29Å
874	G	77.2	Confident	70.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.1	152.7	170.8	0	0	0	0	0	112	L808 N872 C876 H889	L808-G874 VanDerWaalsContact C-CA 3.44Å; L808-G874 CarbonylContact O-C 3.5Å; L808-G874 VanDerWaalsContact O-CA 3.23Å; L808-G874 WeakPolarHBondContact O-CA 3.17Å; N872-G874 PolarHBondContact O-N 3.23Å; G874-C876 PolarHBondContact O-N 2.91Å; G874-H889 VanDerWaalsContact C-CD2 3.44Å; G874-H889 WeakPolarHBondContact CA-NE2 3.18Å; G874-H889 PolarHBondContact N-NE2 3.16Å; G874-H889 PolarHBondContact O-CD2 3.02Å; G874-H889 VanDerWaalsContact O-CD2 3.24Å; G874-H889 PolarHBondContact O-NE2 3.25Å
875	A	88.8	Confident	70.9	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.008	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-70.7	124	-178.9	0	0	0	0	0	111.5	L808 V833 V852 R856	L808-A875 HydrophobicContact CD2-CB 4.1Å; L808-A875 PolarHBondContact O-N 3.29Å; L808-A875 VanDerWaalsContact O-N 3.14Å; V833-A875 HydrophobicContact CG1-CB 4.14Å; V833-A875 HydrophobicContact CG2-CB 4.16Å; V852-A875 HydrophobicContact CG1-CB 3.65Å; R856-A875 HydrophobicContact CB-CB 4.19Å
876	C	90.3	Very high	71.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-85.5	139.8	174.5	-67	0	0	0	0	112.2	R856 L859 G874 F888	R856-C876 PolarHBondContact O-N 3Å; L859-C876 HydrophobicContact CB-CB 3.79Å; L859-C876 HydrophobicContact CD1-CB 3.94Å; G874-C876 PolarHBondContact O-N 2.91Å; C876-F888 WeakPolarHBondContact CA-O 3.21Å
877	I	91.3	Very high	73.4	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	157.9	162.7	55	168.5	0	0	0	109.5	G832 V833 S887 F888 V890 M900 V911	G832-I877 VanDerWaalsContact O-CG2 3.25Å; G832-I877 WeakPolarHBondContact O-CG2 3.32Å; V833-I877 HydrophobicContact CG2-CG2 4.43Å; I877-S887 CarbonylContact O-C 3.6Å; I877-S887 WeakPolarHBondContact O-CA 3.32Å; I877-S887 WeakPolarHBondContact O-CB 3.46Å; I877-F888 HydrophobicContact CD1-CD2 3.98Å; I877-F888 HydrophobicContact CD1-CE2 3.75Å; I877-F888 HydrophobicContact CG1-CD2 3.67Å; I877-F888 HydrophobicContact CG1-CE2 3.77Å; I877-F888 WeakPolarHBondContact CG1-O 3.39Å; I877-F888 PolarHBondContact N-O 3.14Å; I877-F888 PolarHBondContact O-N 3.21Å; I877-V890 HydrophobicContact CD1-CG2 4.12Å; I877-V890 HydrophobicContact CG1-CG2 4.39Å; I877-V890 HydrophobicContact CG2-CG2 4.11Å; I877-M900 HydrophobicContact CD1-SD 4.21Å; I877-V911 HydrophobicContact CD1-CG1 3.96Å; I877-V911 HydrophobicContact CD1-CG2 4.09Å
878	Q	90.2	Very high	75.5	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.047	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	159.2	177.4	-85.3	179	-25.7	0	0	110.8	V650 L859 T886	V650-Q878 PolarHBondContact O-NE2 3.44Å; L859-Q878 HydrophobicContact CD1-CG 4.23Å; Q878-T886 WeakPolarHBondContact CA-O 3.48Å
879	C	90.4	Very high	77.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	23%	0.233	C	C	.	.			trans	-62.7	141.4	173.3	-170.3	0	0	0	0	111.6	H881 C884 T886 V911 C913	C879-H881 VanDerWaalsContact C-N 3.34Å; C879-C884 HydrophobicContact CB-CB 3.89Å; C879-C884 VanDerWaalsContact CB-SG 3.51Å; C879-T886 PolarHBondContact N-O 3.04Å; C879-T886 VanDerWaalsContact N-O 3.1Å; C879-V911 WeakPolarHBondContact CA-O 3.48Å; C879-C913 HydrophobicContact CB-CB 4.17Å; C879-C913 PolarHBondContact SG-N 3.22Å
880	T	85.9	Confident	79.7	Confident	8 Å²	8	37.3 Å²	37.3	5%	0.049	20%	0.201	C	C	.	.	S	Bend	trans	-86.7	1.3	-176.9	52.2	0	0	0	0	114.9	P642 R644 P646 S910 V911	P642-T880 HydrophobicContact CB-CG2 4.04Å; R644-T880 PolarHBondContact N-O 2.91Å; P646-T880 HydrophobicContact CG-CG2 4Å; T880-S910 PolarHBondContact OG1-OG 3.46Å; T880-S910 VanDerWaalsContact OG1-OG 3.07Å; T880-V911 HydrophobicContact CG2-CB 4.25Å; T880-V911 PolarHBondContact N-O 2.89Å; T880-V911 PolarHBondContact OG1-N 3.21Å; T880-V911 PolarHBondContact OG1-O 3.24Å
881	H	81.3	Confident	81.7	Confident	77 Å²	77	32.6 Å²	32.6	36%	0.356	17%	0.168	S	C	.	.	S	Bend	trans	-80.7	155.8	175.4	-157.2	61.9	0	0	0	111.5	M643 C879 C884 H916	M643-H881 PolarHBondContact SD-ND1 2.91Å; C879-H881 VanDerWaalsContact C-N 3.34Å; H881-C884 HydrophobicContact CB-CB 4.4Å; H881-C884 PolarHBondContact O-N 3.39Å; H881-H916 WeakPolarHBondContact CB-ND1 3.47Å; H881-H916 AromaticContact CD2-CD2 3.77Å; H881-H916 AromaticContact CD2-CE1 3.51Å; H881-H916 AromaticContact CD2-CG 3.63Å; H881-H916 AromaticContact CD2-ND1 3.47Å; H881-H916 PolarHBondContact CD2-ND1 2.88Å; H881-H916 AromaticContact CD2-NE2 3.75Å; H881-H916 AromaticContact CG-CG 3.94Å; H881-H916 AromaticContact CG-ND1 3.65Å
882	E	72.6	Confident	83.3	Confident	105 Å²	105	29 Å²	29	49%	0.491	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	144.2	-179.2	-62.6	-170.6	174.4	0	0	112.2	M643 C884	M643-E882 HydrophobicContact CB-CG 3.6Å; M643-E882 HydrophobicContact CE-CG 3.85Å; M643-E882 HydrophobicContact CG-CG 4.49Å; M643-E882 HydrophobicContact SD-CG 4.3Å; E882-C884 PolarHBondContact O-N 2.84Å
883	N	71.7	Confident	85.1	Confident	151 Å²	151	23.8 Å²	23.8	81%	0.807	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	13.8	177.8	-55	-27.7	0	0	0	116.3	A885	N883-A885 PolarHBondContact O-N 2.98Å
884	C	84	Confident	86.1	Confident	8 Å²	8	20.7 Å²	20.7	5%	0.054	11%	0.11	C	C	.	.			trans	-90.5	96.6	-174.2	-165	0	0	0	0	113.7	C879 H881 E882 T886 H916	C879-C884 HydrophobicContact CB-CB 3.89Å; C879-C884 VanDerWaalsContact CB-SG 3.51Å; H881-C884 HydrophobicContact CB-CB 4.4Å; H881-C884 PolarHBondContact O-N 3.39Å; E882-C884 PolarHBondContact O-N 2.84Å; C884-T886 PolarHBondContact O-N 3.35Å; C884-T886 VanDerWaalsContact O-N 3.11Å; C884-T886 PolarHBondContact SG-OG1 2.72Å; C884-T886 VanDerWaalsContact SG-OG1 3.38Å; C884-H916 PolarHBondContact SG-CE1 2.92Å
885	A	85.8	Confident	86.3	Confident	28 Å²	28	21.6 Å²	21.6	23%	0.231	11%	0.114	C	C	.	.			trans	-75.7	13.7	175.5	0	0	0	0	0	115.3	V650 Q652 N883 S887	V650-A885 HydrophobicContact CB-CB 3.96Å; V650-A885 HydrophobicContact CG1-CB 3.94Å; Q652-A885 HydrophobicContact CG-CB 4.32Å; Q652-A885 PolarHBondContact NE2-O 2.78Å; N883-A885 PolarHBondContact O-N 2.98Å; A885-S887 PolarHBondContact O-N 3.1Å
886	T	87.9	Confident	85.9	Confident	25 Å²	25	22.6 Å²	22.6	15%	0.153	12%	0.123	C	C	.	.			trans	-73.5	120.1	-179.1	-56.5	0	0	0	0	110.4	V862 Q878 C879 C884 F888 C913	V862-T886 HydrophobicContact CG1-CG2 4.32Å; V862-T886 HydrophobicContact CG2-CG2 3.97Å; Q878-T886 WeakPolarHBondContact CA-O 3.48Å; C879-T886 PolarHBondContact N-O 3.04Å; C879-T886 VanDerWaalsContact N-O 3.1Å; C884-T886 PolarHBondContact O-N 3.35Å; C884-T886 VanDerWaalsContact O-N 3.11Å; C884-T886 PolarHBondContact SG-OG1 2.72Å; C884-T886 VanDerWaalsContact SG-OG1 3.38Å; T886-F888 HydrophobicContact CG2-CD1 4.24Å; T886-F888 HydrophobicContact CG2-CE1 4.02Å; T886-C913 HydrophobicContact CG2-CB 3.95Å
887	S	89.3	Confident	85.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149.4	-176.1	52.1	0	0	0	0	114.5	Q652 K860 C861 V862 I877 A885	Q652-S887 PolarHBondContact NE2-OG 3.33Å; K860-S887 PolarHBondContact O-OG 3.05Å; C861-S887 WeakPolarHBondContact CA-O 3.46Å; V862-S887 PolarHBondContact N-O 3.1Å; I877-S887 CarbonylContact O-C 3.6Å; I877-S887 WeakPolarHBondContact O-CA 3.32Å; I877-S887 WeakPolarHBondContact O-CB 3.46Å; A885-S887 PolarHBondContact O-N 3.1Å
888	F	91.4	Very high	85.1	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	159.4	-179.8	35	-107.7	0	0	0	111.7	V862 F863 C876 I877 T886 A893 V898 V911 C913	V862-F888 HydrophobicContact CG2-CD1 3.96Å; F863-F888 HydrophobicContact CD2-CB 3.7Å; F863-F888 HydrophobicContact CD2-CD1 4.39Å; F863-F888 HydrophobicContact CD2-CG 4.25Å; F863-F888 HydrophobicContact CE2-CB 3.84Å; F863-F888 AromaticContact CE2-CD1 3.68Å; F863-F888 HydrophobicContact CE2-CD1 3.68Å; F863-F888 HydrophobicContact CE2-CE1 4.49Å; F863-F888 AromaticContact CE2-CG 3.85Å; F863-F888 HydrophobicContact CE2-CG 3.85Å; F863-F888 HydrophobicContact CZ-CD1 4.45Å; C876-F888 WeakPolarHBondContact CA-O 3.21Å; I877-F888 HydrophobicContact CD1-CD2 3.98Å; I877-F888 HydrophobicContact CD1-CE2 3.75Å; I877-F888 HydrophobicContact CG1-CD2 3.67Å; I877-F888 HydrophobicContact CG1-CE2 3.77Å; I877-F888 WeakPolarHBondContact CG1-O 3.39Å; I877-F888 PolarHBondContact N-O 3.14Å; I877-F888 PolarHBondContact O-N 3.21Å; T886-F888 HydrophobicContact CG2-CD1 4.24Å; T886-F888 HydrophobicContact CG2-CE1 4.02Å; F888-A893 HydrophobicContact CD2-CB 3.42Å; F888-A893 VanDerWaalsContact CD2-CB 3.42Å; F888-A893 HydrophobicContact CE2-CB 3.69Å; F888-A893 HydrophobicContact CG-CB 4.15Å; F888-V898 HydrophobicContact CE1-CG1 4.43Å; F888-V898 HydrophobicContact CE1-CG2 4.2Å; F888-V898 HydrophobicContact CE2-CG1 3.96Å; F888-V898 HydrophobicContact CE2-CG2 4.39Å; F888-V898 HydrophobicContact CZ-CG1 3.67Å; F888-V898 HydrophobicContact CZ-CG2 4.13Å; F888-V911 HydrophobicContact CE2-CG1 3.49Å; F888-V911 VanDerWaalsContact CE2-CG1 3.49Å; F888-V911 HydrophobicContact CZ-CG1 3.62Å; F888-C913 HydrophobicContact CE1-CB 3.87Å; F888-C913 HydrophobicContact CZ-CB 4.33Å
889	H	90.7	Very high	84.9	Confident	6 Å²	6	23.8 Å²	23.8	3%	0.028	13%	0.131	C	C	.	.			trans	-71.4	150.4	167.8	-57.4	114.3	0	0	0	111	C809 C864 G874 T891 C892 A893	C809-H889 HydrophobicContact CB-CB 4.01Å; C864-H889 PolarHBondContact SG-CE1 3.2Å; G874-H889 VanDerWaalsContact C-CD2 3.44Å; G874-H889 WeakPolarHBondContact CA-NE2 3.18Å; G874-H889 PolarHBondContact N-NE2 3.16Å; G874-H889 PolarHBondContact O-CD2 3.02Å; G874-H889 VanDerWaalsContact O-CD2 3.24Å; G874-H889 PolarHBondContact O-NE2 3.25Å; H889-T891 VanDerWaalsContact C-N 3.35Å; H889-T891 PolarHBondContact O-N 3.01Å; H889-C892 HydrophobicContact CB-CB 4.19Å; H889-C892 PolarHBondContact O-N 2.95Å; H889-A893 WeakPolarHBondContact O-CB 3.36Å; H889-A893 PolarHBondContact O-N 3Å
890	V	91	Very high	84.7	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-54.9	-46.7	-178.6	-173.6	0	0	0	0	112.3	L706 V833 I877 A893 Q894 M900	L706-V890 HydrophobicContact CD1-CG1 3.76Å; V833-V890 HydrophobicContact CG2-CG2 4.03Å; I877-V890 HydrophobicContact CD1-CG2 4.12Å; I877-V890 HydrophobicContact CG1-CG2 4.39Å; I877-V890 HydrophobicContact CG2-CG2 4.11Å; V890-A893 WeakPolarHBondContact O-CB 3.47Å; V890-A893 PolarHBondContact O-N 3.18Å; V890-Q894 PolarHBondContact O-N 2.67Å; V890-M900 HydrophobicContact CG1-SD 4.36Å
891	T	88.4	Confident	84.7	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-69.6	-39.4	178.9	46.5	0	0	0	0	113.1	C809 L811 I828 H889 A893 Q894 I895	C809-T891 VanDerWaalsContact CB-OG1 3.24Å; C809-T891 WeakPolarHBondContact CB-OG1 3.46Å; C809-T891 PolarHBondContact SG-OG1 3.18Å; L811-T891 HydrophobicContact CB-CG2 4.2Å; L811-T891 HydrophobicContact CD2-CG2 3.88Å; I828-T891 HydrophobicContact CD1-CG2 4.01Å; H889-T891 VanDerWaalsContact C-N 3.35Å; H889-T891 PolarHBondContact O-N 3.01Å; T891-A893 VanDerWaalsContact C-N 3.29Å; T891-A893 PolarHBondContact O-N 3.48Å; T891-Q894 WeakPolarHBondContact O-CB 3.41Å; T891-Q894 PolarHBondContact O-N 2.73Å; T891-I895 WeakPolarHBondContact O-CG1 3.5Å; T891-I895 PolarHBondContact O-N 2.55Å
892	C	86.8	Confident	84.7	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-39.7	173.2	-61.5	0	0	0	0	111.4	F863 H889 A896	F863-C892 HydrophobicContact CB-CB 4.14Å; F863-C892 HydrophobicContact CD2-CB 4.14Å; H889-C892 HydrophobicContact CB-CB 4.19Å; H889-C892 PolarHBondContact O-N 2.95Å; C892-A896 WeakPolarHBondContact O-CB 3.35Å; C892-A896 PolarHBondContact O-N 2.74Å
893	A	87.8	Confident	84.9	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-44.1	174.5	0	0	0	0	0	111.9	F888 H889 V890 T891 A896 G897 V898 M900	F888-A893 HydrophobicContact CD2-CB 3.42Å; F888-A893 VanDerWaalsContact CD2-CB 3.42Å; F888-A893 HydrophobicContact CE2-CB 3.69Å; F888-A893 HydrophobicContact CG-CB 4.15Å; H889-A893 WeakPolarHBondContact O-CB 3.36Å; H889-A893 PolarHBondContact O-N 3Å; V890-A893 WeakPolarHBondContact O-CB 3.47Å; V890-A893 PolarHBondContact O-N 3.18Å; T891-A893 VanDerWaalsContact C-N 3.29Å; T891-A893 PolarHBondContact O-N 3.48Å; A893-A896 PolarHBondContact O-N 3.01Å; A893-G897 PolarHBondContact O-N 3.09Å; A893-G897 VanDerWaalsContact O-N 3.17Å; A893-V898 HydrophobicContact CB-CB 3.8Å; A893-V898 HydrophobicContact CB-CG1 4.23Å; A893-V898 HydrophobicContact CB-CG2 3.75Å; A893-V898 WeakPolarHBondContact O-CB 3.35Å; A893-V898 WeakPolarHBondContact O-CG2 3.42Å; A893-V898 PolarHBondContact O-N 3.49Å; A893-M900 HydrophobicContact CB-CE 4.07Å; A893-M900 HydrophobicContact CB-SD 4.21Å
894	Q	85.4	Confident	84.5	Confident	6 Å²	6	15.2 Å²	15.2	3%	0.028	9%	0.089	C	C	.	.	H	α-helix	trans	-61.9	-49.2	179.9	-163.5	-171	20	0	0	112.1	S705 Y710 I828 V890 T891 G897 M900	S705-Q894 PolarHBondContact O-NE2 2.98Å; S705-Q894 PolarHBondContact OG-NE2 3.2Å; S705-Q894 VanDerWaalsContact OG-NE2 3.08Å; Y710-Q894 HydrophobicContact CD2-CG 4.17Å; Y710-Q894 HydrophobicContact CE2-CG 3.67Å; Y710-Q894 PolarHBondContact OH-NE2 3.05Å; I828-Q894 VanDerWaalsContact CD1-OE1 3.25Å; V890-Q894 PolarHBondContact O-N 2.67Å; T891-Q894 WeakPolarHBondContact O-CB 3.41Å; T891-Q894 PolarHBondContact O-N 2.73Å; Q894-G897 PolarHBondContact O-N 3.07Å; Q894-M900 HydrophobicContact CB-CE 3.91Å; Q894-M900 HydrophobicContact CG-CE 4.38Å
895	I	81.8	Confident	83.1	Confident	18 Å²	18	22.6 Å²	22.6	9%	0.092	12%	0.116	C	C	.	.	H	α-helix	trans	-68.7	-39	179	-56.1	166.8	0	0	0	110.6	M670 L811 T891 G897	M670-I895 HydrophobicContact CE-CB 3.8Å; M670-I895 HydrophobicContact CE-CG2 3.47Å; M670-I895 VanDerWaalsContact CE-CG2 3.47Å; M670-I895 HydrophobicContact CG-CG2 4.17Å; L811-I895 HydrophobicContact CD1-CD1 3.93Å; L811-I895 HydrophobicContact CD2-CD1 3.85Å; T891-I895 WeakPolarHBondContact O-CG1 3.5Å; T891-I895 PolarHBondContact O-N 2.55Å; I895-G897 PolarHBondContact O-N 3.48Å
896	A	80.1	Confident	81.7	Confident	23 Å²	23	23.9 Å²	23.9	19%	0.19	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-3	177.1	0	0	0	0	0	114.5	F863 C892 A893 V898 H914	F863-A896 HydrophobicContact CD1-CB 3.83Å; F863-A896 HydrophobicContact CD2-CB 4.06Å; F863-A896 HydrophobicContact CE1-CB 3.57Å; F863-A896 HydrophobicContact CE2-CB 3.81Å; F863-A896 HydrophobicContact CG-CB 4.08Å; F863-A896 HydrophobicContact CZ-CB 3.57Å; C892-A896 WeakPolarHBondContact O-CB 3.35Å; C892-A896 PolarHBondContact O-N 2.74Å; A893-A896 PolarHBondContact O-N 3.01Å; A896-V898 PolarHBondContact O-N 3.1Å; A896-H914 PolarHBondContact O-CE1 2.75Å; A896-H914 PolarHBondContact O-NE2 2.92Å
897	G	80	Confident	80.8	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	33.7	-179.2	0	0	0	0	0	114	A893 Q894 I895 K917	A893-G897 PolarHBondContact O-N 3.09Å; A893-G897 VanDerWaalsContact O-N 3.17Å; Q894-G897 PolarHBondContact O-N 3.07Å; I895-G897 PolarHBondContact O-N 3.48Å; G897-K917 PolarHBondContact O-NZ 2.98Å
898	V	84.9	Confident	79.9	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.012	13%	0.129	C	C	.	.			trans	-59.9	140.7	162.7	175.5	0	0	0	0	108.4	F863 F888 A893 A896 M900 V911 S912	F863-V898 HydrophobicContact CE2-CG2 3.74Å; F863-V898 HydrophobicContact CZ-CG2 3.84Å; F888-V898 HydrophobicContact CE1-CG1 4.43Å; F888-V898 HydrophobicContact CE1-CG2 4.2Å; F888-V898 HydrophobicContact CE2-CG1 3.96Å; F888-V898 HydrophobicContact CE2-CG2 4.39Å; F888-V898 HydrophobicContact CZ-CG1 3.67Å; F888-V898 HydrophobicContact CZ-CG2 4.13Å; A893-V898 HydrophobicContact CB-CB 3.8Å; A893-V898 HydrophobicContact CB-CG1 4.23Å; A893-V898 HydrophobicContact CB-CG2 3.75Å; A893-V898 WeakPolarHBondContact O-CB 3.35Å; A893-V898 WeakPolarHBondContact O-CG2 3.42Å; A893-V898 PolarHBondContact O-N 3.49Å; A896-V898 PolarHBondContact O-N 3.1Å; V898-M900 HydrophobicContact CG1-CG 4.4Å; V898-M900 PolarHBondContact O-N 2.87Å; V898-V911 HydrophobicContact CG1-CG1 4.14Å; V898-S912 WeakPolarHBondContact CG1-O 3.23Å
899	V	85.1	Confident	79.6	Confident	37 Å²	37	26.6 Å²	26.6	22%	0.224	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	111.5	177.7	179.7	0	0	0	0	108.7	K901 S912 K917	V899-K901 HydrophobicContact CG1-CG 4.2Å; V899-S912 PolarHBondContact N-O 3.38Å; V899-S912 PolarHBondContact O-N 3.31Å; V899-K917 HydrophobicContact CG2-CD 4.08Å; V899-K917 HydrophobicContact CG2-CG 4.15Å
900	M	87.8	Confident	79.4	Confident	10 Å²	10	27.5 Å²	27.5	5%	0.049	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.5	169.7	-66.7	178.6	-73	0	0	108.3	L706 I877 V890 A893 Q894 V898 V909 S910 V911	L706-M900 HydrophobicContact CD1-CE 3.84Å; L706-M900 HydrophobicContact CD1-SD 3.89Å; I877-M900 HydrophobicContact CD1-SD 4.21Å; V890-M900 HydrophobicContact CG1-SD 4.36Å; A893-M900 HydrophobicContact CB-CE 4.07Å; A893-M900 HydrophobicContact CB-SD 4.21Å; Q894-M900 HydrophobicContact CB-CE 3.91Å; Q894-M900 HydrophobicContact CG-CE 4.38Å; V898-M900 HydrophobicContact CG1-CG 4.4Å; V898-M900 PolarHBondContact O-N 2.87Å; M900-V909 HydrophobicContact CB-CG1 4.26Å; M900-S910 WeakPolarHBondContact CA-O 3.42Å; M900-V911 HydrophobicContact CG-CG1 4.38Å; M900-V911 HydrophobicContact CG-CG2 4.38Å
901	K	84.6	Confident	79.3	Confident	91 Å²	91	27.8 Å²	27.8	40%	0.396	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.3	179.1	-70.7	-171.7	174.7	-170.7	0	109.7	F707 V899 V909 S910	F707-K901 VanDerWaalsContact CE1-C 3.43Å; V899-K901 HydrophobicContact CG1-CG 4.2Å; K901-V909 WeakPolarHBondContact O-CA 3.41Å; K901-S910 PolarHBondContact N-O 3.14Å; K901-S910 PolarHBondContact O-N 3.2Å
902	P	81.9	Confident	79.2	Confident	38 Å²	38	28.4 Å²	28.4	25%	0.247	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	147.6	163.5	-17.5	30.3	0	0	0	110.3	L638 F707 P738 V908	L638-P902 HydrophobicContact CD1-CB 4.44Å; F707-P902 HydrophobicContact CD1-CG 4.09Å; F707-P902 HydrophobicContact CD2-CG 3.86Å; F707-P902 HydrophobicContact CE1-CG 4.08Å; F707-P902 HydrophobicContact CE2-CG 3.83Å; F707-P902 HydrophobicContact CG-CG 3.99Å; F707-P902 HydrophobicContact CZ-CB 4.31Å; F707-P902 HydrophobicContact CZ-CG 3.94Å; P738-P902 HydrophobicContact CG-CB 3.88Å; P738-P902 HydrophobicContact CG-CG 4.1Å; P902-V908 WeakPolarHBondContact CA-O 3.47Å
903	A	75.8	Confident	79.3	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.008	15%	0.145	C	C	.	.			trans	-150.8	-177.3	178.6	0	0	0	0	0	111	Y907 V908	A903-Y907 CarbonylContact C-O 3.47Å; A903-Y907 WeakPolarHBondContact CB-O 3.34Å; A903-V908 PolarHBondContact N-O 2.86Å; A903-V908 WeakPolarHBondContact O-CA 3.39Å
904	D	65	Low	78.9	Confident	21 Å²	21	32.3 Å²	32.3	11%	0.112	16%	0.163	C	C	.	.			trans	-98.4	144.5	-159.2	-66.1	-61.3	0	0	0	115.6	P637 L638 S639 Y907	P637-D904 VanDerWaalsContact CA-CG 3.47Å; P637-D904 VanDerWaalsContact CA-OD1 3.27Å; P637-D904 WeakPolarHBondContact CA-OD1 3.35Å; L638-D904 WeakPolarHBondContact CB-OD1 3.18Å; L638-D904 PolarHBondContact N-OD1 3.06Å; L638-D904 PolarHBondContact N-OD2 2.92Å; S639-D904 WeakPolarHBondContact CA-OD2 3.29Å; S639-D904 WeakPolarHBondContact CB-OD2 3.44Å; S639-D904 PolarHBondContact N-OD2 3.34Å; S639-D904 PolarHBondContact OG-OD2 3.46Å; D904-Y907 PolarHBondContact N-O 3.41Å; D904-Y907 CarbonylContact O-C 3.51Å; D904-Y907 VanDerWaalsContact O-CA 3.3Å; D904-Y907 WeakPolarHBondContact O-CA 3.34Å; D904-Y907 WeakPolarHBondContact O-CB 3.45Å; D904-Y907 PolarHBondContact O-N 3.06Å
905	W	54.2	Low	78.6	Confident	164 Å²	164	39.9 Å²	39.9	62%	0.621	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	131.2	-177	-173.2	96.9	0	0	0	111.3	M740	M740-W905 HydrophobicContact CE-CB 4.29Å
906	P	55.3	Low	78.3	Confident	55 Å²	55	41.5 Å²	41.5	36%	0.357	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.5	9.2	9.4	34.3	-35.3	0	0	0	115.5
907	Y	68.6	Low	77.4	Confident	63 Å²	63	43.5 Å²	43.5	25%	0.247	21%	0.207	C	C	.	.			trans	-109.7	73.2	-169.2	-52.2	-43.7	0	0	0	112.9	P642 S645 P646 L647 A903 D904 V909	P642-Y907 HydrophobicContact CG-CD2 3.81Å; P642-Y907 HydrophobicContact CG-CG 4.28Å; S645-Y907 WeakPolarHBondContact CB-OH 3.44Å; S645-Y907 WeakPolarHBondContact OG-CE1 3.39Å; S645-Y907 PolarHBondContact OG-OH 3.47Å; S645-Y907 VanDerWaalsContact OG-OH 3.1Å; P646-Y907 HydrophobicContact CG-CD1 4.09Å; P646-Y907 HydrophobicContact CG-CG 4.1Å; L647-Y907 HydrophobicContact CD1-CE1 4.1Å; L647-Y907 HydrophobicContact CG-CE1 4.28Å; A903-Y907 CarbonylContact C-O 3.47Å; A903-Y907 WeakPolarHBondContact CB-O 3.34Å; D904-Y907 PolarHBondContact N-O 3.41Å; D904-Y907 CarbonylContact O-C 3.51Å; D904-Y907 VanDerWaalsContact O-CA 3.3Å; D904-Y907 WeakPolarHBondContact O-CA 3.34Å; D904-Y907 WeakPolarHBondContact O-CB 3.45Å; D904-Y907 PolarHBondContact O-N 3.06Å; Y907-V909 PolarHBondContact O-N 3.37Å
908	V	72.3	Confident	75.8	Confident	10 Å²	10	52.1 Å²	52.1	6%	0.061	24%	0.244	C	C	.	.			trans	-66.4	-11.6	-169.2	-60.5	0	0	0	0	117	M740 V744 P902 A903	M740-V908 HydrophobicContact CB-CG1 4.05Å; M740-V908 HydrophobicContact CE-CG1 4.38Å; V744-V908 HydrophobicContact CG2-CB 4.02Å; V744-V908 HydrophobicContact CG2-CG1 3.3Å; V744-V908 HydrophobicContact CG2-CG2 3.52Å; P902-V908 WeakPolarHBondContact CA-O 3.47Å; A903-V908 PolarHBondContact N-O 2.86Å; A903-V908 WeakPolarHBondContact O-CA 3.39Å
909	V	83.9	Confident	73.7	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.9	173.3	-177.7	0	0	0	0	109.9	F707 I831 M900 K901 Y907 V911	F707-V909 HydrophobicContact CE1-CG1 4.22Å; F707-V909 HydrophobicContact CE1-CG2 4.05Å; F707-V909 HydrophobicContact CZ-CG2 4.03Å; I831-V909 HydrophobicContact CG2-CG2 3.82Å; M900-V909 HydrophobicContact CB-CG1 4.26Å; K901-V909 WeakPolarHBondContact O-CA 3.41Å; Y907-V909 PolarHBondContact O-N 3.37Å; V909-V911 HydrophobicContact CG1-CG2 3.82Å
910	S	86.4	Confident	71.7	Confident	25 Å²	25	56.2 Å²	56.2	18%	0.175	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.8	166.5	-173.9	0	0	0	0	110.6	T880 M900 K901	T880-S910 PolarHBondContact OG1-OG 3.46Å; T880-S910 VanDerWaalsContact OG1-OG 3.07Å; M900-S910 WeakPolarHBondContact CA-O 3.42Å; K901-S910 PolarHBondContact N-O 3.14Å; K901-S910 PolarHBondContact O-N 3.2Å
911	V	88.6	Confident	69.2	Low	7 Å²	7	61.7 Å²	61.7	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	113	-162.2	-177.7	0	0	0	0	110.1	I877 C879 T880 F888 V898 M900 V909	I877-V911 HydrophobicContact CD1-CG1 3.96Å; I877-V911 HydrophobicContact CD1-CG2 4.09Å; C879-V911 WeakPolarHBondContact CA-O 3.48Å; T880-V911 HydrophobicContact CG2-CB 4.25Å; T880-V911 PolarHBondContact N-O 2.89Å; T880-V911 PolarHBondContact OG1-N 3.21Å; T880-V911 PolarHBondContact OG1-O 3.24Å; F888-V911 HydrophobicContact CE2-CG1 3.49Å; F888-V911 VanDerWaalsContact CE2-CG1 3.49Å; F888-V911 HydrophobicContact CZ-CG1 3.62Å; V898-V911 HydrophobicContact CG1-CG1 4.14Å; M900-V911 HydrophobicContact CG-CG1 4.38Å; M900-V911 HydrophobicContact CG-CG2 4.38Å; V909-V911 HydrophobicContact CG1-CG2 3.82Å
912	S	87.8	Confident	66.7	Low	14 Å²	14	65.2 Å²	65.2	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.7	-176.3	-68.4	0	0	0	0	112.3	V898 V899 I920	V898-S912 WeakPolarHBondContact CG1-O 3.23Å; V899-S912 PolarHBondContact N-O 3.38Å; V899-S912 PolarHBondContact O-N 3.31Å; S912-I920 WeakPolarHBondContact OG-CD1 3.45Å
913	C	87.6	Confident	64.6	Low	3 Å²	3	69.2 Å²	69.2	2%	0.02	35%	0.348	C	S	.	.			trans	-70.9	162.2	178.8	75.8	0	0	0	0	112.7	C879 T886 F888 K915 H916 K917	C879-C913 HydrophobicContact CB-CB 4.17Å; C879-C913 PolarHBondContact SG-N 3.22Å; T886-C913 HydrophobicContact CG2-CB 3.95Å; F888-C913 HydrophobicContact CE1-CB 3.87Å; F888-C913 HydrophobicContact CZ-CB 4.33Å; C913-K915 PolarHBondContact O-N 2.92Å; C913-K915 VanDerWaalsContact O-N 3.11Å; C913-H916 PolarHBondContact O-N 2.97Å; C913-K917 PolarHBondContact O-N 3Å
914	H	80.9	Confident	62.4	Low	81 Å²	81	75 Å²	75	38%	0.375	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.4	-175.7	-58.9	61.1	0	0	0	114.2	F863 A896 H916 K917	F863-H914 AromaticContact CZ-CE1 3.81Å; A896-H914 PolarHBondContact O-CE1 2.75Å; A896-H914 PolarHBondContact O-NE2 2.92Å; H914-H916 VanDerWaalsContact C-N 3.31Å; H914-H916 PolarHBondContact O-N 2.9Å; H914-K917 WeakPolarHBondContact O-CB 3.49Å; H914-K917 PolarHBondContact O-N 3.17Å
915	K	77.7	Confident	60.7	Low	165 Å²	165	79.7 Å²	79.7	72%	0.717	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-38.8	173.9	-64.3	-170.5	176.1	-171.6	0	112.1	C913	C913-K915 PolarHBondContact O-N 2.92Å; C913-K915 VanDerWaalsContact O-N 3.11Å
916	H	75.7	Confident	59.6	Low	52 Å²	52	78.7 Å²	78.7	24%	0.241	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-4.6	-177.5	-55.8	140.9	0	0	0	113.8	H881 C884 C913 H914 K918 G919	H881-H916 WeakPolarHBondContact CB-ND1 3.47Å; H881-H916 AromaticContact CD2-CD2 3.77Å; H881-H916 AromaticContact CD2-CE1 3.51Å; H881-H916 AromaticContact CD2-CG 3.63Å; H881-H916 AromaticContact CD2-ND1 3.47Å; H881-H916 PolarHBondContact CD2-ND1 2.88Å; H881-H916 AromaticContact CD2-NE2 3.75Å; H881-H916 AromaticContact CG-CG 3.94Å; H881-H916 AromaticContact CG-ND1 3.65Å; C884-H916 PolarHBondContact SG-CE1 2.92Å; C913-H916 PolarHBondContact O-N 2.97Å; H914-H916 VanDerWaalsContact C-N 3.31Å; H914-H916 PolarHBondContact O-N 2.9Å; H916-K918 PolarHBondContact O-N 3.07Å; H916-G919 PolarHBondContact O-N 2.67Å; H916-G919 VanDerWaalsContact O-N 3.1Å
917	K	60.7	Low	58.3	Low	64 Å²	64	82.9 Å²	82.9	28%	0.278	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-12.8	173.8	-167.5	170.1	-178	173.8	0	114.1	G897 V899 C913 H914 Q921	G897-K917 PolarHBondContact O-NZ 2.98Å; V899-K917 HydrophobicContact CG2-CD 4.08Å; V899-K917 HydrophobicContact CG2-CG 4.15Å; C913-K917 PolarHBondContact O-N 3Å; H914-K917 WeakPolarHBondContact O-CB 3.49Å; H914-K917 PolarHBondContact O-N 3.17Å; K917-Q921 PolarHBondContact O-NE2 3.08Å
918	K	47	Very low	56.4	Low	183 Å²	183	86.6 Å²	86.6	80%	0.796	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-37.2	172.6	-69.6	-172.3	176.4	-176.5	0	113.3	H916 I920	H916-K918 PolarHBondContact O-N 3.07Å; K918-I920 VanDerWaalsContact C-N 3.35Å; K918-I920 PolarHBondContact O-N 3.37Å
919	G	41.7	Very low	54.4	Low	65 Å²	65	91.8 Å²	91.8	67%	0.67	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-16.9	-177.3	0	0	0	0	0	115.1	H916	H916-G919 PolarHBondContact O-N 2.67Å; H916-G919 VanDerWaalsContact O-N 3.1Å
920	I	41.9	Very low	51.8	Low	60 Å²	60	97.8 Å²	97.8	31%	0.308	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-8.5	-172	-64.1	173.1	0	0	0	112.4	S912 K918	S912-I920 WeakPolarHBondContact OG-CD1 3.45Å; K918-I920 VanDerWaalsContact C-N 3.35Å; K918-I920 PolarHBondContact O-N 3.37Å
921	Q	35.2	Very low	49	Very low	124 Å²	124	105.5 Å²	105.5	58%	0.579	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-82	-9.9	-175.9	-77.6	178.2	83.4	0	0	115.1	K917	K917-Q921 PolarHBondContact O-NE2 3.08Å
922	M	32.8	Very low	46.4	Very low	166 Å²	166	111.1 Å²	111.1	82%	0.818	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-76.9	-18	173	-78.8	179.6	159.1	0	0	113.9
923	V	37.1	Very low	43.9	Very low	121 Å²	121	122 Å²	122	73%	0.733	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-86.9	-6.7	-179	-167.8	0	0	0	0	112.6
924	N	29.6	Very low	40.9	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	65%	0.653	S	S	*	*	S	Bend	trans	-130.5	47.5	-175.2	-82.9	105.4	0	0	0	111.6
925	K	30.5	Very low	38.4	Very low	121 Å²	121	127.1 Å²	127.1	53%	0.526	67%	0.673	S	S	.	*			trans	-144	31.5	-178.8	-140.1	173.6	-171.5	-81.3	0	117.7	N927 K928	K925-N927 PolarHBondContact O-N 3.14Å; K925-K928 PolarHBondContact NZ-O 3.3Å
926	V	31.1	Very low	36.8	Very low	143 Å²	143	125.2 Å²	125.2	87%	0.867	68%	0.678	S	S	*	*	S	Bend	trans	-77	68.2	152.7	-173.7	0	0	0	0	108.4
927	N	27.5	Very low	34.4	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	71%	0.708	S	S	*	*	S	Bend	trans	162.4	145.9	153.7	-89.9	-44.3	0	0	0	112.5	K925	K925-N927 PolarHBondContact O-N 3.14Å
928	K	28.6	Very low	32.9	Very low	141 Å²	141	135.3 Å²	135.3	61%	0.613	73%	0.733	S	S	*	*			trans	62.2	121.1	-176.8	-67.5	-172	174.5	-177.9	0	116.1	D716 K925	D716-K928 VanDerWaalsContact CG-NZ 3.28Å; D716-K928 IonicContact OD1-NZ 2.87Å; D716-K928 PolarHBondContact OD1-NZ 3.01Å; D716-K928 IonicContact OD2-NZ 3.74Å; D716-K928 PolarHBondContact OD2-NZ 3.48Å; K925-K928 PolarHBondContact NZ-O 3.3Å
929	V	29.4	Very low	32	Very low	119 Å²	119	130.8 Å²	130.8	72%	0.721	73%	0.73	S	S	*	*			trans	-113.8	141.9	-176.9	165.9	0	0	0	0	110.4
930	N	29.9	Very low	31.8	Very low	134 Å²	134	133.4 Å²	133.4	72%	0.717	74%	0.735	S	S	*	*			trans	57.1	165.5	167.6	-65.3	-15.7	0	0	0	117.3
931	K	27.4	Very low	32	Very low	188 Å²	188	139.8 Å²	139.8	82%	0.817	76%	0.764	S	S	*	*			cis	-150.9	-175.5	-3.1	-127.1	163	-174.4	176.9	0	105.4
932	P	34.5	Very low	32.8	Very low	125 Å²	125	135.3 Å²	135.3	81%	0.812	75%	0.751	S	S	*	*			cis	-124.7	-160.1	-15.8	40.8	-23.3	0	0	0	112.7
933	R	35.9	Very low	34.5	Very low	241 Å²	241	128.1 Å²	128.1	91%	0.909	72%	0.716	S	S	*	*			trans	-105.3	156.6	-168.5	-172.1	-179	-171.8	171.2	1.5	112.2
934	A	24	Very low	35.8	Very low	96 Å²	96	127 Å²	127	79%	0.793	71%	0.705	S	S	*	*			trans	-133.8	163.8	168.9	0	0	0	0	0	111.7
935	A	28	Very low	37.7	Very low	97 Å²	97	126.5 Å²	126.5	80%	0.802	70%	0.703	S	S	*	*			trans	-60.5	157.2	-160.1	0	0	0	0	0	117.3
936	P	45.2	Very low	39.4	Very low	125 Å²	125	123.3 Å²	123.3	81%	0.812	70%	0.704	S	S	*	*			trans	-88.1	159.3	-170.5	35.9	-37.2	0	0	0	115.2
937	K	24.4	Very low	41.8	Very low	203 Å²	203	119.6 Å²	119.6	88%	0.883	68%	0.679	S	S	*	*			trans	-152.4	163.9	157.7	-109.3	168.4	-174.2	176.5	0	108.6
938	P	29.3	Very low	44.4	Very low	124 Å²	124	119.7 Å²	119.7	81%	0.805	67%	0.672	S	S	*	*	P	Polyproline II helix		-70.8	158.8	-124.5	26.4	-37.1	0	0	0	116
939	A	29	Very low	47.2	Very low	88 Å²	88	113 Å²	113	73%	0.727	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-71.9	158.7	177.1	0	0	0	0	0	112.5
940	P	37.4	Very low	49.9	Very low	121 Å²	121	107.5 Å²	107.5	79%	0.786	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-57.7	149.9	154.8	-13.9	29.3	0	0	0	109.7	G942	P940-G942 PolarHBondContact O-N 3.34Å
941	Q	46.1	Very low	52.5	Low	193 Å²	193	101.1 Å²	101.1	90%	0.902	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-58.6	137.3	-180	-72.8	162.3	-58.9	0	0	111.2
942	G	51.9	Low	55.2	Low	30 Å²	30	96.4 Å²	96.4	31%	0.309	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-77.9	162.7	-177.5	0	0	0	0	0	112.7	P940 D944	P940-G942 PolarHBondContact O-N 3.34Å; G942-D944 WeakPolarHBondContact CA-OD1 3.14Å; G942-D944 PolarHBondContact O-N 2.89Å; G942-D944 VanDerWaalsContact O-N 3.12Å
943	L	68.1	Low	57.4	Low	16 Å²	16	92 Å²	92	8%	0.084	52%	0.521	C	S	.	.			trans	-79.1	75.2	154.2	-73.5	-179.5	0	0	0	107.5	V949 I963 I966 Y1030 Q1044 I1047 Q1049	L943-V949 HydrophobicContact CD2-CG1 4.26Å; L943-I963 HydrophobicContact CB-CD1 3.74Å; L943-I963 HydrophobicContact CD1-CD1 4.49Å; L943-I963 HydrophobicContact CD2-CD1 4.14Å; L943-I963 HydrophobicContact CG-CD1 4.34Å; L943-I966 WeakPolarHBondContact O-CD1 3.01Å; L943-Y1030 HydrophobicContact CB-CD1 4.18Å; L943-Y1030 HydrophobicContact CB-CE1 3.46Å; L943-Y1030 VanDerWaalsContact CB-CE1 3.46Å; L943-Y1030 HydrophobicContact CD1-CE1 4.16Å; L943-Y1030 HydrophobicContact CD1-CE2 4.18Å; L943-Y1030 HydrophobicContact CG-CE1 4.47Å; L943-Y1030 WeakPolarHBondContact O-CE1 3.11Å; L943-Q1044 HydrophobicContact CD1-CG 3.95Å; L943-I1047 HydrophobicContact CD1-CG2 4.33Å; L943-Q1049 HydrophobicContact CD2-CG 3.57Å
944	D	64.8	Low	59.2	Low	96 Å²	96	85.3 Å²	85.3	51%	0.513	51%	0.511	S	S	.	.			trans	-74.4	163.1	-177.5	-56.9	-31.5	0	0	0	112.5	G942 L947	G942-D944 WeakPolarHBondContact CA-OD1 3.14Å; G942-D944 PolarHBondContact O-N 2.89Å; G942-D944 VanDerWaalsContact O-N 3.12Å; D944-L947 HydrophobicContact CB-CD1 4.19Å; D944-L947 WeakPolarHBondContact O-CB 3.39Å; D944-L947 PolarHBondContact O-N 2.79Å
945	L	67.8	Low	61.5	Low	113 Å²	113	84 Å²	84	59%	0.592	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	142.3	178.5	-63.3	169.2	0	0	0	111.4	L947 I963 G965 I966	L945-L947 VanDerWaalsContact C-N 3.31Å; L945-L947 PolarHBondContact O-N 2.69Å; L945-I963 HydrophobicContact CD2-CG2 4.42Å; L945-G965 VanDerWaalsContact CD2-CA 3.5Å; L945-I966 HydrophobicContact CD2-CD1 4.15Å; L945-I966 HydrophobicContact CD2-CG1 3.82Å; L945-I966 HydrophobicContact CG-CD1 4.11Å; L945-I966 HydrophobicContact CG-CG1 4.34Å
946	G	68	Low	63.6	Low	53 Å²	53	81.7 Å²	81.7	55%	0.546	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-6.1	-177.7	0	0	0	0	0	115.2	K948 T962 I963	G946-K948 PolarHBondContact O-N 2.66Å; G946-T962 WeakPolarHBondContact O-CG2 3.23Å; G946-I963 PolarHBondContact N-O 3.38Å
947	L	81.3	Confident	65.1	Low	66 Å²	66	79.1 Å²	79.1	35%	0.346	44%	0.441	S	S	.	.			trans	-69.8	129.9	177.3	-89	163.9	0	0	0	112.1	D944 L945 V949 T962 I963	D944-L947 HydrophobicContact CB-CD1 4.19Å; D944-L947 WeakPolarHBondContact O-CB 3.39Å; D944-L947 PolarHBondContact O-N 2.79Å; L945-L947 VanDerWaalsContact C-N 3.31Å; L945-L947 PolarHBondContact O-N 2.69Å; L947-V949 HydrophobicContact CB-CG1 4.44Å; L947-T962 WeakPolarHBondContact O-CA 3.19Å; L947-I963 PolarHBondContact O-N 2.89Å
948	K	81.3	Confident	68	Low	145 Å²	145	70.8 Å²	70.8	63%	0.63	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.7	169.1	-67.7	-176.8	178.5	178.5	0	109.8	G946 C961 L1050	G946-K948 PolarHBondContact O-N 2.66Å; K948-C961 WeakPolarHBondContact CA-O 3.39Å; K948-L1050 HydrophobicContact CB-CD1 3.76Å; K948-L1050 WeakPolarHBondContact O-CD1 3.35Å; K948-L1050 WeakPolarHBondContact O-CG 3.47Å
949	V	87.6	Confident	70.6	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	178.8	-174.3	-64.2	0	0	0	0	109.6	L943 L947 H960 C961 I963 I1047 F1048	L943-V949 HydrophobicContact CD2-CG1 4.26Å; L947-V949 HydrophobicContact CB-CG1 4.44Å; V949-H960 WeakPolarHBondContact O-CA 3.45Å; V949-C961 PolarHBondContact N-O 3.48Å; V949-C961 PolarHBondContact O-N 2.91Å; V949-C961 VanDerWaalsContact O-O 3.09Å; V949-I963 HydrophobicContact CG1-CD1 4.03Å; V949-I963 HydrophobicContact CG1-CG1 4.33Å; V949-I963 HydrophobicContact CG2-CD1 4.24Å; V949-I963 HydrophobicContact CG2-CG1 3.81Å; V949-I1047 HydrophobicContact CB-CG2 3.75Å; V949-I1047 HydrophobicContact CG1-CG2 4.15Å; V949-I1047 HydrophobicContact CG2-CG2 3.58Å; V949-F1048 CarbonylContact C-O 3.59Å
950	I	86.6	Confident	73.2	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.015	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.4	172.9	-73.4	164.2	0	0	0	108.1	Y958 Y959 I1047 F1048 L1050 L1054 V1058 L1062	I950-Y958 HydrophobicContact CG2-CD1 4.27Å; I950-Y958 HydrophobicContact CG2-CG 4.43Å; I950-Y959 WeakPolarHBondContact CA-O 3.5Å; I950-I1047 WeakPolarHBondContact O-CA 3.33Å; I950-F1048 HydrophobicContact CB-CB 4.38Å; I950-F1048 PolarHBondContact N-O 3.1Å; I950-F1048 PolarHBondContact O-N 3.44Å; I950-L1050 HydrophobicContact CD1-CD2 3.66Å; I950-L1050 HydrophobicContact CG1-CD2 3.65Å; I950-L1054 HydrophobicContact CD1-CD1 3.54Å; I950-L1054 HydrophobicContact CD1-CD2 4.07Å; I950-L1054 HydrophobicContact CD1-CG 4.41Å; I950-V1058 HydrophobicContact CG2-CG1 4.26Å; I950-L1062 HydrophobicContact CD1-CD1 3.76Å; I950-L1062 HydrophobicContact CD1-CD2 3.9Å; I950-L1062 HydrophobicContact CG1-CD1 3.94Å; I950-L1062 HydrophobicContact CG2-CD1 3.8Å
951	G	84.1	Confident	75.5	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	155.1	177.1	0	0	0	0	0	111.5	Y958 Y959 C961	G951-Y958 WeakPolarHBondContact O-CA 3.35Å; G951-Y959 PolarHBondContact N-O 3.34Å; G951-Y959 PolarHBondContact O-N 3Å; G951-C961 VanDerWaalsContact CA-SG 3.59Å; G951-C961 PolarHBondContact N-SG 3.38Å
952	R	84.9	Confident	77.4	Confident	88 Å²	88	52.6 Å²	52.6	33%	0.332	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.5	169.7	-171.8	-176.5	172.1	-159.8	-6.1	110.1	Y958 E1046	R952-Y958 HydrophobicContact CB-CD1 3.92Å; R952-Y958 HydrophobicContact CB-CE1 3.65Å; R952-Y958 HydrophobicContact CG-CD1 4.41Å; R952-Y958 HydrophobicContact CG-CE1 4Å; R952-E1046 HydrophobicContact CB-CB 4.4Å; R952-E1046 VanDerWaalsContact CD-OE1 3.3Å; R952-E1046 WeakPolarHBondContact CD-OE1 3.1Å; R952-E1046 IonicContact CZ-OE1 2.72Å; R952-E1046 PolarHBondContact N-O 2.71Å; R952-E1046 IonicContact NE-OE1 2.8Å; R952-E1046 IonicContact NH1-OE1 2.62Å; R952-E1046 PolarHBondContact NH1-OE1 2.92Å
953	K	80	Confident	78.9	Confident	32 Å²	32	51.2 Å²	51.2	14%	0.139	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-97.3	168.4	175.2	-163.6	164.5	179.4	177.1	0	111.6	D955 T956 W957 Y959 F1034 D1036 S1038	K953-D955 VanDerWaalsContact C-N 3.28Å; K953-D955 PolarHBondContact O-N 2.95Å; K953-T956 VanDerWaalsContact O-CA 3.3Å; K953-T956 WeakPolarHBondContact O-CA 3.24Å; K953-T956 PolarHBondContact O-N 2.02Å; K953-W957 PolarHBondContact N-O 2.88Å; K953-Y959 HydrophobicContact CB-CD2 3.69Å; K953-Y959 HydrophobicContact CB-CE2 3.92Å; K953-Y959 HydrophobicContact CD-CD2 4Å; K953-Y959 HydrophobicContact CD-CE2 4.06Å; K953-F1034 HydrophobicContact CB-CE1 4.24Å; K953-F1034 HydrophobicContact CB-CE2 4.36Å; K953-F1034 HydrophobicContact CB-CZ 4.03Å; K953-F1034 HydrophobicContact CD-CD1 4.46Å; K953-F1034 HydrophobicContact CD-CD2 4.24Å; K953-F1034 HydrophobicContact CD-CE2 4.49Å; K953-F1034 HydrophobicContact CD-CG 4.23Å; K953-F1034 HydrophobicContact CG-CD2 4.41Å; K953-F1034 HydrophobicContact CG-CE2 4.2Å; K953-F1034 HydrophobicContact CG-CZ 4.36Å; K953-D1036 IonicContact NZ-OD1 3.32Å; K953-D1036 PolarHBondContact NZ-OD1 3.34Å; K953-D1036 IonicContact NZ-OD2 2.69Å; K953-D1036 PolarHBondContact NZ-OD2 3.11Å; K953-S1038 VanDerWaalsContact CE-OG 3.26Å; K953-S1038 WeakPolarHBondContact CE-OG 3.4Å; K953-S1038 PolarHBondContact NZ-OG 2.95Å; K953-S1038 VanDerWaalsContact NZ-OG 3.08Å
954	S	72.8	Confident	79.5	Confident	102 Å²	102	53.3 Å²	53.3	71%	0.713	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.1	-177.7	48.8	0	0	0	0	113.8	T956	S954-T956 PolarHBondContact O-N 3.24Å; S954-T956 VanDerWaalsContact O-N 3.11Å
955	D	73.4	Confident	79.8	Confident	67 Å²	67	49.2 Å²	49.2	36%	0.358	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-5.1	168.6	56.1	46.3	0	0	0	114.5	K953 W957 Y959	K953-D955 VanDerWaalsContact C-N 3.28Å; K953-D955 PolarHBondContact O-N 2.95Å; D955-W957 VanDerWaalsContact C-N 3.3Å; D955-W957 PolarHBondContact O-N 3.4Å; D955-W957 WeakPolarHBondContact OD1-CB 3.4Å; D955-W957 PolarHBondContact OD1-N 2.89Å; D955-Y959 WeakPolarHBondContact OD2-CE2 3.32Å
956	T	72.5	Confident	80.4	Confident	49 Å²	49	47.3 Å²	47.3	30%	0.301	25%	0.25	S	S	.	.	S	Bend	trans	69.6	7.4	-177.6	76.5	0	0	0	0	116.9	K953 S954 R1061	K953-T956 VanDerWaalsContact O-CA 3.3Å; K953-T956 WeakPolarHBondContact O-CA 3.24Å; K953-T956 PolarHBondContact O-N 2.02Å; S954-T956 PolarHBondContact O-N 3.24Å; S954-T956 VanDerWaalsContact O-N 3.11Å; T956-R1061 PolarHBondContact O-NH1 3.23Å; T956-R1061 PolarHBondContact O-NH2 2.71Å; T956-R1061 PolarHBondContact OG1-NH1 2.97Å; T956-R1061 PolarHBondContact OG1-NH2 2.71Å
957	W	76.3	Confident	80.4	Confident	71 Å²	71	46.5 Å²	46.5	27%	0.269	24%	0.239	S	C	.	.			trans	-81.2	169.3	165.4	-73.9	76.3	0	0	0	111.1	K953 D955 Y959 R1061 L1085	K953-W957 PolarHBondContact N-O 2.88Å; D955-W957 VanDerWaalsContact C-N 3.3Å; D955-W957 PolarHBondContact O-N 3.4Å; D955-W957 WeakPolarHBondContact OD1-CB 3.4Å; D955-W957 PolarHBondContact OD1-N 2.89Å; W957-Y959 HydrophobicContact CB-CD2 4.33Å; W957-Y959 HydrophobicContact CB-CE2 3.56Å; W957-R1061 VanDerWaalsContact CD1-NH2 3.34Å; W957-R1061 HydrophobicContact CE3-CB 4.37Å; W957-R1061 VanDerWaalsContact CE3-O 3.29Å; W957-L1085 HydrophobicContact CE3-CD2 3.91Å; W957-L1085 HydrophobicContact CH2-CD2 3.98Å; W957-L1085 HydrophobicContact CZ3-CD2 3.54Å
958	Y	84.4	Confident	79.9	Confident	28 Å²	28	47.7 Å²	47.7	11%	0.11	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.9	176.9	-64.9	-87.3	0	0	0	110	I950 G951 R952 F1048 V1058 R1061 L1062 A1063	I950-Y958 HydrophobicContact CG2-CD1 4.27Å; I950-Y958 HydrophobicContact CG2-CG 4.43Å; G951-Y958 WeakPolarHBondContact O-CA 3.35Å; R952-Y958 HydrophobicContact CB-CD1 3.92Å; R952-Y958 HydrophobicContact CB-CE1 3.65Å; R952-Y958 HydrophobicContact CG-CD1 4.41Å; R952-Y958 HydrophobicContact CG-CE1 4Å; Y958-F1048 HydrophobicContact CD1-CE2 4.41Å; Y958-F1048 HydrophobicContact CE1-CD2 4.4Å; Y958-F1048 AromaticContact CE1-CE2 3.84Å; Y958-F1048 HydrophobicContact CE1-CE2 3.84Å; Y958-V1058 HydrophobicContact CD1-CG1 4.04Å; Y958-V1058 HydrophobicContact CD2-CB 4.43Å; Y958-V1058 HydrophobicContact CD2-CG1 4.07Å; Y958-V1058 HydrophobicContact CE1-CG1 4.4Å; Y958-V1058 HydrophobicContact CE1-CG2 4.19Å; Y958-V1058 HydrophobicContact CE2-CB 4.42Å; Y958-V1058 HydrophobicContact CE2-CG1 4.44Å; Y958-V1058 HydrophobicContact CE2-CG2 4.12Å; Y958-V1058 HydrophobicContact CG-CG1 3.86Å; Y958-R1061 HydrophobicContact CD2-CB 3.96Å; Y958-R1061 HydrophobicContact CE2-CB 4.41Å; Y958-R1061 PolarHBondContact N-O 3.36Å; Y958-L1062 WeakPolarHBondContact O-CA 3.49Å; Y958-A1063 PolarHBondContact O-N 3.37Å
959	Y	84.8	Confident	79.6	Confident	61 Å²	61	44 Å²	44	24%	0.239	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.8	-175.9	-66.8	-91.1	0	0	0	110.3	I950 G951 K953 D955 W957 A1063	I950-Y959 WeakPolarHBondContact CA-O 3.5Å; G951-Y959 PolarHBondContact N-O 3.34Å; G951-Y959 PolarHBondContact O-N 3Å; K953-Y959 HydrophobicContact CB-CD2 3.69Å; K953-Y959 HydrophobicContact CB-CE2 3.92Å; K953-Y959 HydrophobicContact CD-CD2 4Å; K953-Y959 HydrophobicContact CD-CE2 4.06Å; D955-Y959 WeakPolarHBondContact OD2-CE2 3.32Å; W957-Y959 HydrophobicContact CB-CD2 4.33Å; W957-Y959 HydrophobicContact CB-CE2 3.56Å; Y959-A1063 HydrophobicContact CD1-CB 3.5Å; Y959-A1063 VanDerWaalsContact CD1-CB 3.5Å; Y959-A1063 HydrophobicContact CE1-CB 3.42Å; Y959-A1063 VanDerWaalsContact CE1-CB 3.42Å; Y959-A1063 HydrophobicContact CG-CB 4.33Å
960	H	83.8	Confident	79.1	Confident	42 Å²	42	45.6 Å²	45.6	19%	0.194	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	131.1	166.8	-64.6	-86.3	0	0	0	109.9	V949 L1050	V949-H960 WeakPolarHBondContact O-CA 3.45Å; H960-L1050 WeakPolarHBondContact ND1-CD2 3.22Å
961	C	84.3	Confident	78.9	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.027	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	160.6	176.3	58.7	0	0	0	0	110.7	K948 V949 G951 V1032 E1033 F1034	K948-C961 WeakPolarHBondContact CA-O 3.39Å; V949-C961 PolarHBondContact N-O 3.48Å; V949-C961 PolarHBondContact O-N 2.91Å; V949-C961 VanDerWaalsContact O-O 3.09Å; G951-C961 VanDerWaalsContact CA-SG 3.59Å; G951-C961 PolarHBondContact N-SG 3.38Å; C961-V1032 HydrophobicContact CB-CB 4.04Å; C961-V1032 HydrophobicContact CB-CG2 4.29Å; C961-E1033 CarbonylContact C-O 3.52Å; C961-E1033 WeakPolarHBondContact CA-O 3.45Å; C961-E1033 WeakPolarHBondContact CB-O 3.38Å; C961-F1034 HydrophobicContact CB-CD1 3.57Å; C961-F1034 HydrophobicContact CB-CE1 3.8Å; C961-F1034 HydrophobicContact CB-CG 4.1Å; C961-F1034 HydrophobicContact CB-CZ 4.5Å
962	T	86.3	Confident	78.8	Confident	38 Å²	38	46.5 Å²	46.5	23%	0.233	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.2	176.3	-47.8	0	0	0	0	109.2	G946 L947 I964 V1032 E1033	G946-T962 WeakPolarHBondContact O-CG2 3.23Å; L947-T962 WeakPolarHBondContact O-CA 3.19Å; T962-I964 PolarHBondContact O-N 3.01Å; T962-V1032 CarbonylContact O-C 3.55Å; T962-V1032 VanDerWaalsContact O-CA 3.28Å; T962-V1032 WeakPolarHBondContact O-CA 3.46Å; T962-E1033 PolarHBondContact N-O 2.89Å; T962-E1033 PolarHBondContact O-N 2.98Å
963	I	84.8	Confident	78.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	111.4	170.7	-59.2	179.3	0	0	0	108	L943 L945 G946 L947 V949 I966 Y1030 V1032	L943-I963 HydrophobicContact CB-CD1 3.74Å; L943-I963 HydrophobicContact CD1-CD1 4.49Å; L943-I963 HydrophobicContact CD2-CD1 4.14Å; L943-I963 HydrophobicContact CG-CD1 4.34Å; L945-I963 HydrophobicContact CD2-CG2 4.42Å; G946-I963 PolarHBondContact N-O 3.38Å; L947-I963 PolarHBondContact O-N 2.89Å; V949-I963 HydrophobicContact CG1-CD1 4.03Å; V949-I963 HydrophobicContact CG1-CG1 4.33Å; V949-I963 HydrophobicContact CG2-CD1 4.24Å; V949-I963 HydrophobicContact CG2-CG1 3.81Å; I963-I966 HydrophobicContact CG2-CG1 4.08Å; I963-Y1030 HydrophobicContact CD1-CD1 4Å; I963-Y1030 HydrophobicContact CG2-CD1 3.93Å; I963-V1032 HydrophobicContact CG1-CG1 4.19Å
964	I	80.8	Confident	79.2	Confident	60 Å²	60	41.3 Å²	41.3	31%	0.308	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-17.3	-179.1	56.2	157.9	0	0	0	113	T962 Q1031 E1033 Q1039	T962-I964 PolarHBondContact O-N 3.01Å; I964-Q1031 HydrophobicContact CD1-CG 3.85Å; I964-Q1031 HydrophobicContact CG1-CB 4.16Å; I964-Q1031 HydrophobicContact CG1-CG 3.88Å; I964-Q1031 VanDerWaalsContact CG1-O 3.29Å; I964-Q1031 WeakPolarHBondContact CG1-O 3.28Å; I964-Q1031 PolarHBondContact N-O 2.62Å; I964-E1033 HydrophobicContact CD1-CB 3.97Å; I964-E1033 HydrophobicContact CG1-CB 4.16Å; I964-E1033 HydrophobicContact CG2-CB 3.77Å; I964-Q1039 HydrophobicContact CD1-CB 4.46Å; I964-Q1039 HydrophobicContact CD1-CG 3.78Å; I964-Q1039 VanDerWaalsContact CD1-NE2 3.33Å
965	G	71.2	Confident	79.6	Confident	11 Å²	11	39.4 Å²	39.4	11%	0.113	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.8	176.9	0	0	0	0	0	111.5	L945 Y1030 Q1031	L945-G965 VanDerWaalsContact CD2-CA 3.5Å; G965-Y1030 CarbonylContact O-C 3.59Å; G965-Y1030 WeakPolarHBondContact O-CA 3.29Å; G965-Q1031 PolarHBondContact N-O 2.79Å; G965-Q1031 VanDerWaalsContact N-O 3.15Å; G965-Q1031 PolarHBondContact O-N 2.72Å
966	I	80.4	Confident	80	Confident	72 Å²	72	37.8 Å²	37.8	37%	0.369	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	119.4	174	-53.4	169.2	0	0	0	106.9	L943 L945 I963 Y1030	L943-I966 WeakPolarHBondContact O-CD1 3.01Å; L945-I966 HydrophobicContact CD2-CD1 4.15Å; L945-I966 HydrophobicContact CD2-CG1 3.82Å; L945-I966 HydrophobicContact CG-CD1 4.11Å; L945-I966 HydrophobicContact CG-CG1 4.34Å; I963-I966 HydrophobicContact CG2-CG1 4.08Å; I966-Y1030 HydrophobicContact CB-CD1 4.48Å; I966-Y1030 HydrophobicContact CD1-CE1 4.29Å; I966-Y1030 HydrophobicContact CG1-CD1 3.87Å; I966-Y1030 HydrophobicContact CG1-CE1 4Å; I966-Y1030 HydrophobicContact CG2-CD1 4.2Å; I966-Y1030 HydrophobicContact CG2-CE1 3.92Å
967	A	67.3	Low	79.9	Confident	37 Å²	37	41 Å²	41	31%	0.306	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137.8	176.4	0	0	0	0	0	110	L1029 M1041	A967-L1029 HydrophobicContact CB-CB 4.49Å; A967-L1029 PolarHBondContact N-O 2.75Å; A967-L1029 PolarHBondContact O-N 2.81Å; A967-M1041 HydrophobicContact CB-CE 3.7Å
968	T	71.5	Confident	79.1	Confident	90 Å²	90	45.9 Å²	45.9	55%	0.552	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.4	164.4	40.4	0	0	0	0	108.2	V1026 K1028	T968-V1026 HydrophobicContact CG2-CG1 3.91Å; T968-K1028 HydrophobicContact CG2-CG 4.01Å
969	Q	74.3	Confident	77.7	Confident	69 Å²	69	47.7 Å²	47.7	32%	0.322	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.7	170.5	-169.6	169.2	31.4	0	0	108.5	F971 H986 H1027 L1029	Q969-F971 HydrophobicContact CB-CE2 3.93Å; Q969-F971 HydrophobicContact CG-CD2 4.3Å; Q969-F971 HydrophobicContact CG-CE2 3.57Å; Q969-F971 HydrophobicContact CG-CZ 3.83Å; Q969-H986 PolarHBondContact NE2-CE1 2.87Å; Q969-H1027 PolarHBondContact N-O 2.68Å; Q969-H1027 PolarHBondContact O-N 2.86Å; Q969-L1029 HydrophobicContact CB-CD1 3.98Å
970	T	77.3	Confident	76.8	Confident	34 Å²	34	47.1 Å²	47.1	21%	0.209	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138	177.3	-62.7	0	0	0	0	109.5	Y972 P987 E1024	T970-Y972 HydrophobicContact CG2-CD1 3.99Å; T970-Y972 HydrophobicContact CG2-CE1 3.42Å; T970-Y972 VanDerWaalsContact CG2-CE1 3.42Å; T970-P987 HydrophobicContact CG2-CG 3.73Å; T970-P987 VanDerWaalsContact O-CD 3.3Å; T970-P987 WeakPolarHBondContact O-CD 3.48Å; T970-E1024 HydrophobicContact CG2-CG 3.75Å; T970-E1024 VanDerWaalsContact CG2-OE1 3.29Å; T970-E1024 WeakPolarHBondContact CG2-OE1 3.43Å
971	F	81.6	Confident	76.6	Confident	17 Å²	17	50.6 Å²	50.6	8%	0.075	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.3	170.1	-67	-90.4	0	0	0	109	Q969 N984 V985 H986 H1025 H1027	Q969-F971 HydrophobicContact CB-CE2 3.93Å; Q969-F971 HydrophobicContact CG-CD2 4.3Å; Q969-F971 HydrophobicContact CG-CE2 3.57Å; Q969-F971 HydrophobicContact CG-CZ 3.83Å; F971-N984 HydrophobicContact CD1-CB 4.09Å; F971-V985 CarbonylContact C-O 3.59Å; F971-V985 VanDerWaalsContact CA-O 3.31Å; F971-V985 WeakPolarHBondContact CA-O 3.1Å; F971-H986 AromaticContact CE1-CD2 3.8Å; F971-H986 AromaticContact CE1-NE2 3.39Å; F971-H986 WeakPolarHBondContact CE1-NE2 3.43Å; F971-H1025 PolarHBondContact N-O 3.03Å; F971-H1025 PolarHBondContact O-N 2.99Å; F971-H1027 HydrophobicContact CD2-CB 4.31Å; F971-H1027 AromaticContact CD2-CD2 3.85Å; F971-H1027 HydrophobicContact CE2-CB 4.4Å
972	Y	83.2	Confident	76.1	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.8	-175.8	-67.7	-27.4	0	0	0	111.8	T970 D983 V985 P987 I990 C995 A1000 F1021 E1024	T970-Y972 HydrophobicContact CG2-CD1 3.99Å; T970-Y972 HydrophobicContact CG2-CE1 3.42Å; T970-Y972 VanDerWaalsContact CG2-CE1 3.42Å; Y972-D983 CarbonylContact O-C 3.43Å; Y972-V985 PolarHBondContact N-O 3.04Å; Y972-V985 PolarHBondContact O-N 2.9Å; Y972-P987 HydrophobicContact CD2-CB 4.29Å; Y972-P987 HydrophobicContact CD2-CG 4.16Å; Y972-P987 HydrophobicContact CE1-CG 4.32Å; Y972-P987 VanDerWaalsContact CE2-CA 3.45Å; Y972-P987 HydrophobicContact CE2-CB 3.54Å; Y972-P987 HydrophobicContact CE2-CG 3.65Å; Y972-I990 HydrophobicContact CD2-CD1 3.42Å; Y972-I990 VanDerWaalsContact CD2-CD1 3.42Å; Y972-I990 HydrophobicContact CD2-CG1 4.36Å; Y972-I990 HydrophobicContact CE2-CD1 3.8Å; Y972-I990 HydrophobicContact CG-CD1 4.47Å; Y972-C995 HydrophobicContact CE2-CB 3.6Å; Y972-A1000 HydrophobicContact CD1-CB 4.48Å; Y972-A1000 HydrophobicContact CE1-CB 3.62Å; Y972-A1000 WeakPolarHBondContact OH-CA 3.4Å; Y972-A1000 PolarHBondContact OH-N 2.72Å; Y972-F1021 AromaticContact CD1-CE2 3.7Å; Y972-F1021 HydrophobicContact CD1-CE2 3.7Å; Y972-F1021 HydrophobicContact CD1-CZ 4.18Å; Y972-F1021 HydrophobicContact CD2-CE2 4.26Å; Y972-F1021 HydrophobicContact CE1-CE2 4.33Å; Y972-F1021 HydrophobicContact CG-CD2 4.47Å; Y972-F1021 AromaticContact CG-CE2 3.66Å; Y972-F1021 HydrophobicContact CG-CE2 3.66Å; Y972-E1024 HydrophobicContact CD1-CB 4.03Å; Y972-E1024 HydrophobicContact CD1-CG 4.11Å; Y972-E1024 HydrophobicContact CE1-CB 3.95Å; Y972-E1024 HydrophobicContact CE1-CG 3.78Å
973	E	86.9	Confident	75.9	Confident	11 Å²	11	53.5 Å²	53.5	5%	0.051	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.2	173.3	-164.2	167.3	105.2	0	0	109.1	Y981 C982 D983 V1022 R1023 H1025	E973-Y981 VanDerWaalsContact CD-OH 3.25Å; E973-Y981 HydrophobicContact CG-CD2 4.29Å; E973-Y981 HydrophobicContact CG-CE2 3.47Å; E973-Y981 VanDerWaalsContact CG-CE2 3.47Å; E973-Y981 PolarHBondContact OE2-OH 2.87Å; E973-Y981 VanDerWaalsContact OE2-OH 3.05Å; E973-C982 CarbonylContact C-O 3.53Å; E973-C982 VanDerWaalsContact CA-O 3.27Å; E973-C982 WeakPolarHBondContact CA-O 3.2Å; E973-D983 HydrophobicContact CB-CB 4.46Å; E973-D983 HydrophobicContact CG-CB 4.07Å; E973-V1022 HydrophobicContact CB-CB 4.06Å; E973-V1022 HydrophobicContact CG-CB 3.95Å; E973-V1022 HydrophobicContact CG-CG1 4.21Å; E973-V1022 WeakPolarHBondContact O-CA 3.36Å; E973-V1022 WeakPolarHBondContact O-CB 3.43Å; E973-V1022 PolarHBondContact O-N 3.24Å; E973-V1022 WeakPolarHBondContact OE1-CG1 3.24Å; E973-R1023 HydrophobicContact CB-CG 3.65Å; E973-R1023 WeakPolarHBondContact CB-O 3.34Å; E973-R1023 HydrophobicContact CG-CG 4.25Å; E973-R1023 PolarHBondContact N-O 2.85Å; E973-R1023 PolarHBondContact O-N 2.99Å; E973-R1023 IonicContact OE1-CZ 3.15Å; E973-R1023 IonicContact OE1-NE 2.89Å; E973-R1023 PolarHBondContact OE1-NE 3.08Å; E973-R1023 IonicContact OE1-NH2 2.66Å; E973-R1023 PolarHBondContact OE1-NH2 3.17Å; E973-R1023 IonicContact OE2-CZ 3.23Å; E973-R1023 IonicContact OE2-NE 3.68Å; E973-R1023 PolarHBondContact OE2-NE 3.36Å; E973-R1023 IonicContact OE2-NH2 2.69Å; E973-R1023 PolarHBondContact OE2-NH2 2.98Å; E973-H1025 IonicContact OE2-CE1 3.53Å; E973-H1025 PolarHBondContact OE2-CE1 2.73Å; E973-H1025 IonicContact OE2-NE2 2.75Å; E973-H1025 PolarHBondContact OE2-NE2 2.74Å
974	V	86.2	Confident	75.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.7	-178.2	-48.8	0	0	0	0	110.6	F976 Y981 C982 V985 I1007 A1019 S1020 F1021	V974-F976 HydrophobicContact CG2-CD2 4.12Å; V974-F976 HydrophobicContact CG2-CE2 3.53Å; V974-F976 HydrophobicContact CG2-CZ 3.75Å; V974-Y981 WeakPolarHBondContact O-CA 3.45Å; V974-C982 HydrophobicContact CG2-CB 4.34Å; V974-C982 PolarHBondContact N-O 3.06Å; V974-C982 PolarHBondContact O-N 2.89Å; V974-V985 HydrophobicContact CG1-CB 4.46Å; V974-V985 HydrophobicContact CG1-CG2 4.25Å; V974-V985 HydrophobicContact CG2-CG2 3.69Å; V974-I1007 HydrophobicContact CG1-CD1 3.97Å; V974-A1019 HydrophobicContact CB-CB 3.88Å; V974-A1019 HydrophobicContact CG2-CB 3.95Å; V974-S1020 WeakPolarHBondContact CA-O 3.44Å; V974-F1021 HydrophobicContact CG1-CD2 4.31Å
975	N	81.6	Confident	75.8	Confident	63 Å²	63	54.9 Å²	54.9	34%	0.337	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	108.5	169	-73.5	-38.1	0	0	0	108.4	S980 Y981 A1019 S1020 V1022	N975-S980 CarbonylContact C-O 3.57Å; N975-S980 WeakPolarHBondContact CA-O 3.3Å; N975-Y981 WeakPolarHBondContact OD1-CD2 3.39Å; N975-A1019 CarbonylContact O-C 3.49Å; N975-A1019 WeakPolarHBondContact O-CA 3.43Å; N975-S1020 PolarHBondContact N-O 2.88Å; N975-S1020 PolarHBondContact O-N 2.83Å; N975-S1020 PolarHBondContact O-OG 3.08Å; N975-S1020 VanDerWaalsContact O-OG 3.08Å; N975-V1022 HydrophobicContact CB-CG2 4.24Å; N975-V1022 WeakPolarHBondContact ND2-CG2 3.22Å
976	F	80.5	Confident	76.3	Confident	32 Å²	32	56.7 Å²	56.7	14%	0.14	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	150.8	174.9	-65.3	-87.8	0	0	0	110.8	V974 E978 G979 S980 C982 V1009 L1017 N1018 A1019	V974-F976 HydrophobicContact CG2-CD2 4.12Å; V974-F976 HydrophobicContact CG2-CE2 3.53Å; V974-F976 HydrophobicContact CG2-CZ 3.75Å; F976-E978 PolarHBondContact O-N 3.08Å; F976-E978 VanDerWaalsContact O-N 3.13Å; F976-G979 PolarHBondContact O-N 3.23Å; F976-S980 WeakPolarHBondContact CB-OG 3.37Å; F976-S980 WeakPolarHBondContact CD2-OG 3.49Å; F976-S980 PolarHBondContact N-O 3.44Å; F976-C982 HydrophobicContact CE2-CB 4.04Å; F976-V1009 HydrophobicContact CE1-CB 4.08Å; F976-V1009 HydrophobicContact CE1-CG2 4.25Å; F976-V1009 HydrophobicContact CZ-CB 4.39Å; F976-V1009 HydrophobicContact CZ-CG2 4.47Å; F976-L1017 HydrophobicContact CD1-CB 3.92Å; F976-L1017 HydrophobicContact CE1-CB 3.85Å; F976-L1017 HydrophobicContact CE1-CD1 4.39Å; F976-N1018 WeakPolarHBondContact CA-O 3.46Å; F976-A1019 HydrophobicContact CB-CB 4.44Å; F976-A1019 HydrophobicContact CD1-CB 3.69Å; F976-A1019 HydrophobicContact CE1-CB 3.96Å; F976-A1019 HydrophobicContact CG-CB 4.02Å
977	E	70	Confident	76.3	Confident	116 Å²	116	53.7 Å²	53.7	54%	0.542	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.6	-177.9	-67.4	-166.5	123	0	0	112.7	G979 L1006 N1018	E977-G979 PolarHBondContact O-N 3Å; E977-L1006 HydrophobicContact CG-CD2 3.97Å; E977-L1006 WeakPolarHBondContact OE1-CD2 3.4Å; E977-N1018 HydrophobicContact CB-CB 4.49Å; E977-N1018 HydrophobicContact CG-CB 3.81Å; E977-N1018 PolarHBondContact N-O 3.27Å; E977-N1018 WeakPolarHBondContact OE2-CB 3.39Å; E977-N1018 PolarHBondContact OE2-ND2 2.89Å
978	E	60.6	Low	76.9	Confident	174 Å²	174	56.9 Å²	56.9	81%	0.813	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	1.8	172.7	-54.8	-175.7	150.7	0	0	114.2	F976	F976-E978 PolarHBondContact O-N 3.08Å; F976-E978 VanDerWaalsContact O-N 3.13Å
979	G	54.4	Low	77.3	Confident	67 Å²	67	55.1 Å²	55.1	69%	0.691	29%	0.292	S	S	*	.	S	Bend	trans	85.7	6.3	176.4	0	0	0	0	0	115.6	F976 E977	F976-G979 PolarHBondContact O-N 3.23Å; E977-G979 PolarHBondContact O-N 3Å
980	S	65.6	Low	77.7	Confident	49 Å²	49	52.3 Å²	52.3	34%	0.343	28%	0.279	S	S	.	.			trans	-83.8	150.6	173.8	74	0	0	0	0	111.9	N975 F976	N975-S980 CarbonylContact C-O 3.57Å; N975-S980 WeakPolarHBondContact CA-O 3.3Å; F976-S980 WeakPolarHBondContact CB-OG 3.37Å; F976-S980 WeakPolarHBondContact CD2-OG 3.49Å; F976-S980 PolarHBondContact N-O 3.44Å
981	Y	79.4	Confident	77.9	Confident	114 Å²	114	54.8 Å²	54.8	45%	0.447	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.8	-175.1	163.4	-78.4	0	0	0	110.4	E973 V974 N975 D983	E973-Y981 VanDerWaalsContact CD-OH 3.25Å; E973-Y981 HydrophobicContact CG-CD2 4.29Å; E973-Y981 HydrophobicContact CG-CE2 3.47Å; E973-Y981 VanDerWaalsContact CG-CE2 3.47Å; E973-Y981 PolarHBondContact OE2-OH 2.87Å; E973-Y981 VanDerWaalsContact OE2-OH 3.05Å; V974-Y981 WeakPolarHBondContact O-CA 3.45Å; N975-Y981 WeakPolarHBondContact OD1-CD2 3.39Å; Y981-D983 HydrophobicContact CE1-CB 3.84Å; Y981-D983 WeakPolarHBondContact OH-CB 3.49Å; Y981-D983 PolarHBondContact OH-OD2 3.22Å
982	C	73.8	Confident	77.8	Confident	42 Å²	42	56.9 Å²	56.9	28%	0.284	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.3	172.1	-175.1	0	0	0	0	111	E973 V974 F976 V985	E973-C982 CarbonylContact C-O 3.53Å; E973-C982 VanDerWaalsContact CA-O 3.27Å; E973-C982 WeakPolarHBondContact CA-O 3.2Å; V974-C982 HydrophobicContact CG2-CB 4.34Å; V974-C982 PolarHBondContact N-O 3.06Å; V974-C982 PolarHBondContact O-N 2.89Å; F976-C982 HydrophobicContact CE2-CB 4.04Å; C982-V985 HydrophobicContact CB-CG2 4.03Å
983	D	83.3	Confident	77.2	Confident	62 Å²	62	58.5 Å²	58.5	33%	0.332	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	20.8	177.3	60.9	4.3	0	0	0	114.5	Y972 E973 Y981	Y972-D983 CarbonylContact O-C 3.43Å; E973-D983 HydrophobicContact CB-CB 4.46Å; E973-D983 HydrophobicContact CG-CB 4.07Å; Y981-D983 HydrophobicContact CE1-CB 3.84Å; Y981-D983 WeakPolarHBondContact OH-CB 3.49Å; Y981-D983 PolarHBondContact OH-OD2 3.22Å
984	N	82.3	Confident	76.5	Confident	77 Å²	77	61.2 Å²	61.2	41%	0.412	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	30.8	177.2	-53.2	-99.9	0	0	0	112.3	F971	F971-N984 HydrophobicContact CD1-CB 4.09Å
985	V	81.6	Confident	76.1	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.067	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	139.8	172.4	178.3	0	0	0	0	109.3	F971 Y972 V974 C982 N989 I990 V1009	F971-V985 CarbonylContact C-O 3.59Å; F971-V985 VanDerWaalsContact CA-O 3.31Å; F971-V985 WeakPolarHBondContact CA-O 3.1Å; Y972-V985 PolarHBondContact N-O 3.04Å; Y972-V985 PolarHBondContact O-N 2.9Å; V974-V985 HydrophobicContact CG1-CB 4.46Å; V974-V985 HydrophobicContact CG1-CG2 4.25Å; V974-V985 HydrophobicContact CG2-CG2 3.69Å; C982-V985 HydrophobicContact CB-CG2 4.03Å; V985-N989 HydrophobicContact CG1-CB 4.45Å; V985-I990 HydrophobicContact CG1-CG1 4.45Å; V985-V1009 HydrophobicContact CG1-CG1 3.68Å; V985-V1009 HydrophobicContact CG1-CG2 4.45Å
986	H	81.3	Confident	75.2	Confident	50 Å²	50	64.4 Å²	64.4	23%	0.231	35%	0.35	C	S	.	.			trans	-87.2	144.5	177.1	-84.2	-116.3	0	0	0	111.3	Q969 F971 E988 N989	Q969-H986 PolarHBondContact NE2-CE1 2.87Å; F971-H986 AromaticContact CE1-CD2 3.8Å; F971-H986 AromaticContact CE1-NE2 3.39Å; F971-H986 WeakPolarHBondContact CE1-NE2 3.43Å; H986-E988 VanDerWaalsContact C-N 3.26Å; H986-E988 HydrophobicContact CB-CG 3.92Å; H986-E988 IonicContact CE1-OE1 3.53Å; H986-E988 IonicContact CG-OE1 3.02Å; H986-E988 IonicContact ND1-OE1 2.72Å; H986-E988 PolarHBondContact ND1-OE1 3.11Å; H986-E988 IonicContact ND1-OE2 3.71Å; H986-E988 PolarHBondContact O-N 3.41Å; H986-N989 HydrophobicContact CB-CB 4.27Å; H986-N989 WeakPolarHBondContact O-CB 3.5Å; H986-N989 PolarHBondContact O-N 3.33Å
987	P	80.8	Confident	74.2	Confident	9 Å²	9	72.8 Å²	72.8	6%	0.058	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-56.9	-38.6	173.6	-24.4	32.5	0	0	0	113.7	T970 Y972 N989 I990 C995 L996	T970-P987 HydrophobicContact CG2-CG 3.73Å; T970-P987 VanDerWaalsContact O-CD 3.3Å; T970-P987 WeakPolarHBondContact O-CD 3.48Å; Y972-P987 HydrophobicContact CD2-CB 4.29Å; Y972-P987 HydrophobicContact CD2-CG 4.16Å; Y972-P987 HydrophobicContact CE1-CG 4.32Å; Y972-P987 VanDerWaalsContact CE2-CA 3.45Å; Y972-P987 HydrophobicContact CE2-CB 3.54Å; Y972-P987 HydrophobicContact CE2-CG 3.65Å; P987-N989 PolarHBondContact O-N 3.08Å; P987-I990 PolarHBondContact O-N 3.09Å; P987-C995 HydrophobicContact CB-CB 3.9Å; P987-L996 HydrophobicContact CB-CD2 4.05Å
988	E	78.1	Confident	73.9	Confident	103 Å²	103	72.8 Å²	72.8	48%	0.481	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-65.9	-9.9	174.5	57.8	-91.7	-150.2	0	0	114.5	H986 L996	H986-E988 VanDerWaalsContact C-N 3.26Å; H986-E988 HydrophobicContact CB-CG 3.92Å; H986-E988 IonicContact CE1-OE1 3.53Å; H986-E988 IonicContact CG-OE1 3.02Å; H986-E988 IonicContact ND1-OE1 2.72Å; H986-E988 PolarHBondContact ND1-OE1 3.11Å; H986-E988 IonicContact ND1-OE2 3.71Å; H986-E988 PolarHBondContact O-N 3.41Å; E988-L996 HydrophobicContact CB-CD1 4.08Å; E988-L996 HydrophobicContact CB-CG 4.48Å
989	N	81.1	Confident	73.9	Confident	53 Å²	53	65.9 Å²	65.9	28%	0.283	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-99.2	1.3	176.9	-67.4	25.2	0	0	0	113.2	V985 H986 P987 V1009 G1010	V985-N989 HydrophobicContact CG1-CB 4.45Å; H986-N989 HydrophobicContact CB-CB 4.27Å; H986-N989 WeakPolarHBondContact O-CB 3.5Å; H986-N989 PolarHBondContact O-N 3.33Å; P987-N989 PolarHBondContact O-N 3.08Å; N989-V1009 HydrophobicContact CB-CG1 4.48Å; N989-V1009 CarbonylContact O-C 3.47Å; N989-V1009 WeakPolarHBondContact O-CA 3.29Å; N989-G1010 PolarHBondContact O-N 2.82Å
990	I	83.4	Confident	75	Confident	11 Å²	11	64.5 Å²	64.5	6%	0.056	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-90.5	122.7	171.7	-59.7	179.4	0	0	0	108.5	Y972 V985 P987 H993 P1001 I1007	Y972-I990 HydrophobicContact CD2-CD1 3.42Å; Y972-I990 VanDerWaalsContact CD2-CD1 3.42Å; Y972-I990 HydrophobicContact CD2-CG1 4.36Å; Y972-I990 HydrophobicContact CE2-CD1 3.8Å; Y972-I990 HydrophobicContact CG-CD1 4.47Å; V985-I990 HydrophobicContact CG1-CG1 4.45Å; P987-I990 PolarHBondContact O-N 3.09Å; I990-H993 HydrophobicContact CG2-CB 3.84Å; I990-H993 WeakPolarHBondContact CG2-O 3.3Å; I990-P1001 HydrophobicContact CD1-CG 4.06Å; I990-I1007 HydrophobicContact CD1-CD1 3.52Å; I990-I1007 HydrophobicContact CG1-CD1 4.07Å; I990-I1007 HydrophobicContact CG2-CB 4.09Å; I990-I1007 HydrophobicContact CG2-CD1 4.27Å; I990-I1007 HydrophobicContact CG2-CG2 4.4Å
991	V	80.3	Confident	75.7	Confident	85 Å²	85	62.5 Å²	62.5	52%	0.515	33%	0.328	S	S	.	.	S	Bend	trans	-98.9	-33.2	-171.9	-176.4	0	0	0	0	111.6	H993 E1008	V991-H993 VanDerWaalsContact C-N 3.3Å; V991-H993 PolarHBondContact O-N 2.9Å; V991-E1008 PolarHBondContact N-O 3.37Å
992	S	79	Confident	75.7	Confident	62 Å²	62	63.2 Å²	63.2	43%	0.434	34%	0.34	S	S	.	.	S	Bend	trans	-76.2	-15.5	176.6	65.9	0	0	0	0	114.2	I1007 E1008	S992-I1007 VanDerWaalsContact OG-CA 3.23Å; S992-I1007 WeakPolarHBondContact OG-CA 3.47Å; S992-E1008 PolarHBondContact OG-N 2.92Å
993	H	71.8	Confident	75.6	Confident	37 Å²	37	65 Å²	65	17%	0.171	36%	0.357	C	S	.	.	S	Bend	trans	-143.3	115.8	-173.4	-162.9	127.5	0	0	0	108.7	I990 V991 C995 P1001 E1005	I990-H993 HydrophobicContact CG2-CB 3.84Å; I990-H993 WeakPolarHBondContact CG2-O 3.3Å; V991-H993 VanDerWaalsContact C-N 3.3Å; V991-H993 PolarHBondContact O-N 2.9Å; H993-C995 VanDerWaalsContact C-N 3.28Å; H993-C995 PolarHBondContact O-N 3.35Å; H993-C995 PolarHBondContact O-SG 3.38Å; H993-C995 VanDerWaalsContact O-SG 3.34Å; H993-P1001 HydrophobicContact CB-CG 4.42Å; H993-E1005 IonicContact CE1-OE1 3.09Å; H993-E1005 IonicContact ND1-OE1 3.32Å; H993-E1005 PolarHBondContact ND1-OE1 3.1Å
994	D	71.8	Confident	75	Confident	68 Å²	68	64.7 Å²	64.7	36%	0.364	37%	0.369	S	S	.	.			trans	-72.2	82	178.6	-178.1	-16.6	0	0	0	110.4	L996 R997 N998	D994-L996 PolarHBondContact O-N 3.41Å; D994-L996 PolarHBondContact OD1-N 2.68Å; D994-R997 PolarHBondContact O-N 2.95Å; D994-R997 PolarHBondContact OD1-N 2.94Å; D994-R997 VanDerWaalsContact OD1-N 3.14Å; D994-R997 VanDerWaalsContact OD2-CD 3.23Å; D994-R997 WeakPolarHBondContact OD2-CD 3.45Å; D994-N998 VanDerWaalsContact O-CB 3.31Å; D994-N998 WeakPolarHBondContact O-CB 3.41Å; D994-N998 PolarHBondContact O-N 2.93Å
995	C	76.9	Confident	74.8	Confident	7 Å²	7	64.2 Å²	64.2	5%	0.047	36%	0.364	C	S	.	.	H	α-helix	trans	-72.4	-15.2	-173.2	-67.7	0	0	0	0	114.3	Y972 P987 H993 R997 G999	Y972-C995 HydrophobicContact CE2-CB 3.6Å; P987-C995 HydrophobicContact CB-CB 3.9Å; H993-C995 VanDerWaalsContact C-N 3.28Å; H993-C995 PolarHBondContact O-N 3.35Å; H993-C995 PolarHBondContact O-SG 3.38Å; H993-C995 VanDerWaalsContact O-SG 3.34Å; C995-R997 VanDerWaalsContact C-N 3.32Å; C995-G999 WeakPolarHBondContact CA-O 3.49Å; C995-G999 VanDerWaalsContact CB-O 3.31Å; C995-G999 WeakPolarHBondContact CB-O 3.13Å; C995-G999 WeakPolarHBondContact O-CA 3.04Å; C995-G999 PolarHBondContact O-N 2.89Å; C995-G999 PolarHBondContact SG-O 3.39Å
996	L	64	Low	74.7	Confident	123 Å²	123	68.8 Å²	68.8	64%	0.644	39%	0.388	S	S	*	.	H	α-helix	trans	-73.5	-25.7	172.5	-65.1	179.8	0	0	0	112.2	P987 E988 D994	P987-L996 HydrophobicContact CB-CD2 4.05Å; E988-L996 HydrophobicContact CB-CD1 4.08Å; E988-L996 HydrophobicContact CB-CG 4.48Å; D994-L996 PolarHBondContact O-N 3.41Å; D994-L996 PolarHBondContact OD1-N 2.68Å
997	R	58	Low	74.8	Confident	208 Å²	208	66.5 Å²	66.5	79%	0.785	38%	0.377	S	S	*	.	H	α-helix	trans	-108.8	-35.9	-180	-63.9	-177.1	63.6	-154	-1.3	113.9	D994 C995	D994-R997 PolarHBondContact O-N 2.95Å; D994-R997 PolarHBondContact OD1-N 2.94Å; D994-R997 VanDerWaalsContact OD1-N 3.14Å; D994-R997 VanDerWaalsContact OD2-CD 3.23Å; D994-R997 WeakPolarHBondContact OD2-CD 3.45Å; C995-R997 VanDerWaalsContact C-N 3.32Å
998	N	64.4	Low	75	Confident	117 Å²	117	69.8 Å²	69.8	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-96.4	-20.4	-176.1	-58.5	-15.6	0	0	0	112.8	D994	D994-N998 VanDerWaalsContact O-CB 3.31Å; D994-N998 WeakPolarHBondContact O-CB 3.41Å; D994-N998 PolarHBondContact O-N 2.93Å
999	G	60.9	Low	75.4	Confident	28 Å²	28	65.3 Å²	65.3	29%	0.289	37%	0.371	S	S	.	.			trans	92.5	-165.4	-175.5	0	0	0	0	0	113.5	C995	C995-G999 WeakPolarHBondContact CA-O 3.49Å; C995-G999 VanDerWaalsContact CB-O 3.31Å; C995-G999 WeakPolarHBondContact CB-O 3.13Å; C995-G999 WeakPolarHBondContact O-CA 3.04Å; C995-G999 PolarHBondContact O-N 2.89Å; C995-G999 PolarHBondContact SG-O 3.39Å
1000	A	76.9	Confident	75.1	Confident	38 Å²	38	63.3 Å²	63.3	31%	0.314	36%	0.364	S	S	.	.	S	Bend	trans	-69.3	140.9	-178.9	0	0	0	0	0	111.9	Y972 F1021 E1024	Y972-A1000 HydrophobicContact CD1-CB 4.48Å; Y972-A1000 HydrophobicContact CE1-CB 3.62Å; Y972-A1000 WeakPolarHBondContact OH-CA 3.4Å; Y972-A1000 PolarHBondContact OH-N 2.72Å; A1000-F1021 HydrophobicContact CB-CE1 4.41Å; A1000-F1021 HydrophobicContact CB-CE2 4.47Å; A1000-F1021 HydrophobicContact CB-CZ 3.82Å; A1000-E1024 HydrophobicContact CB-CB 4.13Å
1001	P	81.4	Confident	74.5	Confident	7 Å²	7	64.7 Å²	64.7	5%	0.045	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-62.3	169.6	173.5	-19.8	33.3	0	0	0	112.7	I990 H993 E1005 I1007 F1021	I990-P1001 HydrophobicContact CD1-CG 4.06Å; H993-P1001 HydrophobicContact CB-CG 4.42Å; P1001-E1005 HydrophobicContact CB-CB 4.33Å; P1001-E1005 HydrophobicContact CB-CG 4.48Å; P1001-E1005 WeakPolarHBondContact CB-OE2 3.42Å; P1001-I1007 HydrophobicContact CB-CG2 3.97Å; P1001-I1007 HydrophobicContact CG-CD1 4.44Å; P1001-I1007 HydrophobicContact CG-CG2 3.92Å; P1001-F1021 HydrophobicContact CB-CB 3.94Å; P1001-F1021 HydrophobicContact CB-CD1 4.12Å; P1001-F1021 HydrophobicContact CB-CD2 4.34Å; P1001-F1021 HydrophobicContact CB-CG 3.88Å; P1001-F1021 HydrophobicContact CG-CB 4.36Å; P1001-F1021 HydrophobicContact CG-CD2 4.08Å; P1001-F1021 HydrophobicContact CG-CG 4.13Å; P1001-F1021 WeakPolarHBondContact O-CD1 3.45Å; P1001-F1021 WeakPolarHBondContact O-CE1 3.26Å
1002	D	77.9	Confident	73.4	Confident	130 Å²	130	66.4 Å²	66.4	70%	0.695	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-78.3	146.9	177.8	-116.8	-33.8	0	0	0	111.9	G1004 E1005	D1002-G1004 PolarHBondContact O-N 3.11Å; D1002-E1005 HydrophobicContact CB-CB 4.39Å; D1002-E1005 PolarHBondContact N-OE2 2.86Å; D1002-E1005 WeakPolarHBondContact O-CB 3.48Å; D1002-E1005 PolarHBondContact O-N 2.94Å
1003	A	72.3	Confident	72.5	Confident	79 Å²	79	70.7 Å²	70.7	65%	0.653	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	105.9	-174.6	0	0	0	0	0	111.8	F1021	A1003-F1021 CarbonylContact C-O 3.58Å
1004	G	71.3	Confident	71.7	Confident	56 Å²	56	72 Å²	72	58%	0.577	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.5	-3.8	-170.6	0	0	0	0	0	114.4	D1002 F1021	D1002-G1004 PolarHBondContact O-N 3.11Å; G1004-F1021 PolarHBondContact N-O 3.23Å
1005	E	78.1	Confident	71.4	Confident	67 Å²	67	75.4 Å²	75.4	31%	0.313	44%	0.44	S	S	.	.			trans	-67.6	131	175.3	-172.8	179.8	154	0	0	110.6	H993 P1001 D1002 I1007 S1020 F1021	H993-E1005 IonicContact CE1-OE1 3.09Å; H993-E1005 IonicContact ND1-OE1 3.32Å; H993-E1005 PolarHBondContact ND1-OE1 3.1Å; P1001-E1005 HydrophobicContact CB-CB 4.33Å; P1001-E1005 HydrophobicContact CB-CG 4.48Å; P1001-E1005 WeakPolarHBondContact CB-OE2 3.42Å; D1002-E1005 HydrophobicContact CB-CB 4.39Å; D1002-E1005 PolarHBondContact N-OE2 2.86Å; D1002-E1005 WeakPolarHBondContact O-CB 3.48Å; D1002-E1005 PolarHBondContact O-N 2.94Å; E1005-I1007 HydrophobicContact CG-CG2 4.22Å; E1005-S1020 CarbonylContact O-C 3.48Å; E1005-S1020 WeakPolarHBondContact O-CA 3.37Å; E1005-F1021 PolarHBondContact O-N 2.92Å
1006	L	78.3	Confident	71.7	Confident	106 Å²	106	78.6 Å²	78.6	56%	0.555	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	124.4	171.9	-72.8	171.6	0	0	0	109.6	E977 A1019	E977-L1006 HydrophobicContact CG-CD2 3.97Å; E977-L1006 WeakPolarHBondContact OE1-CD2 3.4Å; L1006-A1019 CarbonylContact C-O 3.57Å; L1006-A1019 WeakPolarHBondContact CA-O 3.31Å
1007	I	85	Confident	72.3	Confident	3 Å²	3	76 Å²	76	2%	0.015	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.3	-175.5	53	162.6	0	0	0	110.6	V974 I990 S992 P1001 E1005 V1009 A1019 F1021	V974-I1007 HydrophobicContact CG1-CD1 3.97Å; I990-I1007 HydrophobicContact CD1-CD1 3.52Å; I990-I1007 HydrophobicContact CG1-CD1 4.07Å; I990-I1007 HydrophobicContact CG2-CB 4.09Å; I990-I1007 HydrophobicContact CG2-CD1 4.27Å; I990-I1007 HydrophobicContact CG2-CG2 4.4Å; S992-I1007 VanDerWaalsContact OG-CA 3.23Å; S992-I1007 WeakPolarHBondContact OG-CA 3.47Å; P1001-I1007 HydrophobicContact CB-CG2 3.97Å; P1001-I1007 HydrophobicContact CG-CD1 4.44Å; P1001-I1007 HydrophobicContact CG-CG2 3.92Å; E1005-I1007 HydrophobicContact CG-CG2 4.22Å; I1007-V1009 HydrophobicContact CD1-CG2 4.05Å; I1007-V1009 HydrophobicContact CG1-CG2 4.43Å; I1007-A1019 HydrophobicContact CG1-CB 4.49Å; I1007-A1019 WeakPolarHBondContact CG1-O 3.48Å; I1007-A1019 PolarHBondContact N-O 2.93Å; I1007-A1019 PolarHBondContact O-N 2.79Å; I1007-F1021 HydrophobicContact CD1-CB 3.96Å; I1007-F1021 HydrophobicContact CD1-CD2 4.38Å; I1007-F1021 HydrophobicContact CG1-CB 4.36Å
1008	E	83.2	Confident	73.5	Confident	77 Å²	77	69.9 Å²	69.9	36%	0.36	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	119.4	168.7	-69.8	179	-147.8	0	0	109.3	V991 S992 N1016	V991-E1008 PolarHBondContact N-O 3.37Å; S992-E1008 PolarHBondContact OG-N 2.92Å; E1008-N1016 HydrophobicContact CB-CB 4.32Å; E1008-N1016 PolarHBondContact OE2-ND2 2.85Å
1009	V	86.5	Confident	74.4	Confident	9 Å²	9	64.3 Å²	64.3	6%	0.055	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117	173.1	-174.6	0	0	0	0	108.5	F976 V985 N989 I1007 L1017 A1019	F976-V1009 HydrophobicContact CE1-CB 4.08Å; F976-V1009 HydrophobicContact CE1-CG2 4.25Å; F976-V1009 HydrophobicContact CZ-CB 4.39Å; F976-V1009 HydrophobicContact CZ-CG2 4.47Å; V985-V1009 HydrophobicContact CG1-CG1 3.68Å; V985-V1009 HydrophobicContact CG1-CG2 4.45Å; N989-V1009 HydrophobicContact CB-CG1 4.48Å; N989-V1009 CarbonylContact O-C 3.47Å; N989-V1009 WeakPolarHBondContact O-CA 3.29Å; I1007-V1009 HydrophobicContact CD1-CG2 4.05Å; I1007-V1009 HydrophobicContact CG1-CG2 4.43Å; V1009-L1017 PolarHBondContact N-O 3.14Å; V1009-L1017 PolarHBondContact O-N 2.95Å; V1009-A1019 HydrophobicContact CG2-CB 4.17Å
1010	G	76.3	Confident	75.6	Confident	12 Å²	12	64.6 Å²	64.6	12%	0.124	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.5	173.5	0	0	0	0	0	111	N989	N989-G1010 PolarHBondContact O-N 2.82Å
1011	T	71.3	Confident	76	Confident	40 Å²	40	63.1 Å²	63.1	25%	0.245	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-77	154	171.5	59.7	0	0	0	0	110.9	D1013 G1014 E1015 L1017	T1011-D1013 PolarHBondContact O-N 3.15Å; T1011-D1013 VanDerWaalsContact O-N 3.13Å; T1011-G1014 PolarHBondContact O-N 2.86Å; T1011-E1015 WeakPolarHBondContact CB-O 3.38Å; T1011-E1015 WeakPolarHBondContact CG2-O 3.2Å; T1011-E1015 PolarHBondContact N-O 3.48Å; T1011-E1015 PolarHBondContact OG1-N 3.12Å; T1011-E1015 PolarHBondContact OG1-O 2.89Å; T1011-L1017 HydrophobicContact CG2-CD1 3.73Å; T1011-L1017 HydrophobicContact CG2-CG 4.2Å
1012	P	56.3	Low	76.1	Confident	120 Å²	120	64.9 Å²	64.9	78%	0.779	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.6	175.8	-24.2	35.5	0	0	0	114.5
1013	D	60.6	Low	76	Confident	152 Å²	152	64 Å²	64	81%	0.813	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.9	178.9	-59.3	-73.3	0	0	0	113	T1011	T1011-D1013 PolarHBondContact O-N 3.15Å; T1011-D1013 VanDerWaalsContact O-N 3.13Å
1014	G	55.1	Low	76.3	Confident	64 Å²	64	64.6 Å²	64.6	66%	0.66	37%	0.367	S	S	*	.	S	Bend	trans	105.1	5.8	169.1	0	0	0	0	0	116.3	T1011	T1011-G1014 PolarHBondContact O-N 2.86Å
1015	E	65.3	Low	76.5	Confident	140 Å²	140	63.9 Å²	63.9	65%	0.654	35%	0.349	S	S	*	.			trans	-99.5	136.4	179.5	-60.4	-177.4	158.6	0	0	111.3	T1011	T1011-E1015 WeakPolarHBondContact CB-O 3.38Å; T1011-E1015 WeakPolarHBondContact CG2-O 3.2Å; T1011-E1015 PolarHBondContact N-O 3.48Å; T1011-E1015 PolarHBondContact OG1-N 3.12Å; T1011-E1015 PolarHBondContact OG1-O 2.89Å
1016	N	81.8	Confident	76.3	Confident	74 Å²	74	64.3 Å²	64.3	40%	0.396	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.8	176.4	-74.4	11.4	0	0	0	110.6	E1008	E1008-N1016 HydrophobicContact CB-CB 4.32Å; E1008-N1016 PolarHBondContact OE2-ND2 2.85Å
1017	L	77.9	Confident	76	Confident	69 Å²	69	62.6 Å²	62.6	36%	0.361	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.4	180	-62.3	176.3	0	0	0	111.6	F976 V1009 T1011	F976-L1017 HydrophobicContact CD1-CB 3.92Å; F976-L1017 HydrophobicContact CE1-CB 3.85Å; F976-L1017 HydrophobicContact CE1-CD1 4.39Å; V1009-L1017 PolarHBondContact N-O 3.14Å; V1009-L1017 PolarHBondContact O-N 2.95Å; T1011-L1017 HydrophobicContact CG2-CD1 3.73Å; T1011-L1017 HydrophobicContact CG2-CG 4.2Å
1018	N	83.2	Confident	75.5	Confident	80 Å²	80	67.7 Å²	67.7	43%	0.428	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130	177.9	-68.6	-2.9	0	0	0	111.8	F976 E977	F976-N1018 WeakPolarHBondContact CA-O 3.46Å; E977-N1018 HydrophobicContact CB-CB 4.49Å; E977-N1018 HydrophobicContact CG-CB 3.81Å; E977-N1018 PolarHBondContact N-O 3.27Å; E977-N1018 WeakPolarHBondContact OE2-CB 3.39Å; E977-N1018 PolarHBondContact OE2-ND2 2.89Å
1019	A	82.9	Confident	75.3	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.9	172.1	0	0	0	0	0	112.5	V974 N975 F976 L1006 I1007 V1009	V974-A1019 HydrophobicContact CB-CB 3.88Å; V974-A1019 HydrophobicContact CG2-CB 3.95Å; N975-A1019 CarbonylContact O-C 3.49Å; N975-A1019 WeakPolarHBondContact O-CA 3.43Å; F976-A1019 HydrophobicContact CB-CB 4.44Å; F976-A1019 HydrophobicContact CD1-CB 3.69Å; F976-A1019 HydrophobicContact CE1-CB 3.96Å; F976-A1019 HydrophobicContact CG-CB 4.02Å; L1006-A1019 CarbonylContact C-O 3.57Å; L1006-A1019 WeakPolarHBondContact CA-O 3.31Å; I1007-A1019 HydrophobicContact CG1-CB 4.49Å; I1007-A1019 WeakPolarHBondContact CG1-O 3.48Å; I1007-A1019 PolarHBondContact N-O 2.93Å; I1007-A1019 PolarHBondContact O-N 2.79Å; V1009-A1019 HydrophobicContact CG2-CB 4.17Å
1020	S	85.9	Confident	75	Confident	33 Å²	33	65 Å²	65	23%	0.231	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.4	164	57.2	0	0	0	0	110	V974 N975 E1005	V974-S1020 WeakPolarHBondContact CA-O 3.44Å; N975-S1020 PolarHBondContact N-O 2.88Å; N975-S1020 PolarHBondContact O-N 2.83Å; N975-S1020 PolarHBondContact O-OG 3.08Å; N975-S1020 VanDerWaalsContact O-OG 3.08Å; E1005-S1020 CarbonylContact O-C 3.48Å; E1005-S1020 WeakPolarHBondContact O-CA 3.37Å
1021	F	85.5	Confident	75.3	Confident	8 Å²	8	67.7 Å²	67.7	4%	0.035	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	139.2	174.7	178.3	-96.6	0	0	0	111	Y972 V974 A1000 P1001 A1003 G1004 E1005 I1007 R1023 E1024	Y972-F1021 AromaticContact CD1-CE2 3.7Å; Y972-F1021 HydrophobicContact CD1-CE2 3.7Å; Y972-F1021 HydrophobicContact CD1-CZ 4.18Å; Y972-F1021 HydrophobicContact CD2-CE2 4.26Å; Y972-F1021 HydrophobicContact CE1-CE2 4.33Å; Y972-F1021 HydrophobicContact CG-CD2 4.47Å; Y972-F1021 AromaticContact CG-CE2 3.66Å; Y972-F1021 HydrophobicContact CG-CE2 3.66Å; V974-F1021 HydrophobicContact CG1-CD2 4.31Å; A1000-F1021 HydrophobicContact CB-CE1 4.41Å; A1000-F1021 HydrophobicContact CB-CE2 4.47Å; A1000-F1021 HydrophobicContact CB-CZ 3.82Å; P1001-F1021 HydrophobicContact CB-CB 3.94Å; P1001-F1021 HydrophobicContact CB-CD1 4.12Å; P1001-F1021 HydrophobicContact CB-CD2 4.34Å; P1001-F1021 HydrophobicContact CB-CG 3.88Å; P1001-F1021 HydrophobicContact CG-CB 4.36Å; P1001-F1021 HydrophobicContact CG-CD2 4.08Å; P1001-F1021 HydrophobicContact CG-CG 4.13Å; P1001-F1021 WeakPolarHBondContact O-CD1 3.45Å; P1001-F1021 WeakPolarHBondContact O-CE1 3.26Å; A1003-F1021 CarbonylContact C-O 3.58Å; G1004-F1021 PolarHBondContact N-O 3.23Å; E1005-F1021 PolarHBondContact O-N 2.92Å; I1007-F1021 HydrophobicContact CD1-CB 3.96Å; I1007-F1021 HydrophobicContact CD1-CD2 4.38Å; I1007-F1021 HydrophobicContact CG1-CB 4.36Å; F1021-R1023 WeakPolarHBondContact CE2-O 3.17Å; F1021-R1023 WeakPolarHBondContact CZ-O 3.34Å; F1021-E1024 HydrophobicContact CZ-CB 4.4Å
1022	V	84.3	Confident	76	Confident	44 Å²	44	65.8 Å²	65.8	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-50.9	-175.2	-174.4	0	0	0	0	111.9	E973 N975	E973-V1022 HydrophobicContact CB-CB 4.06Å; E973-V1022 HydrophobicContact CG-CB 3.95Å; E973-V1022 HydrophobicContact CG-CG1 4.21Å; E973-V1022 WeakPolarHBondContact O-CA 3.36Å; E973-V1022 WeakPolarHBondContact O-CB 3.43Å; E973-V1022 PolarHBondContact O-N 3.24Å; E973-V1022 WeakPolarHBondContact OE1-CG1 3.24Å; N975-V1022 HydrophobicContact CB-CG2 4.24Å; N975-V1022 WeakPolarHBondContact ND2-CG2 3.22Å
1023	R	74.8	Confident	77.4	Confident	110 Å²	110	63.1 Å²	63.1	42%	0.415	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	168.7	176.7	60.8	171.8	177.8	-151	-12.7	113.7	E973 F1021 H1025	E973-R1023 HydrophobicContact CB-CG 3.65Å; E973-R1023 WeakPolarHBondContact CB-O 3.34Å; E973-R1023 HydrophobicContact CG-CG 4.25Å; E973-R1023 PolarHBondContact N-O 2.85Å; E973-R1023 PolarHBondContact O-N 2.99Å; E973-R1023 IonicContact OE1-CZ 3.15Å; E973-R1023 IonicContact OE1-NE 2.89Å; E973-R1023 PolarHBondContact OE1-NE 3.08Å; E973-R1023 IonicContact OE1-NH2 2.66Å; E973-R1023 PolarHBondContact OE1-NH2 3.17Å; E973-R1023 IonicContact OE2-CZ 3.23Å; E973-R1023 IonicContact OE2-NE 3.68Å; E973-R1023 PolarHBondContact OE2-NE 3.36Å; E973-R1023 IonicContact OE2-NH2 2.69Å; E973-R1023 PolarHBondContact OE2-NH2 2.98Å; F1021-R1023 WeakPolarHBondContact CE2-O 3.17Å; F1021-R1023 WeakPolarHBondContact CZ-O 3.34Å; R1023-H1025 PolarHBondContact NE-NE2 3Å
1024	E	79.6	Confident	78.5	Confident	92 Å²	92	56.2 Å²	56.2	43%	0.43	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	140.8	171.8	176.2	-179.2	-113.5	0	0	113.2	T970 Y972 A1000 F1021 V1026	T970-E1024 HydrophobicContact CG2-CG 3.75Å; T970-E1024 VanDerWaalsContact CG2-OE1 3.29Å; T970-E1024 WeakPolarHBondContact CG2-OE1 3.43Å; Y972-E1024 HydrophobicContact CD1-CB 4.03Å; Y972-E1024 HydrophobicContact CD1-CG 4.11Å; Y972-E1024 HydrophobicContact CE1-CB 3.95Å; Y972-E1024 HydrophobicContact CE1-CG 3.78Å; A1000-E1024 HydrophobicContact CB-CB 4.13Å; F1021-E1024 HydrophobicContact CZ-CB 4.4Å; E1024-V1026 HydrophobicContact CG-CG2 4.01Å
1025	H	74.7	Confident	79.4	Confident	42 Å²	42	59.9 Å²	59.9	19%	0.194	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	106.6	165.4	-48.7	87.3	0	0	0	111.3	F971 E973 R1023 H1027	F971-H1025 PolarHBondContact N-O 3.03Å; F971-H1025 PolarHBondContact O-N 2.99Å; E973-H1025 IonicContact OE2-CE1 3.53Å; E973-H1025 PolarHBondContact OE2-CE1 2.73Å; E973-H1025 IonicContact OE2-NE2 2.75Å; E973-H1025 PolarHBondContact OE2-NE2 2.74Å; R1023-H1025 PolarHBondContact NE-NE2 3Å; H1025-H1027 PolarHBondContact O-N 2.95Å
1026	V	75	Confident	79.8	Confident	75 Å²	75	57.8 Å²	57.8	46%	0.455	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	103.1	170	-173.1	0	0	0	0	110.1	T968 E1024	T968-V1026 HydrophobicContact CG2-CG1 3.91Å; E1024-V1026 HydrophobicContact CG-CG2 4.01Å
1027	H	71.8	Confident	79.2	Confident	70 Å²	70	62 Å²	62	32%	0.324	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.5	177.1	-84.4	-72.1	0	0	0	111.8	Q969 F971 H1025	Q969-H1027 PolarHBondContact N-O 2.68Å; Q969-H1027 PolarHBondContact O-N 2.86Å; F971-H1027 HydrophobicContact CD2-CB 4.31Å; F971-H1027 AromaticContact CD2-CD2 3.85Å; F971-H1027 HydrophobicContact CE2-CB 4.4Å; H1025-H1027 PolarHBondContact O-N 2.95Å
1028	K	72.9	Confident	79.1	Confident	110 Å²	110	60.6 Å²	60.6	48%	0.478	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.3	168.6	-70.3	-167.7	175.1	-165.7	0	110.9	T968 Y1030	T968-K1028 HydrophobicContact CG2-CG 4.01Å; K1028-Y1030 HydrophobicContact CB-CE2 3.93Å
1029	L	78.8	Confident	79	Confident	20 Å²	20	61.4 Å²	61.4	11%	0.105	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	146.5	169	-65.5	169.2	0	0	0	109	A967 Q969 M1041 L1042 K1043	A967-L1029 HydrophobicContact CB-CB 4.49Å; A967-L1029 PolarHBondContact N-O 2.75Å; A967-L1029 PolarHBondContact O-N 2.81Å; Q969-L1029 HydrophobicContact CB-CD1 3.98Å; L1029-M1041 HydrophobicContact CB-CE 3.9Å; L1029-M1041 HydrophobicContact CD1-CE 4.49Å; L1029-L1042 WeakPolarHBondContact CA-O 3.21Å; L1029-K1043 HydrophobicContact CD2-CB 4.48Å; L1029-K1043 HydrophobicContact CD2-CG 3.58Å
1030	Y	82.1	Confident	79	Confident	10 Å²	10	64.4 Å²	64.4	4%	0.039	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.4	179	-61.2	-94.6	0	0	0	108.2	L943 I963 G965 I966 K1028 V1032 L1042 Q1044 I1047	L943-Y1030 HydrophobicContact CB-CD1 4.18Å; L943-Y1030 HydrophobicContact CB-CE1 3.46Å; L943-Y1030 VanDerWaalsContact CB-CE1 3.46Å; L943-Y1030 HydrophobicContact CD1-CE1 4.16Å; L943-Y1030 HydrophobicContact CD1-CE2 4.18Å; L943-Y1030 HydrophobicContact CG-CE1 4.47Å; L943-Y1030 WeakPolarHBondContact O-CE1 3.11Å; I963-Y1030 HydrophobicContact CD1-CD1 4Å; I963-Y1030 HydrophobicContact CG2-CD1 3.93Å; G965-Y1030 CarbonylContact O-C 3.59Å; G965-Y1030 WeakPolarHBondContact O-CA 3.29Å; I966-Y1030 HydrophobicContact CB-CD1 4.48Å; I966-Y1030 HydrophobicContact CD1-CE1 4.29Å; I966-Y1030 HydrophobicContact CG1-CD1 3.87Å; I966-Y1030 HydrophobicContact CG1-CE1 4Å; I966-Y1030 HydrophobicContact CG2-CD1 4.2Å; I966-Y1030 HydrophobicContact CG2-CE1 3.92Å; K1028-Y1030 HydrophobicContact CB-CE2 3.93Å; Y1030-V1032 PolarHBondContact O-N 3.08Å; Y1030-L1042 PolarHBondContact N-O 2.78Å; Y1030-L1042 PolarHBondContact O-N 3.48Å; Y1030-Q1044 HydrophobicContact CE2-CB 3.9Å; Y1030-Q1044 HydrophobicContact CE2-CG 4.04Å; Y1030-I1047 VanDerWaalsContact CB-CD1 3.49Å; Y1030-I1047 HydrophobicContact CD2-CD1 3.61Å; Y1030-I1047 HydrophobicContact CG-CD1 3.69Å
1031	Q	81.9	Confident	78.7	Confident	69 Å²	69	67 Å²	67	32%	0.322	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114.2	167.7	-166.5	-179.9	-12.5	0	0	106.6	I964 G965 L1040 M1041	I964-Q1031 HydrophobicContact CD1-CG 3.85Å; I964-Q1031 HydrophobicContact CG1-CB 4.16Å; I964-Q1031 HydrophobicContact CG1-CG 3.88Å; I964-Q1031 VanDerWaalsContact CG1-O 3.29Å; I964-Q1031 WeakPolarHBondContact CG1-O 3.28Å; I964-Q1031 PolarHBondContact N-O 2.62Å; G965-Q1031 PolarHBondContact N-O 2.79Å; G965-Q1031 VanDerWaalsContact N-O 3.15Å; G965-Q1031 PolarHBondContact O-N 2.72Å; Q1031-L1040 WeakPolarHBondContact CA-O 3.2Å; Q1031-M1041 VanDerWaalsContact CA-SD 3.6Å; Q1031-M1041 HydrophobicContact CB-SD 3.51Å; Q1031-M1041 VanDerWaalsContact CB-SD 3.51Å; Q1031-M1041 HydrophobicContact CG-SD 3.85Å
1032	V	86.4	Confident	78.4	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.6	178.1	-58.7	0	0	0	0	110.6	C961 T962 I963 Y1030 F1034 Q1039 L1040 L1042 I1047	C961-V1032 HydrophobicContact CB-CB 4.04Å; C961-V1032 HydrophobicContact CB-CG2 4.29Å; T962-V1032 CarbonylContact O-C 3.55Å; T962-V1032 VanDerWaalsContact O-CA 3.28Å; T962-V1032 WeakPolarHBondContact O-CA 3.46Å; I963-V1032 HydrophobicContact CG1-CG1 4.19Å; Y1030-V1032 PolarHBondContact O-N 3.08Å; V1032-F1034 HydrophobicContact CG2-CE2 3.95Å; V1032-F1034 HydrophobicContact CG2-CZ 3.96Å; V1032-Q1039 CarbonylContact O-C 3.34Å; V1032-Q1039 VanDerWaalsContact O-CA 3.29Å; V1032-Q1039 WeakPolarHBondContact O-CA 3.47Å; V1032-L1040 HydrophobicContact CG2-CB 4.46Å; V1032-L1040 PolarHBondContact N-O 3.37Å; V1032-L1040 PolarHBondContact O-N 2.93Å; V1032-L1042 HydrophobicContact CG2-CD1 3.72Å; V1032-L1042 HydrophobicContact CG2-CG 4.06Å; V1032-I1047 HydrophobicContact CG1-CD1 4.31Å
1033	E	84.8	Confident	78.3	Confident	63 Å²	63	68.6 Å²	68.6	29%	0.294	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.2	173.8	-174.5	170.5	-94.7	0	0	109.8	C961 T962 I964 Q1039	C961-E1033 CarbonylContact C-O 3.52Å; C961-E1033 WeakPolarHBondContact CA-O 3.45Å; C961-E1033 WeakPolarHBondContact CB-O 3.38Å; T962-E1033 PolarHBondContact N-O 2.89Å; T962-E1033 PolarHBondContact O-N 2.98Å; I964-E1033 HydrophobicContact CD1-CB 3.97Å; I964-E1033 HydrophobicContact CG1-CB 4.16Å; I964-E1033 HydrophobicContact CG2-CB 3.77Å; E1033-Q1039 HydrophobicContact CB-CG 4.17Å; E1033-Q1039 HydrophobicContact CG-CG 4.08Å; E1033-Q1039 PolarHBondContact OE1-NE2 2.77Å
1034	F	84.2	Confident	78.5	Confident	7 Å²	7	68.6 Å²	68.6	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	164.7	176.6	-67.1	-77.7	0	0	0	111.5	K953 C961 V1032 D1036 Q1037 S1038 L1040 L1042	K953-F1034 HydrophobicContact CB-CE1 4.24Å; K953-F1034 HydrophobicContact CB-CE2 4.36Å; K953-F1034 HydrophobicContact CB-CZ 4.03Å; K953-F1034 HydrophobicContact CD-CD1 4.46Å; K953-F1034 HydrophobicContact CD-CD2 4.24Å; K953-F1034 HydrophobicContact CD-CE2 4.49Å; K953-F1034 HydrophobicContact CD-CG 4.23Å; K953-F1034 HydrophobicContact CG-CD2 4.41Å; K953-F1034 HydrophobicContact CG-CE2 4.2Å; K953-F1034 HydrophobicContact CG-CZ 4.36Å; C961-F1034 HydrophobicContact CB-CD1 3.57Å; C961-F1034 HydrophobicContact CB-CE1 3.8Å; C961-F1034 HydrophobicContact CB-CG 4.1Å; C961-F1034 HydrophobicContact CB-CZ 4.5Å; V1032-F1034 HydrophobicContact CG2-CE2 3.95Å; V1032-F1034 HydrophobicContact CG2-CZ 3.96Å; F1034-D1036 WeakPolarHBondContact CB-OD1 3.07Å; F1034-D1036 PolarHBondContact O-N 3.42Å; F1034-Q1037 PolarHBondContact O-N 2.66Å; F1034-S1038 WeakPolarHBondContact CD2-O 3.35Å; F1034-S1038 PolarHBondContact N-O 3Å; F1034-L1040 HydrophobicContact CE2-CB 3.87Å; F1034-L1040 HydrophobicContact CE2-CD2 4.14Å; F1034-L1042 HydrophobicContact CZ-CD1 4.48Å
1035	Q	73.2	Confident	78.2	Confident	141 Å²	141	68.8 Å²	68.8	66%	0.659	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-16.9	-178.8	-71.1	178.6	-28.4	0	0	115.1
1036	D	74.1	Confident	78.5	Confident	96 Å²	96	69.4 Å²	69.4	51%	0.513	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	21.9	174.6	70.5	-38.3	0	0	0	113.4	K953 F1034 S1038	K953-D1036 IonicContact NZ-OD1 3.32Å; K953-D1036 PolarHBondContact NZ-OD1 3.34Å; K953-D1036 IonicContact NZ-OD2 2.69Å; K953-D1036 PolarHBondContact NZ-OD2 3.11Å; F1034-D1036 WeakPolarHBondContact CB-OD1 3.07Å; F1034-D1036 PolarHBondContact O-N 3.42Å; D1036-S1038 PolarHBondContact O-N 2.87Å; D1036-S1038 PolarHBondContact OD1-OG 3.28Å; D1036-S1038 PolarHBondContact OD2-OG 3Å
1037	Q	68.6	Low	78.8	Confident	164 Å²	164	66.4 Å²	66.4	77%	0.766	33%	0.328	S	S	*	.	S	Bend	trans	61.7	5.5	-177.8	-56.4	174.6	-3.8	0	0	114.6	F1034	F1034-Q1037 PolarHBondContact O-N 2.66Å
1038	S	75.9	Confident	79.3	Confident	38 Å²	38	65.3 Å²	65.3	27%	0.266	32%	0.323	S	S	.	.			trans	-72.1	130.6	172.8	65.6	0	0	0	0	110.5	K953 F1034 D1036	K953-S1038 VanDerWaalsContact CE-OG 3.26Å; K953-S1038 WeakPolarHBondContact CE-OG 3.4Å; K953-S1038 PolarHBondContact NZ-OG 2.95Å; K953-S1038 VanDerWaalsContact NZ-OG 3.08Å; F1034-S1038 WeakPolarHBondContact CD2-O 3.35Å; F1034-S1038 PolarHBondContact N-O 3Å; D1036-S1038 PolarHBondContact O-N 2.87Å; D1036-S1038 PolarHBondContact OD1-OG 3.28Å; D1036-S1038 PolarHBondContact OD2-OG 3Å
1039	Q	82.7	Confident	79.6	Confident	98 Å²	98	62.9 Å²	62.9	46%	0.458	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.8	-179.1	-61.2	-175.3	3.9	0	0	111.1	I964 V1032 E1033	I964-Q1039 HydrophobicContact CD1-CB 4.46Å; I964-Q1039 HydrophobicContact CD1-CG 3.78Å; I964-Q1039 VanDerWaalsContact CD1-NE2 3.33Å; V1032-Q1039 CarbonylContact O-C 3.34Å; V1032-Q1039 VanDerWaalsContact O-CA 3.29Å; V1032-Q1039 WeakPolarHBondContact O-CA 3.47Å; E1033-Q1039 HydrophobicContact CB-CG 4.17Å; E1033-Q1039 HydrophobicContact CG-CG 4.08Å; E1033-Q1039 PolarHBondContact OE1-NE2 2.77Å
1040	L	82.1	Confident	79.3	Confident	62 Å²	62	66.1 Å²	66.1	33%	0.325	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	144.3	-176.9	-163.7	71.1	0	0	0	111.7	Q1031 V1032 F1034 L1042	Q1031-L1040 WeakPolarHBondContact CA-O 3.2Å; V1032-L1040 HydrophobicContact CG2-CB 4.46Å; V1032-L1040 PolarHBondContact N-O 3.37Å; V1032-L1040 PolarHBondContact O-N 2.93Å; F1034-L1040 HydrophobicContact CE2-CB 3.87Å; F1034-L1040 HydrophobicContact CE2-CD2 4.14Å; L1040-L1042 HydrophobicContact CD2-CD2 3.86Å; L1040-L1042 HydrophobicContact CD2-CG 4.32Å
1041	M	79.3	Confident	78.1	Confident	89 Å²	89	71.5 Å²	71.5	44%	0.438	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	122.1	169.6	-61.8	-59.7	-84	0	0	110.2	A967 L1029 Q1031	A967-M1041 HydrophobicContact CB-CE 3.7Å; L1029-M1041 HydrophobicContact CB-CE 3.9Å; L1029-M1041 HydrophobicContact CD1-CE 4.49Å; Q1031-M1041 VanDerWaalsContact CA-SD 3.6Å; Q1031-M1041 HydrophobicContact CB-SD 3.51Å; Q1031-M1041 VanDerWaalsContact CB-SD 3.51Å; Q1031-M1041 HydrophobicContact CG-SD 3.85Å
1042	L	80.1	Confident	77.5	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.031	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.2	177.8	-72.7	-176.1	0	0	0	112.4	L1029 Y1030 V1032 F1034 L1040 E1046 I1047	L1029-L1042 WeakPolarHBondContact CA-O 3.21Å; Y1030-L1042 PolarHBondContact N-O 2.78Å; Y1030-L1042 PolarHBondContact O-N 3.48Å; V1032-L1042 HydrophobicContact CG2-CD1 3.72Å; V1032-L1042 HydrophobicContact CG2-CG 4.06Å; F1034-L1042 HydrophobicContact CZ-CD1 4.48Å; L1040-L1042 HydrophobicContact CD2-CD2 3.86Å; L1040-L1042 HydrophobicContact CD2-CG 4.32Å; L1042-E1046 HydrophobicContact CD2-CB 4.26Å; L1042-I1047 HydrophobicContact CB-CD1 3.82Å; L1042-I1047 HydrophobicContact CB-CG1 3.82Å; L1042-I1047 HydrophobicContact CD1-CG1 3.99Å
1043	K	80.9	Confident	76.2	Confident	79 Å²	79	81.6 Å²	81.6	34%	0.343	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	149.8	168.3	-67.8	-170.7	178.3	-161.5	0	109.6	L1029 S1045 E1046	L1029-K1043 HydrophobicContact CD2-CB 4.48Å; L1029-K1043 HydrophobicContact CD2-CG 3.58Å; K1043-S1045 PolarHBondContact O-N 2.84Å; K1043-E1046 PolarHBondContact O-N 2.86Å
1044	Q	79.4	Confident	75.7	Confident	110 Å²	110	79.7 Å²	79.7	51%	0.514	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-52.5	-29.7	-179.1	-163.1	175.5	1.8	0	0	114.1	L943 Y1030 E1046 I1047	L943-Q1044 HydrophobicContact CD1-CG 3.95Å; Y1030-Q1044 HydrophobicContact CE2-CB 3.9Å; Y1030-Q1044 HydrophobicContact CE2-CG 4.04Å; Q1044-E1046 PolarHBondContact O-N 2.83Å; Q1044-I1047 PolarHBondContact O-N 3.25Å
1045	S	74.4	Confident	75.3	Confident	96 Å²	96	82.2 Å²	82.2	67%	0.671	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-71.6	-9	177.1	49.5	0	0	0	0	115.3	K1043	K1043-S1045 PolarHBondContact O-N 2.84Å
1046	E	80.7	Confident	75	Confident	55 Å²	55	84 Å²	84	26%	0.257	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-110.1	8.4	179.9	-58	-164.9	101.8	0	0	113	R952 L1042 K1043 Q1044	R952-E1046 HydrophobicContact CB-CB 4.4Å; R952-E1046 VanDerWaalsContact CD-OE1 3.3Å; R952-E1046 WeakPolarHBondContact CD-OE1 3.1Å; R952-E1046 IonicContact CZ-OE1 2.72Å; R952-E1046 PolarHBondContact N-O 2.71Å; R952-E1046 IonicContact NE-OE1 2.8Å; R952-E1046 IonicContact NH1-OE1 2.62Å; R952-E1046 PolarHBondContact NH1-OE1 2.92Å; L1042-E1046 HydrophobicContact CD2-CB 4.26Å; K1043-E1046 PolarHBondContact O-N 2.86Å; Q1044-E1046 PolarHBondContact O-N 2.83Å
1047	I	80.2	Confident	74.7	Confident	12 Å²	12	89 Å²	89	6%	0.062	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.3	-176.8	-56.8	170.3	0	0	0	109	L943 V949 I950 Y1030 V1032 L1042 Q1044	L943-I1047 HydrophobicContact CD1-CG2 4.33Å; V949-I1047 HydrophobicContact CB-CG2 3.75Å; V949-I1047 HydrophobicContact CG1-CG2 4.15Å; V949-I1047 HydrophobicContact CG2-CG2 3.58Å; I950-I1047 WeakPolarHBondContact O-CA 3.33Å; Y1030-I1047 VanDerWaalsContact CB-CD1 3.49Å; Y1030-I1047 HydrophobicContact CD2-CD1 3.61Å; Y1030-I1047 HydrophobicContact CG-CD1 3.69Å; V1032-I1047 HydrophobicContact CG1-CD1 4.31Å; L1042-I1047 HydrophobicContact CB-CD1 3.82Å; L1042-I1047 HydrophobicContact CB-CG1 3.82Å; L1042-I1047 HydrophobicContact CD1-CG1 3.99Å; Q1044-I1047 PolarHBondContact O-N 3.25Å
1048	F	82.6	Confident	75	Confident	47 Å²	47	81.4 Å²	81.4	21%	0.206	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.4	-178.9	-55.3	-89.9	0	0	0	110	V949 I950 Y958 L1054 P1055 V1058	V949-F1048 CarbonylContact C-O 3.59Å; I950-F1048 HydrophobicContact CB-CB 4.38Å; I950-F1048 PolarHBondContact N-O 3.1Å; I950-F1048 PolarHBondContact O-N 3.44Å; Y958-F1048 HydrophobicContact CD1-CE2 4.41Å; Y958-F1048 HydrophobicContact CE1-CD2 4.4Å; Y958-F1048 AromaticContact CE1-CE2 3.84Å; Y958-F1048 HydrophobicContact CE1-CE2 3.84Å; F1048-L1054 HydrophobicContact CB-CD2 3.46Å; F1048-L1054 VanDerWaalsContact CB-CD2 3.46Å; F1048-L1054 HydrophobicContact CG-CD2 4.15Å; F1048-P1055 HydrophobicContact CD1-CG 4.39Å; F1048-P1055 HydrophobicContact CE1-CG 3.92Å; F1048-V1058 HydrophobicContact CD2-CG1 4.28Å; F1048-V1058 HydrophobicContact CD2-CG2 4.29Å; F1048-V1058 HydrophobicContact CE1-CG2 4.3Å; F1048-V1058 HydrophobicContact CE2-CG2 3.85Å; F1048-V1058 HydrophobicContact CZ-CG2 3.87Å
1049	Q	79.3	Confident	75	Confident	59 Å²	59	85.1 Å²	85.1	28%	0.276	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	151.6	176.5	-63.2	175.1	-79.3	0	0	110.9	L943 D1051 H1052	L943-Q1049 HydrophobicContact CD2-CG 3.57Å; Q1049-D1051 VanDerWaalsContact C-N 3.25Å; Q1049-D1051 WeakPolarHBondContact CB-OD1 3.48Å; Q1049-D1051 PolarHBondContact O-N 2.8Å; Q1049-H1052 PolarHBondContact O-N 2.79Å
1050	L	72.4	Confident	74.3	Confident	88 Å²	88	84.2 Å²	84.2	46%	0.461	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-16.4	-175.3	-65	174.5	0	0	0	114.1	K948 I950 H960	K948-L1050 HydrophobicContact CB-CD1 3.76Å; K948-L1050 WeakPolarHBondContact O-CD1 3.35Å; K948-L1050 WeakPolarHBondContact O-CG 3.47Å; I950-L1050 HydrophobicContact CD1-CD2 3.66Å; I950-L1050 HydrophobicContact CG1-CD2 3.65Å; H960-L1050 WeakPolarHBondContact ND1-CD2 3.22Å
1051	D	56.7	Low	74	Confident	123 Å²	123	84.7 Å²	84.7	66%	0.658	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.7	-179.5	56.6	0.6	0	0	0	113.7	Q1049	Q1049-D1051 VanDerWaalsContact C-N 3.25Å; Q1049-D1051 WeakPolarHBondContact CB-OD1 3.48Å; Q1049-D1051 PolarHBondContact O-N 2.8Å
1052	H	68.7	Low	74	Confident	123 Å²	123	81.8 Å²	81.8	57%	0.569	40%	0.398	S	S	*	.	S	Bend	trans	-93.4	146.4	-176.7	-82.9	73.2	0	0	0	113	Q1049 L1054	Q1049-H1052 PolarHBondContact O-N 2.79Å; H1052-L1054 PolarHBondContact O-N 3.5Å
1053	E	60.4	Low	73.6	Confident	157 Å²	157	82 Å²	82	73%	0.734	40%	0.401	S	S	*	.			trans	-70.1	97.5	179.9	-156.8	-156.2	165.3	0	0	111.5	R1059	E1053-R1059 VanDerWaalsContact CD-NH2 3.31Å; E1053-R1059 IonicContact OE1-CZ 3.24Å; E1053-R1059 IonicContact OE1-NH1 2.64Å; E1053-R1059 PolarHBondContact OE1-NH1 3.44Å; E1053-R1059 IonicContact OE1-NH2 2.66Å; E1053-R1059 PolarHBondContact OE1-NH2 2.64Å
1054	L	74.2	Confident	72.7	Confident	23 Å²	23	83.5 Å²	83.5	12%	0.12	41%	0.412	C	S	.	.			trans	-52.6	138	-176.2	-61.9	175.6	0	0	0	112.9	I950 F1048 H1052 V1058 R1059 L1062	I950-L1054 HydrophobicContact CD1-CD1 3.54Å; I950-L1054 HydrophobicContact CD1-CD2 4.07Å; I950-L1054 HydrophobicContact CD1-CG 4.41Å; F1048-L1054 HydrophobicContact CB-CD2 3.46Å; F1048-L1054 VanDerWaalsContact CB-CD2 3.46Å; F1048-L1054 HydrophobicContact CG-CD2 4.15Å; H1052-L1054 PolarHBondContact O-N 3.5Å; L1054-V1058 HydrophobicContact CB-CB 4.5Å; L1054-V1058 HydrophobicContact CB-CG1 4.41Å; L1054-V1058 HydrophobicContact CD2-CG1 4.37Å; L1054-R1059 HydrophobicContact CB-CG 3.79Å; L1054-R1059 HydrophobicContact CD1-CG 4.46Å; L1054-R1059 PolarHBondContact O-NE 2.95Å; L1054-R1059 PolarHBondContact O-NH2 2.7Å; L1054-L1062 HydrophobicContact CD1-CD2 3.85Å
1055	P	75.4	Confident	71.2	Confident	61 Å²	61	81.9 Å²	81.9	40%	0.396	41%	0.411	S	S	.	.			trans	-55.9	147.6	175.4	-25.9	34	0	0	0	112.6	F1048 R1057 V1058 R1059	F1048-P1055 HydrophobicContact CD1-CG 4.39Å; F1048-P1055 HydrophobicContact CE1-CG 3.92Å; P1055-R1057 PolarHBondContact O-N 3.49Å; P1055-R1057 VanDerWaalsContact O-N 3.08Å; P1055-V1058 HydrophobicContact CB-CG2 4.13Å; P1055-V1058 HydrophobicContact CG-CG2 4.17Å; P1055-V1058 WeakPolarHBondContact O-CA 3.45Å; P1055-V1058 WeakPolarHBondContact O-CB 3.4Å; P1055-V1058 PolarHBondContact O-N 3.46Å; P1055-R1059 PolarHBondContact O-N 2.73Å
1056	K	66.5	Low	69.5	Low	177 Å²	177	83.5 Å²	83.5	77%	0.77	42%	0.417	S	S	*	.	H	α-helix	trans	-53.8	-34.8	-177.5	-67.5	-176.9	179.6	179.2	0	113.3	A1060	K1056-A1060 VanDerWaalsContact O-CB 3.31Å; K1056-A1060 WeakPolarHBondContact O-CB 3.32Å; K1056-A1060 PolarHBondContact O-N 3.47Å
1057	R	67.4	Low	67.4	Low	202 Å²	202	86.6 Å²	86.6	76%	0.762	44%	0.442	S	S	*	.	H	α-helix	trans	-68	-31.4	175.7	-172.6	178.4	-177.1	-179.5	1.2	113.6	P1055	P1055-R1057 PolarHBondContact O-N 3.49Å; P1055-R1057 VanDerWaalsContact O-N 3.08Å
1058	V	75.6	Confident	65.2	Low	4 Å²	4	95.4 Å²	95.4	2%	0.024	48%	0.483	C	S	.	.	H	α-helix	trans	-78.1	-49.1	175.7	-179.6	0	0	0	0	109.4	I950 Y958 F1048 L1054 P1055 A1060 R1061 L1062	I950-V1058 HydrophobicContact CG2-CG1 4.26Å; Y958-V1058 HydrophobicContact CD1-CG1 4.04Å; Y958-V1058 HydrophobicContact CD2-CB 4.43Å; Y958-V1058 HydrophobicContact CD2-CG1 4.07Å; Y958-V1058 HydrophobicContact CE1-CG1 4.4Å; Y958-V1058 HydrophobicContact CE1-CG2 4.19Å; Y958-V1058 HydrophobicContact CE2-CB 4.42Å; Y958-V1058 HydrophobicContact CE2-CG1 4.44Å; Y958-V1058 HydrophobicContact CE2-CG2 4.12Å; Y958-V1058 HydrophobicContact CG-CG1 3.86Å; F1048-V1058 HydrophobicContact CD2-CG1 4.28Å; F1048-V1058 HydrophobicContact CD2-CG2 4.29Å; F1048-V1058 HydrophobicContact CE1-CG2 4.3Å; F1048-V1058 HydrophobicContact CE2-CG2 3.85Å; F1048-V1058 HydrophobicContact CZ-CG2 3.87Å; L1054-V1058 HydrophobicContact CB-CB 4.5Å; L1054-V1058 HydrophobicContact CB-CG1 4.41Å; L1054-V1058 HydrophobicContact CD2-CG1 4.37Å; P1055-V1058 HydrophobicContact CB-CG2 4.13Å; P1055-V1058 HydrophobicContact CG-CG2 4.17Å; P1055-V1058 WeakPolarHBondContact O-CA 3.45Å; P1055-V1058 WeakPolarHBondContact O-CB 3.4Å; P1055-V1058 PolarHBondContact O-N 3.46Å; V1058-A1060 VanDerWaalsContact C-N 3.27Å; V1058-A1060 PolarHBondContact O-N 3.3Å; V1058-R1061 CarbonylContact O-C 3.44Å; V1058-R1061 PolarHBondContact O-N 3.46Å; V1058-L1062 PolarHBondContact O-N 2.79Å
1059	R	76	Confident	62.8	Low	117 Å²	117	101.6 Å²	101.6	44%	0.442	51%	0.512	S	S	.	.	H	α-helix	trans	-53.5	-40.9	174.4	-80.5	-174.9	-89.7	-168.2	-13	113.2	E1053 L1054 P1055 R1061	E1053-R1059 VanDerWaalsContact CD-NH2 3.31Å; E1053-R1059 IonicContact OE1-CZ 3.24Å; E1053-R1059 IonicContact OE1-NH1 2.64Å; E1053-R1059 PolarHBondContact OE1-NH1 3.44Å; E1053-R1059 IonicContact OE1-NH2 2.66Å; E1053-R1059 PolarHBondContact OE1-NH2 2.64Å; L1054-R1059 HydrophobicContact CB-CG 3.79Å; L1054-R1059 HydrophobicContact CD1-CG 4.46Å; L1054-R1059 PolarHBondContact O-NE 2.95Å; L1054-R1059 PolarHBondContact O-NH2 2.7Å; P1055-R1059 PolarHBondContact O-N 2.73Å; R1059-R1061 PolarHBondContact O-N 3.44Å
1060	A	68.5	Low	60.5	Low	78 Å²	78	108.3 Å²	108.3	65%	0.645	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-6.5	178.5	0	0	0	0	0	114.7	K1056 V1058	K1056-A1060 VanDerWaalsContact O-CB 3.31Å; K1056-A1060 WeakPolarHBondContact O-CB 3.32Å; K1056-A1060 PolarHBondContact O-N 3.47Å; V1058-A1060 VanDerWaalsContact C-N 3.27Å; V1058-A1060 PolarHBondContact O-N 3.3Å
1061	R	75.1	Confident	58.7	Low	73 Å²	73	109.9 Å²	109.9	28%	0.275	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.4	20.8	-176.1	-60.6	-163.7	70.4	-164.8	0.6	113.2	T956 W957 Y958 V1058 R1059	T956-R1061 PolarHBondContact O-NH1 3.23Å; T956-R1061 PolarHBondContact O-NH2 2.71Å; T956-R1061 PolarHBondContact OG1-NH1 2.97Å; T956-R1061 PolarHBondContact OG1-NH2 2.71Å; W957-R1061 VanDerWaalsContact CD1-NH2 3.34Å; W957-R1061 HydrophobicContact CE3-CB 4.37Å; W957-R1061 VanDerWaalsContact CE3-O 3.29Å; Y958-R1061 HydrophobicContact CD2-CB 3.96Å; Y958-R1061 HydrophobicContact CE2-CB 4.41Å; Y958-R1061 PolarHBondContact N-O 3.36Å; V1058-R1061 CarbonylContact O-C 3.44Å; V1058-R1061 PolarHBondContact O-N 3.46Å; R1059-R1061 PolarHBondContact O-N 3.44Å
1062	L	79.4	Confident	57.4	Low	27 Å²	27	115.6 Å²	115.6	14%	0.141	57%	0.569	C	S	.	*	B	Isolated β-bridge	trans	-87.6	125.3	175.1	178.4	63.2	0	0	0	109.6	I950 Y958 L1054 V1058 L1064	I950-L1062 HydrophobicContact CD1-CD1 3.76Å; I950-L1062 HydrophobicContact CD1-CD2 3.9Å; I950-L1062 HydrophobicContact CG1-CD1 3.94Å; I950-L1062 HydrophobicContact CG2-CD1 3.8Å; Y958-L1062 WeakPolarHBondContact O-CA 3.49Å; L1054-L1062 HydrophobicContact CD1-CD2 3.85Å; V1058-L1062 PolarHBondContact O-N 2.79Å; L1062-L1064 HydrophobicContact CD2-CD2 4Å; L1062-L1064 HydrophobicContact CG-CD2 4.31Å; L1062-L1064 PolarHBondContact O-N 2.88Å
1063	A	72.5	Confident	55.9	Low	11 Å²	11	115.5 Å²	115.5	9%	0.091	58%	0.579	C	S	.	*			trans	-75.5	112.7	169	0	0	0	0	0	109.6	Y958 Y959 L1085	Y958-A1063 PolarHBondContact O-N 3.37Å; Y959-A1063 HydrophobicContact CD1-CB 3.5Å; Y959-A1063 VanDerWaalsContact CD1-CB 3.5Å; Y959-A1063 HydrophobicContact CE1-CB 3.42Å; Y959-A1063 VanDerWaalsContact CE1-CB 3.42Å; Y959-A1063 HydrophobicContact CG-CB 4.33Å; A1063-L1085 HydrophobicContact CB-CD1 4.26Å; A1063-L1085 HydrophobicContact CB-CD2 4.17Å
1064	L	62.3	Low	54.5	Low	111 Å²	111	112.4 Å²	112.4	58%	0.581	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-86.6	131.8	177.2	-65.5	174.5	0	0	0	110.5	L1062	L1062-L1064 HydrophobicContact CD2-CD2 4Å; L1062-L1064 HydrophobicContact CG-CD2 4.31Å; L1062-L1064 PolarHBondContact O-N 2.88Å
1065	P	48	Very low	52.4	Low	75 Å²	75	118.6 Å²	118.6	49%	0.487	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-63.7	137.1	169.1	-19.9	32.6	0	0	0	111.4
1066	T	36.8	Very low	50.3	Low	131 Å²	131	124.3 Å²	124.3	80%	0.804	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-87.8	121.9	170	43	0	0	0	0	110.4
1067	P	37.8	Very low	48.7	Very low	119 Å²	119	120.3 Å²	120.3	77%	0.773	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-63.9	155.2	165.2	-17.4	31.8	0	0	0	111.1
1068	Q	32.7	Very low	47.1	Very low	198 Å²	198	120 Å²	120	93%	0.925	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-69.4	151.3	167.7	-71.2	175	-99.3	0	0	110.8
1069	E	33.4	Very low	44.8	Very low	177 Å²	177	125 Å²	125	83%	0.827	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-85.6	138	-178.5	-62.5	175.3	120.1	0	0	112.1	V1071	E1069-V1071 HydrophobicContact CB-CG2 4.32Å
1070	E	29.9	Very low	42.6	Very low	200 Å²	200	124.2 Å²	124.2	94%	0.935	70%	0.702	S	S	*	*			trans	-110	142.9	145.3	-76.8	-162.9	138.6	0	0	108.4
1071	V	36.2	Very low	41	Very low	120 Å²	120	130.6 Å²	130.6	73%	0.727	72%	0.716	S	S	*	*			trans	-118.4	122.8	-162.8	177.2	0	0	0	0	112	E1069	E1069-V1071 HydrophobicContact CB-CG2 4.32Å
1072	R	27.6	Very low	38.9	Very low	243 Å²	243	138.3 Å²	138.3	92%	0.917	75%	0.745	S	S	*	*			trans	-145.1	152.1	154.1	-73.9	-157.8	166.3	175	-3.1	112.3
1073	P	38.8	Very low	36.7	Very low	122 Å²	122	149 Å²	149	79%	0.792	78%	0.783	S	S	*	*			trans	-109.6	171.4	-168.3	41.5	-34.7	0	0	0	115.4
1074	A	31.1	Very low	34.9	Very low	91 Å²	91	160.2 Å²	160.2	75%	0.752	82%	0.823	S	S	*	*			trans	68.5	142.8	176.8	0	0	0	0	0	115.5
1075	D	29.7	Very low	33.5	Very low	153 Å²	153	159 Å²	159	82%	0.818	82%	0.817	S	S	*	*			cis	-141.2	-175.9	5.2	-123.2	-34	0	0	0	113.2
1076	E	31	Very low	32.7	Very low	181 Å²	181	160.1 Å²	160.1	85%	0.846	82%	0.824	S	S	*	*			trans	-25.8	156.7	-170.5	-59.9	-163.4	110.7	0	0	123.9
1077	A	32.4	Very low	32.4	Very low	93 Å²	93	159.1 Å²	159.1	77%	0.769	82%	0.823	S	S	*	*			trans	108.7	113.7	145.5	0	0	0	0	0	121.3
1078	Q	35.6	Very low	32.1	Very low	196 Å²	196	159.5 Å²	159.5	92%	0.916	83%	0.828	S	S	*	*			trans	50.8	102.4	148.8	-57.6	-173.4	5.5	0	0	121.9
1079	A	26.5	Very low	32	Very low	109 Å²	109	155.8 Å²	155.8	90%	0.901	82%	0.824	S	S	*	*			trans	-163.1	164.8	145	0	0	0	0	0	114.2
1080	A	30.5	Very low	31.9	Very low	100 Å²	100	152.7 Å²	152.7	83%	0.826	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75.1	153.8	-171.4	0	0	0	0	0	116.5
1081	K	33.8	Very low	31.9	Very low	213 Å²	213	146.5 Å²	146.5	93%	0.926	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.9	125.3	-178.9	-66.4	-178.7	177.5	179.4	0	113.7
1082	R	32.2	Very low	32.4	Very low	234 Å²	234	146.8 Å²	146.8	88%	0.883	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-72.5	169.9	163.4	-75.4	-177.4	171.6	-174.7	-1.8	111.9
1083	R	32.3	Very low	32.6	Very low	252 Å²	252	143 Å²	143	95%	0.951	82%	0.821	S	S	*	*			trans	-116.1	153.7	171	-66.5	-174.4	177.3	-165.3	-1.6	111
1084	R	33.5	Very low	32.3	Very low	247 Å²	247	143.9 Å²	143.9	93%	0.932	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-89	159	-177.5	-75.5	-175.1	172.8	-177	-2.9	113.5
1085	L	33	Very low	32.3	Very low	84 Å²	84	143.6 Å²	143.6	44%	0.44	82%	0.822	S	S	.	*	P	Polyproline II helix	trans	-82.9	162.7	162.5	-81.3	155.4	0	0	0	111.3	W957 A1063	W957-L1085 HydrophobicContact CE3-CD2 3.91Å; W957-L1085 HydrophobicContact CH2-CD2 3.98Å; W957-L1085 HydrophobicContact CZ3-CD2 3.54Å; A1063-L1085 HydrophobicContact CB-CD1 4.26Å; A1063-L1085 HydrophobicContact CB-CD2 4.17Å
1086	P	31.9	Very low	32.3	Very low	100 Å²	100	144.3 Å²	144.3	65%	0.649	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79.6	139.4	170	-1.3	20	0	0	0	111.3
1087	S	31.5	Very low	32.9	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.1	136.7	167.3	51.3	0	0	0	0	110.5
1088	S	30.6	Very low	32.6	Very low	126 Å²	126	144 Å²	144	88%	0.881	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.7	146.8	161.8	45.7	0	0	0	0	110
1089	S	30.7	Very low	33	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	81%	0.81	S	S	*	*			trans	-135.8	124.5	171.9	54.4	0	0	0	0	110.2
1090	A	31.1	Very low	33.2	Very low	112 Å²	112	138.9 Å²	138.9	93%	0.926	80%	0.804	S	S	*	*			trans	-126.5	153.7	170.4	0	0	0	0	0	108.5
1091	G	30.1	Very low	33.9	Very low	70 Å²	70	139.8 Å²	139.8	72%	0.722	80%	0.801	S	S	*	*			trans	157.3	-178	-178.5	0	0	0	0	0	111.4
1092	P	46.9	Very low	33.5	Very low	126 Å²	126	133.5 Å²	133.5	82%	0.818	79%	0.789	S	S	*	*			cis	-108.5	175.1	3.6	39.6	-31.2	0	0	0	113.7
1093	N	32.1	Very low	33.4	Very low	164 Å²	164	130 Å²	130	88%	0.877	78%	0.783	S	S	*	*			trans	-127	132.5	170.3	-105.5	-7.4	0	0	0	110.2
1094	T	31.2	Very low	33.2	Very low	141 Å²	141	124.9 Å²	124.9	87%	0.865	77%	0.769	S	S	*	*			trans	-155.9	137.4	159.2	48	0	0	0	0	107.3
1095	A	31.8	Very low	32.9	Very low	85 Å²	85	118.6 Å²	118.6	70%	0.702	76%	0.755	S	S	*	*			cis	158.2	118.4	-15.7	0	0	0	0	0	104
1096	D	29.6	Very low	32.7	Very low	167 Å²	167	122.1 Å²	122.1	89%	0.893	77%	0.768	S	S	*	*			trans	-179.2	163.1	149.1	-97.9	-14.4	0	0	0	111.2
1097	P	43.9	Very low	32.4	Very low	101 Å²	101	121.7 Å²	121.7	66%	0.656	77%	0.767	S	S	*	*			trans	-128.6	149.5	-145	39.6	-25.4	0	0	0	118.9
1098	L	26	Very low	32.3	Very low	166 Å²	166	123.7 Å²	123.7	87%	0.869	77%	0.768	S	S	*	*			trans	67.9	166	147.8	-71	172	0	0	0	119.1
1099	P	44.8	Very low	32.1	Very low	105 Å²	105	123.4 Å²	123.4	68%	0.682	76%	0.761	S	S	*	*			cis	-133.2	149.2	-13.4	31.3	-11.8	0	0	0	117
1100	A	29.3	Very low	31.9	Very low	93 Å²	93	123.9 Å²	123.9	77%	0.769	76%	0.759	S	S	*	*			trans	61.1	171.7	134.3	0	0	0	0	0	121.6
1101	P	45.1	Very low	32	Very low	119 Å²	119	125.4 Å²	125.4	77%	0.773	75%	0.747	S	S	*	*			cis	-130.1	-176.7	-24.7	33.7	-14.9	0	0	0	114.9
1102	A	26.6	Very low	32.8	Very low	81 Å²	81	126.9 Å²	126.9	67%	0.669	74%	0.744	S	S	*	*			trans	79.2	147.8	145.7	0	0	0	0	0	119.8
1103	Q	28.9	Very low	32.1	Very low	162 Å²	162	126.9 Å²	126.9	76%	0.757	74%	0.742	S	S	*	*			cis	-159.2	147.6	-16.3	-119.7	172.7	-29.8	0	0	112.3
1104	Q	28.5	Very low	32	Very low	143 Å²	143	125.7 Å²	125.7	67%	0.668	74%	0.74	S	S	*	*			trans	51.1	124.4	139.7	-76.6	176.6	-15.2	0	0	123.9
1105	N	27.5	Very low	32.1	Very low	116 Å²	116	127.5 Å²	127.5	62%	0.62	74%	0.739	S	S	*	*				87	115.5	122.7	-64.2	3.8	0	0	0	123.5
1106	H	28.8	Very low	33.4	Very low	158 Å²	158	128.7 Å²	128.7	73%	0.731	74%	0.74	S	S	*	*				65.2	107.6	123.8	-66.1	-56.6	0	0	0	123.8
1107	S	25.9	Very low	34.5	Very low	90 Å²	90	125.8 Å²	125.8	63%	0.629	73%	0.73	S	S	*	*				86.5	111.7	110.8	-58.5	0	0	0	0	123.6
1108	I	29.5	Very low	33.8	Very low	152 Å²	152	125.8 Å²	125.8	78%	0.779	73%	0.732	S	S	*	*				70	148.8	127.5	-53	169	0	0	0	119.8
1109	T	26.4	Very low	34	Very low	121 Å²	121	124.9 Å²	124.9	74%	0.742	73%	0.725	S	S	*	*			trans	75.8	142.6	167	15.6	0	0	0	0	117
1110	T	27.1	Very low	33.3	Very low	129 Å²	129	125.4 Å²	125.4	79%	0.791	73%	0.727	S	S	*	*			cis	-150.5	166.5	6.2	-36.5	0	0	0	0	111.6
1111	Q	32.7	Very low	34.3	Very low	144 Å²	144	126.2 Å²	126.2	67%	0.673	72%	0.724	S	S	*	*			trans	-81.4	-161.9	162.5	-59.3	-167.4	29.3	0	0	111.2
1112	P	47.4	Very low	33.6	Very low	101 Å²	101	125.6 Å²	125.6	66%	0.656	72%	0.718	S	S	*	*			cis	-153.9	174.1	4.3	44.9	-22.7	0	0	0	122
1113	T	30.9	Very low	33.9	Very low	127 Å²	127	127.5 Å²	127.5	78%	0.779	72%	0.722	S	S	*	*			trans	72.5	147.4	144.4	17.2	0	0	0	0	128.1
1114	V	31.1	Very low	34	Very low	139 Å²	139	125.5 Å²	125.5	84%	0.842	72%	0.716	S	S	*	*			trans	93.6	149.2	149.1	172.3	0	0	0	0	121
1115	E	32	Very low	34.2	Very low	178 Å²	178	125.6 Å²	125.6	83%	0.832	72%	0.717	S	S	*	*			trans	-107.8	-141.5	-168.7	-59.1	171.6	101.2	0	0	114.6
1116	P	60.1	Low	34.3	Very low	111 Å²	111	128.2 Å²	128.2	72%	0.721	73%	0.725	S	S	*	*				-122.9	-143.8	-108.4	43.3	-21.7	0	0	0	112.7
1117	P	52.3	Low	34.4	Very low	106 Å²	106	124.9 Å²	124.9	69%	0.688	73%	0.725	S	S	*	*			cis	-142.1	177.2	-14.9	42.1	-23.2	0	0	0	118.5
1118	S	29.7	Very low	35.9	Very low	100 Å²	100	125.8 Å²	125.8	70%	0.699	73%	0.729	S	S	*	*			trans	87.2	151.1	137	78	0	0	0	0	125.8
1119	M	28.8	Very low	36	Very low	148 Å²	148	124.3 Å²	124.3	73%	0.729	73%	0.727	S	S	*	*			trans	90.9	101.4	152.9	-65.2	-58.1	103.2	0	0	124.1
1120	T	31.8	Very low	36.3	Very low	116 Å²	116	129.2 Å²	129.2	71%	0.712	73%	0.732	S	S	*	*				44.3	168.7	116.7	55.3	0	0	0	0	123.3
1121	P	50.3	Low	36.5	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	73%	0.731	S	S	*	*			cis	-121.2	-141.4	1.6	23.8	3.5	0	0	0	113.1
1122	T	28.5	Very low	36.4	Very low	106 Å²	106	127.6 Å²	127.6	65%	0.65	74%	0.736	S	S	*	*			cis	-167.4	138.3	9.8	-20.2	0	0	0	0	113
1123	T	33.3	Very low	35.6	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	74%	0.735	S	S	*	*			trans	52.2	154.6	149.7	47.5	0	0	0	0	122.5
1124	N	31.4	Very low	35.5	Very low	120 Å²	120	128.4 Å²	128.4	64%	0.642	74%	0.735	S	S	*	*			cis	-161.3	154.1	10.1	-129.7	5.5	0	0	0	114
1125	Q	32.9	Very low	35.5	Very low	146 Å²	146	128.8 Å²	128.8	68%	0.682	73%	0.728	S	S	*	*			trans	56.3	158.6	150.1	-70.4	169.2	-67.8	0	0	120.1
1126	E	30.2	Very low	35.4	Very low	170 Å²	170	125.8 Å²	125.8	79%	0.794	72%	0.722	S	S	*	*			cis	-152.1	-170.5	0.2	-138.2	155.8	-140.8	0	0	112.6
1127	A	30.8	Very low	33.9	Very low	88 Å²	88	126.8 Å²	126.8	73%	0.727	72%	0.722	S	S	*	*			trans	-142.9	-169.7	-177.3	0	0	0	0	0	110.5
1128	P	55.9	Low	32.8	Very low	110 Å²	110	127.1 Å²	127.1	71%	0.714	72%	0.722	S	S	*	*			cis	-150.1	171	7.2	45.2	-24.1	0	0	0	120.5
1129	T	33.4	Very low	32.9	Very low	121 Å²	121	131 Å²	131	74%	0.742	73%	0.729	S	S	*	*			trans	54.4	134.1	141.1	54.3	0	0	0	0	127.8
1130	R	32.2	Very low	33.3	Very low	224 Å²	224	130 Å²	130	85%	0.845	73%	0.731	S	S	*	*				94.4	108.7	126.7	-90.2	-166	166.7	-171	-3.4	125
1131	V	31.4	Very low	34.3	Very low	126 Å²	126	129.4 Å²	129.4	76%	0.764	73%	0.729	S	S	*	*				74.7	130.5	109	166.5	0	0	0	0	124
1132	S	30.9	Very low	33.5	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	74%	0.736	S	S	*	*			trans	92.3	141.1	150.1	-155.4	0	0	0	0	122
1133	S	29.4	Very low	33.9	Very low	91 Å²	91	134 Å²	134	64%	0.636	74%	0.74	S	S	*	*			trans	-82.6	167.1	178.9	49.9	0	0	0	0	115.6
1134	I	29.9	Very low	33.9	Very low	154 Å²	154	134.4 Å²	134.4	79%	0.79	74%	0.743	S	S	*	*				-179.4	170.3	129.9	-92.4	157.5	0	0	0	110
1135	Q	29.6	Very low	33.9	Very low	147 Å²	147	131.9 Å²	131.9	69%	0.687	75%	0.745	S	S	*	*			trans	-118.8	-173.3	-174.6	-45	83.4	-120.7	0	0	111.1
1136	T	31.1	Very low	34	Very low	116 Å²	116	132.1 Å²	132.1	71%	0.712	75%	0.751	S	S	*	*			cis	-154.7	-148.4	17.8	-21.6	0	0	0	0	110.4
1137	D	27.2	Very low	34	Very low	132 Å²	132	129.5 Å²	129.5	71%	0.706	74%	0.743	S	S	*	*			trans	77.7	149.3	149	-68.4	-55	0	0	0	120.5
1138	T	30.8	Very low	34.1	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	75%	0.747	S	S	*	*			cis	-158.5	158.2	-40.6	-2.8	0	0	0	0	110.5
1139	E	31.7	Very low	32.9	Very low	182 Å²	182	132 Å²	132	85%	0.85	75%	0.75	S	S	*	*			trans	64.7	156.1	154	-65.9	-170.2	158	0	0	125.4
1140	T	37.3	Very low	33	Very low	128 Å²	128	135 Å²	135	79%	0.785	76%	0.756	S	S	*	*			trans	-66.4	-178.1	-175.9	28.2	0	0	0	0	117.4
1141	P	51.8	Low	34.3	Very low	102 Å²	102	129.7 Å²	129.7	66%	0.662	75%	0.75	S	S	*	*			cis	-150.1	179.7	26	46.5	-25.5	0	0	0	120.8
1142	M	34.7	Very low	36	Very low	176 Å²	176	129 Å²	129	87%	0.867	75%	0.748	S	S	*	*			trans	34.4	153.2	139.3	-72.2	-162.5	-62	0	0	123.6
1143	D	36.9	Very low	36.9	Very low	136 Å²	136	128.7 Å²	128.7	73%	0.727	74%	0.744	S	S	*	*			cis	-174	-176.8	-9.5	179	35.4	0	0	0	110.3
1144	T	31.8	Very low	36.8	Very low	130 Å²	130	131.4 Å²	131.4	80%	0.798	75%	0.749	S	S	*	*			trans	88.3	141.5	170.3	72.2	0	0	0	0	118.2
1145	G	32.8	Very low	36.6	Very low	67 Å²	67	129.4 Å²	129.4	69%	0.691	75%	0.749	S	S	*	*			cis	178.9	167.2	-7.2	0	0	0	0	0	115.3
1146	D	34	Very low	36.5	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	76%	0.756	S	S	*	*			trans	71.2	144.9	168	-87.5	49.6	0	0	0	120.2
1147	N	30.5	Very low	37.8	Very low	116 Å²	116	129.9 Å²	129.9	62%	0.62	76%	0.759	S	S	*	*			cis	-170	166.9	-21.7	-140.2	-33.7	0	0	0	114.1
1148	L	31.8	Very low	39.1	Very low	155 Å²	155	128.5 Å²	128.5	81%	0.812	76%	0.757	S	S	*	*			trans	59.8	145.9	157.3	-55.9	175.3	0	0	0	121.3
1149	A	31.7	Very low	39	Very low	94 Å²	94	131 Å²	131	78%	0.777	77%	0.765	S	S	*	*			cis	-168.1	174.9	-18.9	0	0	0	0	0	111.6
1150	E	35.9	Very low	38.9	Very low	185 Å²	185	128.2 Å²	128.2	86%	0.864	76%	0.761	S	S	*	*			trans	-111.2	175.9	-166.3	-87.9	-166.8	126.6	0	0	115.4
1151	P	59.9	Low	38.5	Very low	112 Å²	112	131 Å²	131	73%	0.727	77%	0.765	S	S	*	*			cis	-133.4	-108.9	-30.8	37.3	-13.7	0	0	0	115.2
1152	P	66	Low	37.4	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	77%	0.767	S	S	*	*			trans	-124.9	-141.3	-163.4	39.1	-12.2	0	0	0	112.8
1153	P	49.1	Very low	37.3	Very low	106 Å²	106	133 Å²	133	69%	0.688	76%	0.763	S	S	*	*			cis	-141.4	-156.8	-11.9	35.4	-9.6	0	0	0	116.6
1154	I	27.6	Very low	36.9	Very low	147 Å²	147	132.4 Å²	132.4	75%	0.754	76%	0.764	S	S	*	*			trans	78	132.1	163.2	-17.9	-178.7	0	0	0	121.9
1155	S	26.8	Very low	37.9	Very low	113 Å²	113	131 Å²	131	79%	0.79	76%	0.757	S	S	*	*			trans	77.8	145	143.1	46.7	0	0	0	0	125.1
1156	N	27.3	Very low	37.7	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	76%	0.761	S	S	*	*			trans	-79.2	-179.9	163	-75.1	-30.5	0	0	0	112.3
1157	P	58.3	Low	37.4	Very low	120 Å²	120	137 Å²	137	78%	0.779	76%	0.76	S	S	*	*			cis	-106.5	-84.5	-12.6	12.7	9.8	0	0	0	114.3
1158	P	54.3	Low	37.3	Very low	102 Å²	102	136.1 Å²	136.1	66%	0.662	77%	0.769	S	S	*	*			cis	-121.5	-167.4	-1	37.1	-17.3	0	0	0	114.9
1159	L	29.3	Very low	37.2	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	77%	0.765	S	S	*	*			trans	74.3	164.9	168.6	-54.9	178.3	0	0	0	118.6
1160	T	29.8	Very low	37.1	Very low	124 Å²	124	137.7 Å²	137.7	76%	0.761	77%	0.769	S	S	*	*			trans	-156.8	138.8	-160.6	57.1	0	0	0	0	116.2
1161	Q	28.7	Very low	36.7	Very low	186 Å²	186	135.5 Å²	135.5	87%	0.869	76%	0.763	S	S	*	*			trans	-132.4	112.9	138.8	-83.3	-176.8	1.1	0	0	106.2
1162	Q	29	Very low	35.2	Very low	153 Å²	153	134.8 Å²	134.8	72%	0.715	76%	0.761	S	S	*	*				62.6	123.7	78.5	-72.9	-174.7	-18	0	0	112.4
1163	H	31.2	Very low	33.7	Very low	167 Å²	167	136.9 Å²	136.9	77%	0.773	77%	0.766	S	S	*	*			cis	-137.9	163.7	17.2	-108.3	-86.4	0	0	0	114.5
1164	T	28.8	Very low	33.7	Very low	123 Å²	123	136.3 Å²	136.3	76%	0.755	76%	0.762	S	S	*	*			trans	-105.8	-173.6	175.4	47	0	0	0	0	110.1
1165	P	53.1	Low	33.8	Very low	100 Å²	100	138.2 Å²	138.2	65%	0.649	77%	0.766	S	S	*	*			cis	-158.1	-174.3	29.1	46.5	-22.9	0	0	0	121.6
1166	F	28.4	Very low	33.8	Very low	178 Å²	178	139.5 Å²	139.5	78%	0.781	76%	0.763	S	S	*	*			trans	53.8	132.8	165.8	-62.5	-75.4	0	0	0	119.4
1167	Q	28.5	Very low	33.9	Very low	165 Å²	165	137.5 Å²	137.5	77%	0.771	76%	0.761	S	S	*	*			cis	97.9	105.9	17.3	-168	-172.1	20.4	0	0	114.6
1168	A	28.1	Very low	32.7	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	76%	0.759	S	S	*	*			trans	-151.6	161.8	171.9	0	0	0	0	0	112.1
1169	T	29.2	Very low	32.4	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	77%	0.767	S	S	*	*			trans	-148.9	130.9	-149.8	43.1	0	0	0	0	116
1170	L	29.6	Very low	32.5	Very low	163 Å²	163	134.6 Å²	134.6	85%	0.853	76%	0.762	S	S	*	*			trans	56.4	158.8	148.1	-76.6	167.6	0	0	0	122.3
1171	N	27.4	Very low	32.6	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	76%	0.76	S	S	*	*			trans	85.6	107.1	156.1	-61.5	-14.1	0	0	0	123.2
1172	S	28.8	Very low	32.8	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	75%	0.753	S	S	*	*				54.1	123.8	118	-43.8	0	0	0	0	125.3
1173	D	33.6	Very low	33.4	Very low	156 Å²	156	127.8 Å²	127.8	83%	0.834	76%	0.757	S	S	*	*			trans	61.7	176.7	141.5	-62.6	-24.5	0	0	0	118.7
1174	P	51	Low	34.3	Very low	94 Å²	94	126 Å²	126	61%	0.61	76%	0.76	S	S	*	*			cis	-135.9	-177	-0.8	44.2	-27.8	0	0	0	117
1175	F	28.1	Very low	34.6	Very low	187 Å²	187	128.2 Å²	128.2	82%	0.82	77%	0.766	S	S	*	*			trans	64.3	158.3	149.9	-66.6	-34.6	0	0	0	120.3
1176	L	27.9	Very low	35.3	Very low	139 Å²	139	128.5 Å²	128.5	73%	0.728	77%	0.768	S	S	*	*			cis	-163	168.1	-32.1	-126.5	174.2	0	0	0	109.5
1177	S	29	Very low	36.3	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	77%	0.768	S	S	*	*			trans	72.1	140.5	156.6	-59.3	0	0	0	0	121.4
1178	A	34.1	Very low	37.5	Very low	91 Å²	91	124 Å²	124	75%	0.752	77%	0.771	S	S	*	*			trans	-97.3	175.1	165.1	0	0	0	0	0	111
1179	P	46.7	Very low	39.3	Very low	126 Å²	126	124.5 Å²	124.5	82%	0.818	77%	0.766	S	S	*	*				-149.2	-175.9	90.5	38.9	-19.7	0	0	0	116.5
1180	S	31.3	Very low	40.1	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	77%	0.769	S	S	*	*			trans	-63.3	162.5	177.3	52.9	0	0	0	0	115.3
1181	S	31.4	Very low	41.2	Very low	101 Å²	101	122.3 Å²	122.3	71%	0.706	76%	0.764	S	S	*	*				-178.9	129.8	57.5	54.3	0	0	0	0	116.9
1182	S	34.6	Very low	42.6	Very low	104 Å²	104	120.7 Å²	120.7	73%	0.727	76%	0.761	S	S	*	*			trans	40.5	129.6	140	62.6	0	0	0	0	126.2
1183	S	40.3	Very low	42.8	Very low	115 Å²	115	124.1 Å²	124.1	80%	0.804	77%	0.766	S	S	*	*			trans	79.2	157.9	138.6	-63	0	0	0	0	120.1
1184	P	50.2	Low	42.8	Very low	128 Å²	128	124.1 Å²	124.1	83%	0.831	76%	0.761	S	S	*	*			cis	-128.5	-148.7	15.8	43.7	-25.7	0	0	0	117.1
1185	L	34.8	Very low	41.8	Very low	170 Å²	170	127.3 Å²	127.3	89%	0.89	77%	0.77	S	S	*	*			trans	-122	-176	-156.3	-91.6	172.7	0	0	0	114.9
1186	P	67.9	Low	41.9	Very low	106 Å²	106	121.8 Å²	121.8	69%	0.688	77%	0.765	S	S	*	*			trans	-121.5	-175.8	-145.8	46.8	-38.7	0	0	0	117.8
1187	P	49.5	Very low	42.2	Very low	121 Å²	121	122.7 Å²	122.7	79%	0.786	77%	0.771	S	S	*	*			trans	-127.7	171.9	160.1	37.1	-21.5	0	0	0	116
1188	P	54	Low	42.5	Very low	127 Å²	127	121.4 Å²	121.4	83%	0.825	76%	0.761	S	S	*	*			trans	-124.3	-124.6	-160.9	33.5	-8.9	0	0	0	118.2
1189	P	66.4	Low	42.3	Very low	110 Å²	110	127.6 Å²	127.6	71%	0.714	77%	0.767	S	S	*	*			trans	-117.5	-170.6	-134.6	43.3	-23.6	0	0	0	115.2
1190	P	45.7	Very low	41.9	Very low	122 Å²	122	125.6 Å²	125.6	79%	0.792	75%	0.752	S	S	*	*				-156.6	-142	81.6	51.7	-28.6	0	0	0	114.4
1191	P	52.1	Low	41.9	Very low	114 Å²	114	126.4 Å²	126.4	74%	0.74	76%	0.755	S	S	*	*			trans	-134.2	-137.7	-144.6	42.4	-14.9	0	0	0	113.7
1192	P	56.4	Low	42.2	Very low	105 Å²	105	127.3 Å²	127.3	68%	0.682	76%	0.761	S	S	*	*			cis	-133.3	-160.2	-27.1	34.6	-11.4	0	0	0	114.8
1193	Q	33.6	Very low	42.8	Very low	169 Å²	169	127.2 Å²	127.2	79%	0.79	76%	0.761	S	S	*	*			trans	93.1	139	163.1	-52.7	-161.2	-10.7	0	0	118.4
1194	H	33.3	Very low	42.9	Very low	157 Å²	157	124.8 Å²	124.8	73%	0.727	75%	0.754	S	S	*	*			cis	-148.9	162.6	-7.3	-139.3	-87.1	0	0	0	113.6
1195	M	29.5	Very low	42.4	Very low	161 Å²	161	127 Å²	127	79%	0.793	75%	0.747	S	S	*	*			trans	-40.4	155.9	-178.3	-53.2	-61.4	179.4	0	0	117.7
1196	G	31.2	Very low	42.8	Very low	70 Å²	70	123.3 Å²	123.3	72%	0.722	73%	0.731	S	S	*	*			cis	104.3	145.2	10.3	0	0	0	0	0	112.8
1197	D	34.7	Very low	41.4	Very low	159 Å²	159	121.4 Å²	121.4	85%	0.85	72%	0.72	S	S	*	*			cis	-149.4	-128.2	-1.8	-165	-99.7	0	0	0	112.5
1198	S	34.7	Very low	41	Very low	83 Å²	83	123.1 Å²	123.1	58%	0.58	71%	0.712	S	S	*	*			trans	-146.3	-173	-156.8	71.7	0	0	0	0	115.2
1199	Y	30.8	Very low	40.4	Very low	222 Å²	222	121.1 Å²	121.1	87%	0.871	69%	0.693	S	S	*	*			trans	-142.4	160	160.9	-147.3	-97.8	0	0	0	115.2
1200	T	37.5	Very low	39.1	Very low	83 Å²	83	121.7 Å²	121.7	51%	0.509	69%	0.686	S	S	.	*			trans	-133.8	165.3	-143.4	52.2	0	0	0	0	115.7
1201	P	31.7	Very low	39	Very low	127 Å²	127	120.6 Å²	120.6	83%	0.825	68%	0.677	S	S	*	*			trans	-76	151.5	157.9	-7.5	26	0	0	0	111.6
1202	S	37.9	Very low	38.4	Very low	120 Å²	120	120.4 Å²	120.4	84%	0.839	67%	0.669	S	S	*	*			trans	-85.6	142.2	-167.7	53.2	0	0	0	0	116.1	G1204	S1202-G1204 VanDerWaalsContact C-N 3.26Å; S1202-G1204 PolarHBondContact O-N 3Å
1203	S	46.3	Very low	37.7	Very low	102 Å²	102	122 Å²	122	71%	0.713	67%	0.672	S	S	*	*			trans	-76.8	49.9	-173.7	-176	0	0	0	0	115
1204	G	43.5	Very low	38	Very low	64 Å²	64	121.6 Å²	121.6	66%	0.66	67%	0.669	S	S	*	*			trans	-79.6	-34.6	-173.6	0	0	0	0	0	116.4	S1202	S1202-G1204 VanDerWaalsContact C-N 3.26Å; S1202-G1204 PolarHBondContact O-N 3Å
1205	Y	38.8	Very low	38	Very low	175 Å²	175	119 Å²	119	69%	0.686	67%	0.668	S	S	*	*	S	Bend	trans	-107.4	-23.6	-163.3	-160.1	-105.4	0	0	0	115.2	M1209	Y1205-M1209 HydrophobicContact CE1-CE 4.16Å
1206	V	43.9	Very low	38.4	Very low	92 Å²	92	122.7 Å²	122.7	56%	0.558	67%	0.674	S	S	*	*	H	α-helix	trans	-75.8	-48.9	-173.9	-178	0	0	0	0	111.6	Y1208 M1209 E1210	V1206-Y1208 PolarHBondContact O-N 2.94Å; V1206-Y1208 VanDerWaalsContact O-N 3.16Å; V1206-M1209 PolarHBondContact O-N 3.46Å; V1206-E1210 PolarHBondContact O-N 3.29Å
1207	S	37	Very low	38.4	Very low	67 Å²	67	129 Å²	129	47%	0.469	68%	0.682	S	S	.	*	H	α-helix	trans	-58	-31.9	-178.4	175	0	0	0	0	113.7	T1211	S1207-T1211 PolarHBondContact O-N 2.74Å; S1207-T1211 PolarHBondContact O-OG1 3.26Å
1208	Y	42.1	Very low	38.5	Very low	156 Å²	156	127.2 Å²	127.2	61%	0.612	68%	0.679	S	S	*	*	H	α-helix	trans	-66.8	-35.3	175.7	-175.2	-104.4	0	0	0	112.7	V1206 L1212	V1206-Y1208 PolarHBondContact O-N 2.94Å; V1206-Y1208 VanDerWaalsContact O-N 3.16Å; Y1208-L1212 HydrophobicContact CD1-CD1 4.42Å; Y1208-L1212 HydrophobicContact CE1-CD1 3.83Å
1209	M	41.9	Very low	38.4	Very low	85 Å²	85	131.9 Å²	131.9	42%	0.419	69%	0.691	S	S	.	*	H	α-helix	trans	-78.1	-35.2	-179.3	-69.9	-67	168.5	0	0	112.6	Y1205 V1206 L1212	Y1205-M1209 HydrophobicContact CE1-CE 4.16Å; V1206-M1209 PolarHBondContact O-N 3.46Å; M1209-L1212 PolarHBondContact O-N 3.16Å
1210	E	39	Very low	38.4	Very low	123 Å²	123	128.7 Å²	128.7	58%	0.575	69%	0.689	S	S	*	*	H	α-helix	trans	-70.5	-34.3	177.2	-66.6	179.9	127.7	0	0	112.5	V1206 L1212 L1213 H1214	V1206-E1210 PolarHBondContact O-N 3.29Å; E1210-L1212 VanDerWaalsContact C-N 3.26Å; E1210-L1212 PolarHBondContact O-N 2.91Å; E1210-L1213 PolarHBondContact O-N 3.05Å; E1210-H1214 PolarHBondContact O-ND1 2.88Å
1211	T	42.9	Very low	38	Very low	98 Å²	98	133.7 Å²	133.7	60%	0.601	71%	0.707	S	S	*	*	H	α-helix	trans	-65.8	-28.1	177.5	-53.5	0	0	0	0	112.4	S1207 L1213	S1207-T1211 PolarHBondContact O-N 2.74Å; S1207-T1211 PolarHBondContact O-OG1 3.26Å; T1211-L1213 VanDerWaalsContact C-N 3.31Å; T1211-L1213 PolarHBondContact O-N 3.44Å
1212	L	40.5	Very low	38.1	Very low	110 Å²	110	130.9 Å²	130.9	58%	0.576	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-4.7	179.8	-102.5	160.4	0	0	0	114.6	Y1208 M1209 E1210	Y1208-L1212 HydrophobicContact CD1-CD1 4.42Å; Y1208-L1212 HydrophobicContact CE1-CD1 3.83Å; M1209-L1212 PolarHBondContact O-N 3.16Å; E1210-L1212 VanDerWaalsContact C-N 3.26Å; E1210-L1212 PolarHBondContact O-N 2.91Å
1213	L	41.5	Very low	38.7	Very low	140 Å²	140	131.4 Å²	131.4	73%	0.733	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-3.2	-174.9	-76.3	166.7	0	0	0	115	E1210 T1211	E1210-L1213 PolarHBondContact O-N 3.05Å; T1211-L1213 VanDerWaalsContact C-N 3.31Å; T1211-L1213 PolarHBondContact O-N 3.44Å
1214	H	39.9	Very low	38	Very low	160 Å²	160	130.2 Å²	130.2	74%	0.741	71%	0.706	S	S	*	*	S	Bend	trans	-129.2	4.5	-167.8	-75.1	96.9	0	0	0	116.8	E1210	E1210-H1214 PolarHBondContact O-ND1 2.88Å
1215	S	33.7	Very low	38.1	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-87.8	125.1	172.2	40.1	0	0	0	0	111.7
1216	R	36.3	Very low	37.6	Very low	240 Å²	240	129.8 Å²	129.8	91%	0.906	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-84.2	148.8	-170.1	-57.5	176.9	-177.8	177.8	-1.4	113
1217	F	32.8	Very low	37	Very low	202 Å²	202	139.6 Å²	139.6	89%	0.886	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-98.8	149.6	149.2	-86.2	-87	0	0	0	109.7
1218	P	35.5	Very low	37	Very low	121 Å²	121	143.2 Å²	143.2	79%	0.786	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-70.2	162.5	176.2	-17.8	32.7	0	0	0	113.8
1219	Q	32.8	Very low	36.7	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	76%	0.76	S	S	*	*			trans	-101.6	-177.7	164.5	-64.3	-176.2	-95.3	0	0	110.1
1220	D	31.4	Very low	36.4	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	78%	0.779	S	S	*	*			trans	96.1	124.9	175.7	-56.3	-9.9	0	0	0	114.7
1221	E	29.7	Very low	36.3	Very low	188 Å²	188	147.1 Å²	147.1	88%	0.879	79%	0.792	S	S	*	*			cis	-138.2	179.9	-12	-72	-154	107.9	0	0	110.6
1222	G	33.3	Very low	35.9	Very low	69 Å²	69	150.1 Å²	150.1	71%	0.711	80%	0.803	S	S	*	*			trans	-91.3	-156.2	171.3	0	0	0	0	0	113.9
1223	P	50.3	Low	35.6	Very low	130 Å²	130	152.8 Å²	152.8	84%	0.844	82%	0.819	S	S	*	*			cis	-140	124.5	3.7	37	-16.2	0	0	0	117.4
1224	G	31.7	Very low	35.1	Very low	78 Å²	78	153.7 Å²	153.7	80%	0.804	83%	0.825	S	S	*	*			trans	62.5	-172.5	151.4	0	0	0	0	0	119.6
1225	P	44.6	Very low	34.8	Very low	120 Å²	120	153.2 Å²	153.2	78%	0.779	83%	0.831	S	S	*	*			cis	-131.3	-165.3	-9.2	35.2	-14.6	0	0	0	114.5
1226	V	29.2	Very low	34.9	Very low	109 Å²	109	157.6 Å²	157.6	66%	0.661	84%	0.842	S	S	*	*			trans	84.7	132.6	161.1	-138	0	0	0	0	120.4
1227	Y	30.9	Very low	34.7	Very low	298 Å²	298	150.1 Å²	150.1	100%	1.169	84%	0.836	S	S	*	*			trans	72.8	0	171	-62.1	-63.1	0	0	0	118.6

Retrieved 1,227 of 1,227 residues in 775.9 ms (Link to these results)

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