A0A3Q0KMS1_SCHMA Loading...

Histone acetyltransferase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KMS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,185 aa.

						>A0A3Q0KMS1_SCHMA|A0A3Q0KMS1
MSFGPTNLSQFPAMLATAQTGGPTAFVAINNMFPASPSSLPNSPGTILSMSTNMMPSNINSTQTLNPGSFLLPPTNFPPNPANLTCTVPLSSPPQLQTPILPFFAPTSGNLMPSNSSSLSMPSPFGAPMSHFVHPGHSNSLPTFSSSVSTSGNPSTLPVSLFPSNNQMPSGILSSQPMVLPTLPVAFSNQAQTNSVGVLPIPIGIPQSLPSNSITETTNSFLVSSSNYTTPIYTATLFPLNNPTILPITTVASLSSNPTSYLPSTNGDHASTISSKNEKPLVSVPAKVGNVRNLQALEAVDFHRDAILDAIDKLRERKARPDFERISCLLKRHQNINSEQTHLCLQRLADAGAVVCVDYKGNLSYRNPSKWRKTAATSGTGNTNLPSVSHKLVDAIRSLMESNLSSQSTQSCTNLIPFSQPGPNGGYSLFQVERALQFLNDLNSSPKSIPELTGATLRVCLDREATHGKLAKTSDGRYILDETGEHKKAYMSNSNMHTPLMSNKKLLPPNTSSGVYQTSNGSCSKVTNKSGPIDRNITPTRLHPLAAKQTPNITNGKPVNLSLTPNFSMPPLSSGRRGRPPGSKAKKISSEINLCEKKIKVENSSTAYGNTTTPGGVDSNTCNGLNTPSLYISDANSSGLVPTSCFTSHATSELPFSSTIPVLPSSSFITVIASTSNNCPNILPGTILPTHFSAASSIPIDSSLMTTISSPFLSFPLSQSLSLPPLFSNTSNLSHDFTSSQLTMPLKPDNVLTPDSFMSDMNCDTIDKQEEKDGLICYCCGGPPTCEEAFLVCKDCGLNAHPTCLDYWPELTERARQSPWQCSDCKTCTVCNNSEYRSDLIICDACDKGFHIECHRPKLEESIDRSLPWVCASCQDEGYRVAIGTLPSGNNNQNYSSPNKTKESNDDLMKTPLKEINSSYEYIKTESKQEINESGVEENIIKSVESSPHSTVGQHLTTTTSNTICNENFPADINSTGHSSVVLTPTKTCCSTSPKLNESNNSNNNSTNISTNNNSTTCGINSVQLDGECLHENKSSTSIQEDATDNDKKTSPISSNSTSDLHLKSCLEDNNNNNNDTSNIKEIKNEIENISESNMIINGENQEIPSNNNRPTDVSIWSVDHVQQWLLEEGFPREAEAFYQQEIDGTCLLLMKRMDVLTELGIKLGPAVKIYERIKRFQSQCGSPT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	42.9	Very low	40.2	Very low	238 Å²	238	141 Å²	141	100%	1.172	78%	0.777	S	S	*	*				0	136.6	0	-65.3	169.2	178.8	0	0	107.6
2	S	42.2	Very low	40.2	Very low	87 Å²	87	138.9 Å²	138.9	61%	0.608	78%	0.775	S	S	*	*			cis	-165.9	130.1	-13	-86.4	0	0	0	0	108.7
3	F	42.4	Very low	40.1	Very low	195 Å²	195	134.5 Å²	134.5	86%	0.855	77%	0.768	S	S	*	*			trans	43.6	132.8	161.4	-42	-67.8	0	0	0	119
4	G	44.2	Very low	39.9	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	77%	0.769	S	S	*	*			cis	84.1	168.2	22.8	0	0	0	0	0	112.4
5	P	57.2	Low	39.6	Very low	106 Å²	106	137.5 Å²	137.5	69%	0.688	77%	0.772	S	S	*	*			cis	-146.9	-175.8	-12.4	40.3	-20.5	0	0	0	115.5
6	T	41.4	Very low	39.6	Very low	118 Å²	118	133.8 Å²	133.8	72%	0.724	76%	0.763	S	S	*	*			trans	63.3	169.3	152.7	49.9	0	0	0	0	120
7	N	34.4	Very low	39.4	Very low	128 Å²	128	134.1 Å²	134.1	68%	0.684	77%	0.769	S	S	*	*			cis	-139.3	135.4	-3	-125.1	-76.9	0	0	0	106.1
8	L	32.9	Very low	39.3	Very low	146 Å²	146	131.1 Å²	131.1	76%	0.764	76%	0.763	S	S	*	*				71.9	160	69.3	-115.5	169.8	0	0	0	115.3
9	S	35.5	Very low	39.4	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	77%	0.766	S	S	*	*			trans	76.1	140	-175.8	82.1	0	0	0	0	116.7
10	Q	36.5	Very low	39.3	Very low	175 Å²	175	133.5 Å²	133.5	82%	0.818	77%	0.769	S	S	*	*			cis	-151	153.6	-12.4	-157	84.8	-14.6	0	0	111.6
11	F	32.8	Very low	39.2	Very low	190 Å²	190	131 Å²	131	83%	0.833	77%	0.772	S	S	*	*			trans	-61.6	170	166.2	-89.3	-100.8	0	0	0	113.3
12	P	40.4	Very low	38.8	Very low	116 Å²	116	123.3 Å²	123.3	75%	0.753	75%	0.753	S	S	*	*			cis	-149.6	166.2	33.7	43.4	-23.1	0	0	0	121.6
13	A	39	Very low	38.8	Very low	82 Å²	82	124.7 Å²	124.7	68%	0.678	76%	0.76	S	S	*	*			trans	70.5	143.3	141.1	0	0	0	0	0	121.1
14	M	36.5	Very low	38.6	Very low	158 Å²	158	122.3 Å²	122.3	78%	0.778	76%	0.762	S	S	*	*			cis	-161.1	142.2	-12.9	-123.9	173.2	70.5	0	0	114.3
15	L	35	Very low	38.1	Very low	156 Å²	156	123.2 Å²	123.2	82%	0.817	76%	0.762	S	S	*	*			trans	75.9	153.1	143.2	-135	70	0	0	0	122.3
16	A	39.6	Very low	37	Very low	77 Å²	77	128.2 Å²	128.2	64%	0.636	77%	0.774	S	S	*	*			trans	68.5	96.5	169.8	0	0	0	0	0	118.2
17	T	36.3	Very low	36.7	Very low	140 Å²	140	128.6 Å²	128.6	86%	0.859	78%	0.776	S	S	*	*				67.5	134.2	69.5	66.8	0	0	0	0	115.8
18	A	38.4	Very low	36.7	Very low	79 Å²	79	126.2 Å²	126.2	65%	0.653	77%	0.774	S	S	*	*			cis	-171.4	151	-8.8	0	0	0	0	0	112
19	Q	40.5	Very low	36.9	Very low	179 Å²	179	126.2 Å²	126.2	84%	0.836	77%	0.773	S	S	*	*			trans	53.2	155.8	139	-63.9	-178.8	11.2	0	0	121.4
20	T	37.5	Very low	37	Very low	132 Å²	132	128.2 Å²	128.2	81%	0.81	78%	0.776	S	S	*	*			cis	-167.3	169.8	-14.9	26.5	0	0	0	0	108.5
21	G	38.1	Very low	37.1	Very low	81 Å²	81	127 Å²	127	84%	0.835	78%	0.775	S	S	*	*			trans	165.8	95	157.9	0	0	0	0	0	120.6
22	G	33.3	Very low	37	Very low	76 Å²	76	125.5 Å²	125.5	78%	0.784	77%	0.773	S	S	*	*			trans	93.9	121.6	148.5	0	0	0	0	0	119
23	P	42	Very low	37	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	78%	0.776	S	S	*	*				-147.9	168.8	121.6	39.6	-25.4	0	0	0	116.2
24	T	38.4	Very low	37.2	Very low	146 Å²	146	130.2 Å²	130.2	90%	0.896	78%	0.778	S	S	*	*			trans	65.5	169.6	156.6	42.2	0	0	0	0	119.7
25	A	34	Very low	37.1	Very low	87 Å²	87	126.9 Å²	126.9	72%	0.719	78%	0.775	S	S	*	*			trans	-135.5	164.6	-171.1	0	0	0	0	0	111.1
26	F	33.9	Very low	37.2	Very low	211 Å²	211	124.8 Å²	124.8	93%	0.925	77%	0.774	S	S	*	*			trans	-174.2	177.8	130.1	-107.9	-70.9	0	0	0	112.5
27	V	34.7	Very low	37.6	Very low	126 Å²	126	126.6 Å²	126.6	76%	0.764	78%	0.779	S	S	*	*			trans	-93.2	152	179.4	-173.9	0	0	0	0	106.7
28	A	35.9	Very low	37.5	Very low	78 Å²	78	125.5 Å²	125.5	65%	0.645	78%	0.777	S	S	*	*				175.2	145.1	74.5	0	0	0	0	0	116
29	I	35.9	Very low	37.5	Very low	147 Å²	147	126.2 Å²	126.2	75%	0.754	78%	0.777	S	S	*	*				71.3	132.6	128.3	-67.3	172.3	0	0	0	122.5
30	N	38	Very low	37.5	Very low	141 Å²	141	125.4 Å²	125.4	75%	0.754	78%	0.778	S	S	*	*			trans	98.9	135.1	149.9	-85.2	-1.5	0	0	0	125
31	N	38.9	Very low	37.9	Very low	149 Å²	149	123.7 Å²	123.7	80%	0.797	77%	0.769	S	S	*	*			trans	69.2	127	156.4	-64.6	11.7	0	0	0	121.9
32	M	31.6	Very low	38	Very low	159 Å²	159	126.4 Å²	126.4	78%	0.783	76%	0.764	S	S	*	*			trans	-104.5	150.5	169.9	-64.2	166	56.3	0	0	110
33	F	39.3	Very low	38.4	Very low	186 Å²	186	127.7 Å²	127.7	82%	0.816	76%	0.761	S	S	*	*				-174.3	166.7	106.4	-110.2	-106.5	0	0	0	109.7
34	P	44.3	Very low	38.5	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	76%	0.762	S	S	*	*			trans	-129	-145.4	-147.8	47.6	-35.5	0	0	0	115.6
35	A	34.1	Very low	38.6	Very low	87 Å²	87	124.2 Å²	124.2	72%	0.719	75%	0.754	S	S	*	*			trans	95	127.7	-178.8	0	0	0	0	0	114.4
36	S	37	Very low	38.9	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	76%	0.759	S	S	*	*			cis	94.5	153.9	28.5	-63.5	0	0	0	0	114
37	P	47.5	Very low	39.2	Very low	115 Å²	115	122.9 Å²	122.9	75%	0.747	75%	0.748	S	S	*	*			cis	-140.1	-148	-40.4	41.6	-23.1	0	0	0	112.1
38	S	35	Very low	39.3	Very low	117 Å²	117	124.3 Å²	124.3	82%	0.818	75%	0.751	S	S	*	*			trans	83.7	156.4	170.8	85.7	0	0	0	0	116.2
39	S	38.1	Very low	39.3	Very low	94 Å²	94	124.7 Å²	124.7	66%	0.657	75%	0.748	S	S	*	*			cis	-156.4	139.2	13.3	62.3	0	0	0	0	116.5
40	L	40.1	Very low	39.2	Very low	162 Å²	162	126 Å²	126	85%	0.848	75%	0.754	S	S	*	*			trans	66.5	-178.8	136.7	-64.3	168.8	0	0	0	119.1
41	P	46.4	Very low	38.9	Very low	96 Å²	96	123.8 Å²	123.8	62%	0.623	75%	0.749	S	S	*	*				-141.3	-166	-77	43.7	-25.9	0	0	0	117.1
42	N	40.2	Very low	38.8	Very low	138 Å²	138	122.1 Å²	122.1	74%	0.738	75%	0.745	S	S	*	*			trans	100.7	97.2	154.1	-61.2	-18.3	0	0	0	122
43	S	41.2	Very low	38.7	Very low	102 Å²	102	121.3 Å²	121.3	71%	0.713	74%	0.743	S	S	*	*				13.2	173	107.4	77.7	0	0	0	0	121.8
44	P	44.1	Very low	38.6	Very low	118 Å²	118	120.8 Å²	120.8	77%	0.766	75%	0.745	S	S	*	*			cis	-141.3	166.3	3.2	40.5	-22.1	0	0	0	118.5
45	G	40.4	Very low	38.2	Very low	72 Å²	72	123.9 Å²	123.9	74%	0.742	75%	0.752	S	S	*	*			trans	81.5	166.5	130.2	0	0	0	0	0	120.5
46	T	40.5	Very low	38.7	Very low	133 Å²	133	124.5 Å²	124.5	82%	0.816	75%	0.749	S	S	*	*			cis	-160.3	154.8	-14.7	-38.3	0	0	0	0	107
47	I	39.4	Very low	38.5	Very low	136 Å²	136	124.2 Å²	124.2	70%	0.697	75%	0.747	S	S	*	*				158.2	125.9	102.6	-78	-155.7	0	0	0	109.3
48	L	37.4	Very low	37.6	Very low	157 Å²	157	125.3 Å²	125.3	82%	0.822	75%	0.747	S	S	*	*			trans	48.2	158.2	149.9	-59.3	173.5	0	0	0	121.8
49	S	36.7	Very low	37.6	Very low	85 Å²	85	126 Å²	126	59%	0.594	74%	0.74	S	S	*	*			cis	-175.4	154.8	-23.2	55.5	0	0	0	0	111
50	M	32.8	Very low	37.3	Very low	175 Å²	175	127.9 Å²	127.9	86%	0.862	74%	0.743	S	S	*	*			trans	39.2	148.3	135.9	-61.5	175.5	-176.2	0	0	121.6
51	S	32.6	Very low	37.1	Very low	95 Å²	95	124.2 Å²	124.2	66%	0.664	73%	0.731	S	S	*	*			cis	-175.9	-176.5	-9.1	-92.3	0	0	0	0	108.7
52	T	36.1	Very low	36.5	Very low	114 Å²	114	124.3 Å²	124.3	70%	0.699	73%	0.729	S	S	*	*			trans	68.6	112.5	156.8	51.1	0	0	0	0	122.1
53	N	30	Very low	36.1	Very low	141 Å²	141	125.6 Å²	125.6	75%	0.754	73%	0.731	S	S	*	*				78	147.1	120.1	-56.8	-8.5	0	0	0	123.5
54	M	36.7	Very low	35.6	Very low	175 Å²	175	125.8 Å²	125.8	86%	0.862	73%	0.728	S	S	*	*			trans	81.5	98.7	154.3	-53.7	-132	165.5	0	0	120.3
55	M	36.7	Very low	35.3	Very low	176 Å²	176	127.6 Å²	127.6	87%	0.867	73%	0.731	S	S	*	*				-10.8	165.3	121.7	-82.8	-178	158.2	0	0	118.4
56	P	44.1	Very low	34.8	Very low	100 Å²	100	131.3 Å²	131.3	65%	0.649	73%	0.733	S	S	*	*			cis	-140.6	-156.8	-29.8	38.3	-18.5	0	0	0	111.5
57	S	32.1	Very low	34.7	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	73%	0.73	S	S	*	*			trans	67.8	160.2	158.3	33	0	0	0	0	116.8
58	N	29.9	Very low	34.5	Very low	137 Å²	137	127 Å²	127	73%	0.733	73%	0.728	S	S	*	*			cis	-173.8	-168.8	-20.1	179.1	13.9	0	0	0	104.2
59	I	33.4	Very low	34.1	Very low	132 Å²	132	124.8 Å²	124.8	68%	0.677	73%	0.726	S	S	*	*			trans	71.8	119.4	156.8	-63.2	168.9	0	0	0	113.1
60	N	33.2	Very low	33.8	Very low	133 Å²	133	129.6 Å²	129.6	71%	0.711	74%	0.736	S	S	*	*			cis	-166.6	174.8	10.4	-140	-4.9	0	0	0	112.8
61	S	34.2	Very low	34	Very low	85 Å²	85	128.4 Å²	128.4	59%	0.594	73%	0.732	S	S	*	*			trans	67.5	146	137.8	-68.2	0	0	0	0	121.2
62	T	34	Very low	33.9	Very low	98 Å²	98	131.7 Å²	131.7	60%	0.601	74%	0.742	S	S	*	*			cis	-170.9	142.2	-17.6	22.8	0	0	0	0	108
63	Q	31.8	Very low	34.6	Very low	166 Å²	166	130.7 Å²	130.7	78%	0.776	74%	0.737	S	S	*	*			trans	65.5	160.8	141.8	-64.4	176.2	35.3	0	0	116.5
64	T	32.2	Very low	35.5	Very low	106 Å²	106	129.3 Å²	129.3	65%	0.65	74%	0.736	S	S	*	*			cis	-157	165.5	-6.7	6.2	0	0	0	0	110.7
65	L	36.3	Very low	35.4	Very low	156 Å²	156	125.8 Å²	125.8	82%	0.817	73%	0.725	S	S	*	*			trans	62.8	103.3	144.7	-69.4	164.6	0	0	0	121
66	N	30.7	Very low	35.4	Very low	149 Å²	149	124.7 Å²	124.7	80%	0.797	72%	0.722	S	S	*	*				-21.1	168.2	121.3	-121.4	-5.3	0	0	0	116.3
67	P	39.3	Very low	35	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	73%	0.732	S	S	*	*			cis	-138.6	-165.4	-3.3	43.2	-24.6	0	0	0	114.1
68	G	33.7	Very low	35.5	Very low	63 Å²	63	129.3 Å²	129.3	65%	0.649	73%	0.73	S	S	*	*			trans	115.7	124.9	163.9	0	0	0	0	0	112.5
69	S	29.7	Very low	36.2	Very low	111 Å²	111	128 Å²	128	78%	0.776	73%	0.729	S	S	*	*			cis	79.1	149.7	47.1	-60.6	0	0	0	0	114.3
70	F	31.2	Very low	36.2	Very low	186 Å²	186	129 Å²	129	82%	0.816	74%	0.736	S	S	*	*			trans	92.6	116.7	169	-64.7	-76.6	0	0	0	119.9
71	L	36.3	Very low	36.6	Very low	150 Å²	150	127.9 Å²	127.9	79%	0.785	74%	0.736	S	S	*	*			trans	70	113.9	148.6	-53.9	166.5	0	0	0	116.5
72	L	31.2	Very low	36.8	Very low	164 Å²	164	128.3 Å²	128.3	86%	0.859	75%	0.745	S	S	*	*				61.7	144.5	57.1	-68.9	174.4	0	0	0	114.7
73	P	48.8	Very low	36.6	Very low	93 Å²	93	130.2 Å²	130.2	60%	0.604	75%	0.751	S	S	*	*			trans	-108.4	-174.1	-145.2	43.6	-39	0	0	0	114.1
74	P	50.4	Low	36.5	Very low	113 Å²	113	129.2 Å²	129.2	73%	0.734	75%	0.75	S	S	*	*			trans	-105.7	133.1	130.2	-8	27.8	0	0	0	109.3
75	T	33.4	Very low	36.2	Very low	101 Å²	101	130.1 Å²	130.1	62%	0.62	76%	0.756	S	S	*	*				54.8	126.4	59.5	79.5	0	0	0	0	111.7
76	N	37.8	Very low	35.8	Very low	152 Å²	152	128.1 Å²	128.1	81%	0.813	75%	0.753	S	S	*	*				-149.9	128.6	67.5	-78.7	-27.2	0	0	0	115.5
77	F	35	Very low	35.9	Very low	196 Å²	196	127.7 Å²	127.7	86%	0.86	76%	0.756	S	S	*	*			trans	-60.6	-168.2	142.6	-83.6	-94.9	0	0	0	111.2
78	P	42.3	Very low	35.8	Very low	109 Å²	109	128.5 Å²	128.5	71%	0.708	76%	0.759	S	S	*	*			cis	-126.9	-142.1	-9.5	28.4	-2.8	0	0	0	109.4
79	P	45.8	Very low	35.9	Very low	111 Å²	111	130.5 Å²	130.5	72%	0.721	76%	0.761	S	S	*	*			cis	-108.9	168.7	-37.3	10	14.2	0	0	0	111.7
80	N	32.5	Very low	36	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	76%	0.762	S	S	*	*			cis	77	169	41.5	-129.7	16.8	0	0	0	113.3
81	P	42.4	Very low	36.2	Very low	109 Å²	109	128.7 Å²	128.7	71%	0.708	76%	0.758	S	S	*	*				-130.9	164.7	-115.4	40.1	-21.8	0	0	0	116.7
82	A	37.7	Very low	36.1	Very low	95 Å²	95	126.7 Å²	126.7	79%	0.785	76%	0.757	S	S	*	*			trans	-155.6	133.8	153.7	0	0	0	0	0	108.2
83	N	29.2	Very low	36.7	Very low	137 Å²	137	123.9 Å²	123.9	73%	0.733	75%	0.748	S	S	*	*			cis	86.1	117.8	22.9	-149.9	23	0	0	0	114.6
84	L	29.6	Very low	36.5	Very low	146 Å²	146	124.5 Å²	124.5	76%	0.764	75%	0.752	S	S	*	*			trans	74	149.6	162.9	-52.9	175.8	0	0	0	121.8
85	T	27.9	Very low	35.8	Very low	124 Å²	124	127 Å²	127	76%	0.761	75%	0.754	S	S	*	*			trans	91.7	92.6	150.3	-31.1	0	0	0	0	119.3
86	C	26.5	Very low	35.9	Very low	114 Å²	114	128 Å²	128	77%	0.77	76%	0.755	S	S	*	*			trans	1	132.3	133.8	-45.4	0	0	0	0	118.5
87	T	33.4	Very low	35.8	Very low	140 Å²	140	128.2 Å²	128.2	86%	0.859	75%	0.751	S	S	*	*				-159.6	140	121.3	1.2	0	0	0	0	112.3
88	V	36.4	Very low	35.7	Very low	132 Å²	132	124.5 Å²	124.5	80%	0.8	75%	0.745	S	S	*	*			trans	-97.4	129.9	165.6	179.1	0	0	0	0	107.3
89	P	36.9	Very low	35.6	Very low	106 Å²	106	124.7 Å²	124.7	69%	0.688	75%	0.746	S	S	*	*				-119.2	151.1	118.8	-6.4	27.1	0	0	0	111.4
90	L	30.6	Very low	35.2	Very low	154 Å²	154	126.5 Å²	126.5	81%	0.806	75%	0.748	S	S	*	*				62.3	128.5	68.4	-126.7	73	0	0	0	111.4
91	S	36.3	Very low	35.1	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	75%	0.749	S	S	*	*			cis	-151.9	150.5	29.2	-54.1	0	0	0	0	114.7
92	S	34.3	Very low	35	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	75%	0.748	S	S	*	*			trans	-79	-162.3	157	57.6	0	0	0	0	110.6
93	P	44.4	Very low	34.6	Very low	106 Å²	106	130 Å²	130	69%	0.688	75%	0.745	S	S	*	*			cis	-125.5	-141.4	-9.2	43.9	-23.6	0	0	0	109.3
94	P	43.8	Very low	34.7	Very low	106 Å²	106	132 Å²	132	69%	0.688	75%	0.747	S	S	*	*			cis	-112.4	154.2	-17.5	13	13.1	0	0	0	114.2
95	Q	36.3	Very low	34.9	Very low	165 Å²	165	129.1 Å²	129.1	77%	0.771	75%	0.745	S	S	*	*				62.5	144.3	84.1	-49.1	-158.3	25.8	0	0	114.5
96	L	35.4	Very low	35.5	Very low	122 Å²	122	128.4 Å²	128.4	64%	0.639	74%	0.742	S	S	*	*			cis	-142.7	153.8	30.6	-73.7	160.4	0	0	0	114
97	Q	35.2	Very low	35.7	Very low	157 Å²	157	128.4 Å²	128.4	73%	0.734	74%	0.739	S	S	*	*			trans	46.5	143.9	132.7	-59.6	173.7	-46.2	0	0	121.4
98	T	33.3	Very low	35.6	Very low	117 Å²	117	127.3 Å²	127.3	72%	0.718	74%	0.737	S	S	*	*			cis	-161.6	155.3	-3.8	12.6	0	0	0	0	110
99	P	38.7	Very low	35.5	Very low	114 Å²	114	124.3 Å²	124.3	74%	0.74	73%	0.733	S	S	*	*			trans	-84.6	178.3	165.3	38.5	-36.3	0	0	0	111.8
100	I	37.8	Very low	35.1	Very low	149 Å²	149	127.1 Å²	127.1	76%	0.764	74%	0.742	S	S	*	*			trans	160.9	96.5	156.3	-88.3	154	0	0	0	104.9
101	L	31.6	Very low	35.3	Very low	160 Å²	160	127.6 Å²	127.6	84%	0.838	75%	0.745	S	S	*	*				84.1	155.9	91.1	-76	172.4	0	0	0	113.1
102	P	39.7	Very low	35.2	Very low	103 Å²	103	130.8 Å²	130.8	67%	0.669	75%	0.75	S	S	*	*			trans	-110.8	-142.6	-152.8	43.4	-35.3	0	0	0	112.6
103	F	28.3	Very low	35.6	Very low	165 Å²	165	130.2 Å²	130.2	72%	0.724	74%	0.744	S	S	*	*			trans	97.6	147	161.6	-87	-72.4	0	0	0	120.4
104	F	32.3	Very low	34.9	Very low	179 Å²	179	129.1 Å²	129.1	79%	0.785	74%	0.739	S	S	*	*			trans	65	101.6	158.5	-58.8	-52.3	0	0	0	121.1
105	A	33.9	Very low	34.2	Very low	86 Å²	86	131.3 Å²	131.3	71%	0.711	74%	0.744	S	S	*	*			trans	-60.4	171.3	132	0	0	0	0	0	110.1
106	P	40.9	Very low	34	Very low	109 Å²	109	128 Å²	128	71%	0.708	74%	0.739	S	S	*	*			cis	-153.9	-156.3	34.1	38.3	-11.9	0	0	0	116.7
107	T	30.8	Very low	33.9	Very low	114 Å²	114	127.6 Å²	127.6	70%	0.699	75%	0.747	S	S	*	*			trans	70.2	105.6	147.1	39.4	0	0	0	0	121.8
108	S	31.4	Very low	33.7	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	74%	0.741	S	S	*	*				51.6	133.9	116.9	68	0	0	0	0	122.4
109	G	33.6	Very low	33.6	Very low	70 Å²	70	126.6 Å²	126.6	72%	0.722	75%	0.748	S	S	*	*			trans	156.4	77.6	169.9	0	0	0	0	0	109.7
110	N	28.7	Very low	33.4	Very low	164 Å²	164	126.2 Å²	126.2	88%	0.877	75%	0.748	S	S	*	*				41.1	99.9	83.7	-87	4.6	0	0	0	114.2
111	L	35.3	Very low	33.2	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	75%	0.752	S	S	*	*			trans	-179.9	109.2	138.8	-92.2	158.3	0	0	0	105.1
112	M	32.9	Very low	33.8	Very low	170 Å²	170	125 Å²	125	84%	0.837	75%	0.747	S	S	*	*				58.6	141	66.1	-76.7	-118.1	163.1	0	0	114.7
113	P	42.3	Very low	33.9	Very low	97 Å²	97	124.9 Å²	124.9	63%	0.63	75%	0.748	S	S	*	*			cis	-145	-166	-30.1	35.6	-14.1	0	0	0	113.8
114	S	31	Very low	34.6	Very low	82 Å²	82	122.1 Å²	122.1	57%	0.573	75%	0.747	S	S	*	*			trans	66.4	128.3	135.6	70.6	0	0	0	0	121.2
115	N	28.6	Very low	34.7	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	76%	0.755	S	S	*	*			trans	67.5	160.8	141.5	-51.5	-10	0	0	0	115.6
116	S	32.2	Very low	34.8	Very low	95 Å²	95	123.8 Å²	123.8	66%	0.664	76%	0.762	S	S	*	*			cis	-148	157.6	12.7	-37.7	0	0	0	0	110.1
117	S	33	Very low	34.7	Very low	115 Å²	115	123.1 Å²	123.1	80%	0.804	77%	0.765	S	S	*	*			trans	64	154.7	135.3	-64.6	0	0	0	0	119.8
118	S	31.4	Very low	35.4	Very low	85 Å²	85	122.9 Å²	122.9	59%	0.594	77%	0.766	S	S	*	*			cis	-179.4	150.3	-18.4	53.5	0	0	0	0	107.5
119	L	31.3	Very low	35.6	Very low	167 Å²	167	125 Å²	125	87%	0.874	77%	0.765	S	S	*	*			trans	66.8	156.5	156.8	-63.1	159.6	0	0	0	114.7
120	S	35.3	Very low	35.6	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	76%	0.757	S	S	*	*			cis	-153.6	158	-7.7	38.7	0	0	0	0	111.5
121	M	33.8	Very low	35.7	Very low	173 Å²	173	124.6 Å²	124.6	85%	0.852	75%	0.747	S	S	*	*			trans	-62.9	176.6	154.8	-69	-73.4	165	0	0	110.7
122	P	42.3	Very low	35.5	Very low	112 Å²	112	125.8 Å²	125.8	73%	0.727	75%	0.746	S	S	*	*			cis	-136.6	-173.7	8.1	37.3	-15.8	0	0	0	116
123	S	41.7	Very low	35.5	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	75%	0.746	S	S	*	*			trans	-57.6	164.4	153.2	57.2	0	0	0	0	112.9
124	P	43.9	Very low	35.1	Very low	108 Å²	108	128.2 Å²	128.2	70%	0.701	76%	0.756	S	S	*	*				-155.5	159.2	88.4	39.6	-20.4	0	0	0	118.4
125	F	34.3	Very low	35.5	Very low	216 Å²	216	129.9 Å²	129.9	95%	0.947	76%	0.764	S	S	*	*			trans	48.4	137.5	138.3	-75.3	-122.6	0	0	0	122.6
126	G	36.3	Very low	35.7	Very low	83 Å²	83	125.5 Å²	125.5	86%	0.856	76%	0.756	S	S	*	*			trans	170.6	99.4	161.7	0	0	0	0	0	115.3
127	A	38	Very low	35.8	Very low	95 Å²	95	129.9 Å²	129.9	79%	0.785	77%	0.765	S	S	*	*			trans	-141.7	-176.9	172.7	0	0	0	0	0	108.6
128	P	46.5	Very low	36	Very low	110 Å²	110	128.5 Å²	128.5	71%	0.714	76%	0.755	S	S	*	*			cis	-124.5	-152.4	-25.1	24.4	0.4	0	0	0	110.3
129	M	36	Very low	36.2	Very low	161 Å²	161	131.7 Å²	131.7	79%	0.793	77%	0.766	S	S	*	*			trans	75.1	151.6	160.8	-56.5	-167.1	77.8	0	0	117
130	S	32.4	Very low	36.6	Very low	79 Å²	79	129 Å²	129	55%	0.552	76%	0.761	S	S	*	*			cis	-173.6	168	-17.9	51.4	0	0	0	0	111.6
131	H	32.2	Very low	36.7	Very low	146 Å²	146	131.4 Å²	131.4	68%	0.676	77%	0.765	S	S	*	*			trans	77.1	114.3	147.9	-68.3	-43.9	0	0	0	122.9
132	F	29.5	Very low	37.1	Very low	191 Å²	191	127.9 Å²	127.9	84%	0.838	76%	0.755	S	S	*	*			trans	72.8	164.8	133.1	-80.9	-78.5	0	0	0	123
133	V	34.8	Very low	36.7	Very low	139 Å²	139	127.2 Å²	127.2	84%	0.842	75%	0.749	S	S	*	*			trans	90.9	87.9	162.1	-163.2	0	0	0	0	119.1
134	H	32.4	Very low	36.4	Very low	178 Å²	178	131.4 Å²	131.4	82%	0.824	76%	0.755	S	S	*	*			trans	-70.9	174.5	143.4	-120.4	-33.2	0	0	0	110
135	P	40.7	Very low	35.8	Very low	117 Å²	117	130.7 Å²	130.7	76%	0.76	75%	0.753	S	S	*	*			cis	-125.5	-167.3	-29.6	40.4	-24.7	0	0	0	111.3
136	G	32.4	Very low	35.7	Very low	61 Å²	61	125.1 Å²	125.1	63%	0.629	74%	0.74	S	S	*	*			trans	159.3	118.9	156	0	0	0	0	0	119.3
137	H	34.9	Very low	35.5	Very low	186 Å²	186	126.1 Å²	126.1	86%	0.861	73%	0.734	S	S	*	*				22.5	139.6	129	-57.3	-67.7	0	0	0	119.9
138	S	36.9	Very low	35.1	Very low	86 Å²	86	127.8 Å²	127.8	60%	0.601	73%	0.734	S	S	*	*			cis	179.2	177.9	13.1	45.5	0	0	0	0	111.1
139	N	34.9	Very low	34.3	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	73%	0.734	S	S	*	*			trans	70.3	146.6	155.1	-60.9	-18.4	0	0	0	118
140	S	39.4	Very low	34	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	73%	0.732	S	S	*	*			cis	-153.7	148.5	-6.7	47.1	0	0	0	0	113.9
141	L	37.2	Very low	33.9	Very low	157 Å²	157	127.5 Å²	127.5	82%	0.822	75%	0.745	S	S	*	*			trans	-27.3	170.9	143.3	-110.7	67.6	0	0	0	116.7
142	P	42.9	Very low	34.1	Very low	98 Å²	98	124.6 Å²	124.6	64%	0.636	76%	0.755	S	S	*	*			cis	-148.6	170.8	8.5	36.5	-13.3	0	0	0	120.6
143	T	33.4	Very low	34.4	Very low	99 Å²	99	123 Å²	123	61%	0.607	76%	0.755	S	S	*	*			trans	73.7	146.9	133.6	48.4	0	0	0	0	126.5
144	F	35.5	Very low	34.8	Very low	187 Å²	187	121.1 Å²	121.1	82%	0.82	75%	0.746	S	S	*	*			trans	71.4	148.3	145.2	-62.2	-39.5	0	0	0	120.2
145	S	30.6	Very low	35	Very low	93 Å²	93	117.8 Å²	117.8	65%	0.65	74%	0.742	S	S	*	*			cis	-168.6	149.3	-36.7	-138.9	0	0	0	0	111.4
146	S	33	Very low	34.8	Very low	99 Å²	99	117.7 Å²	117.7	69%	0.692	74%	0.74	S	S	*	*			trans	59.1	127.3	141.7	-49.9	0	0	0	0	122.2
147	S	31.9	Very low	34.9	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	75%	0.75	S	S	*	*				80.3	118.1	124.5	66	0	0	0	0	123.4
148	V	29.7	Very low	35.1	Very low	130 Å²	130	117.8 Å²	117.8	79%	0.788	74%	0.736	S	S	*	*				84.8	105	119.4	173.8	0	0	0	0	120.2
149	S	30.2	Very low	35.1	Very low	101 Å²	101	118.4 Å²	118.4	71%	0.706	74%	0.737	S	S	*	*			trans	81.6	158.1	134	-69.8	0	0	0	0	124.2
150	T	29.9	Very low	35	Very low	125 Å²	125	112.7 Å²	112.7	77%	0.767	71%	0.709	S	S	*	*			trans	76.1	101.8	150.6	29.4	0	0	0	0	120.7
151	S	30.6	Very low	34.8	Very low	118 Å²	118	111.7 Å²	111.7	83%	0.825	69%	0.694	S	S	*	*				43.5	114.9	127	60.5	0	0	0	0	120.3
152	G	35.1	Very low	34.7	Very low	85 Å²	85	112.8 Å²	112.8	88%	0.876	69%	0.693	S	S	*	*			trans	-164.8	76.9	170.9	0	0	0	0	0	114.6
153	N	35.5	Very low	34.6	Very low	158 Å²	158	113.2 Å²	113.2	85%	0.845	70%	0.695	S	S	*	*			trans	-90.9	168.3	164.4	-144.2	9.2	0	0	0	108.2
154	P	44.1	Very low	34.6	Very low	100 Å²	100	113.8 Å²	113.8	65%	0.649	70%	0.703	S	S	*	*			cis	-128.8	-167.4	-13.5	42.4	-26.5	0	0	0	112.6
155	S	36.2	Very low	34.5	Very low	107 Å²	107	111.7 Å²	111.7	75%	0.748	70%	0.701	S	S	*	*			trans	-175.2	123.1	134	-84.4	0	0	0	0	116.7
156	T	36	Very low	34.5	Very low	116 Å²	116	113.6 Å²	113.6	71%	0.712	70%	0.703	S	S	*	*			trans	55.6	96.2	142.9	58.2	0	0	0	0	124
157	L	35.9	Very low	34.4	Very low	160 Å²	160	117.1 Å²	117.1	84%	0.838	71%	0.709	S	S	*	*				57.6	160.7	103.8	-64	172.3	0	0	0	122.1
158	P	38.8	Very low	34.4	Very low	88 Å²	88	120.5 Å²	120.5	57%	0.571	72%	0.716	S	S	*	*			cis	-138	-129.2	-38.5	39.4	-19.9	0	0	0	114	K557	P158-K557 PolarHBondContact O-NZ 3.4Å
159	V	37.3	Very low	34.9	Very low	100 Å²	100	119.3 Å²	119.3	61%	0.606	71%	0.71	S	S	*	*			trans	71.9	130.2	170.5	-169.9	0	0	0	0	120.1	N555 K557	V159-N555 WeakPolarHBondContact CA-OD1 3.16Å; V159-K557 WeakPolarHBondContact O-CD 3.44Å; V159-K557 VanDerWaalsContact O-CE 3.32Å; V159-K557 WeakPolarHBondContact O-CE 2.95Å; V159-K557 PolarHBondContact O-NZ 3.26Å
160	S	32	Very low	35	Very low	33 Å²	33	119.8 Å²	119.8	23%	0.231	71%	0.714	C	S	.	*			trans	-178	168.8	159.2	60.8	0	0	0	0	114.4	N555 G556 K557	S160-N555 PolarHBondContact N-OD1 3.41Å; S160-N555 WeakPolarHBondContact O-CA 3.42Å; S160-N555 PolarHBondContact O-N 2.9Å; S160-N555 VanDerWaalsContact O-N 3.09Å; S160-N555 PolarHBondContact O-OD1 2.89Å; S160-G556 WeakPolarHBondContact OG-CA 3.39Å; S160-K557 WeakPolarHBondContact OG-CA 3.39Å; S160-K557 WeakPolarHBondContact OG-CB 3.3Å; S160-K557 VanDerWaalsContact OG-CG 3.32Å; S160-K557 WeakPolarHBondContact OG-CG 3.18Å
161	L	35.4	Very low	35.1	Very low	88 Å²	88	117.4 Å²	117.4	46%	0.461	71%	0.714	S	S	.	*			trans	-179.1	142.7	138.3	-102.2	-167.6	0	0	0	113.3	N555	L161-N555 VanDerWaalsContact CG-C 3.49Å; L161-N555 VanDerWaalsContact CG-N 3.33Å
162	F	34.8	Very low	35.1	Very low	181 Å²	181	119.5 Å²	119.5	79%	0.794	71%	0.714	S	S	*	*			trans	26.4	162.4	131.3	-80.3	-112.1	0	0	0	124.9
163	P	41.1	Very low	34.9	Very low	107 Å²	107	122.8 Å²	122.8	70%	0.695	71%	0.711	S	S	*	*			trans	-121.5	175	-158.9	43.8	-32.1	0	0	0	116.3
164	S	34	Very low	34.8	Very low	111 Å²	111	120.6 Å²	120.6	78%	0.776	71%	0.708	S	S	*	*			trans	-173.4	142.3	139.3	-85.3	0	0	0	0	115.6
165	N	32.7	Very low	34.5	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	71%	0.714	S	S	*	*			trans	57.6	133	146.1	-70.9	-2.4	0	0	0	125.1
166	N	30.3	Very low	34.6	Very low	133 Å²	133	124.3 Å²	124.3	71%	0.711	72%	0.717	S	S	*	*			trans	81.2	112.7	134.5	-71.3	7.3	0	0	0	123
167	Q	30.8	Very low	35	Very low	174 Å²	174	124 Å²	124	81%	0.813	72%	0.718	S	S	*	*				92.1	107.5	122.7	-158.7	161.6	8.2	0	0	119.7
168	M	33	Very low	35.1	Very low	174 Å²	174	124 Å²	124	86%	0.857	72%	0.715	S	S	*	*			trans	1.3	158.3	135.8	-95.5	-172.1	166.8	0	0	120.6
169	P	40.2	Very low	35.1	Very low	104 Å²	104	125.1 Å²	125.1	68%	0.675	72%	0.72	S	S	*	*			cis	-139.1	-166.1	5.7	35.3	-12.5	0	0	0	115.6
170	S	32.3	Very low	35	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	73%	0.725	S	S	*	*			trans	77.3	75.7	147.3	-58.2	0	0	0	0	121.5
171	G	30.3	Very low	35.2	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	75%	0.75	S	S	*	*				93.9	173.3	110.8	0	0	0	0	0	121.7
172	I	31.4	Very low	35.2	Very low	161 Å²	161	131.5 Å²	131.5	83%	0.826	76%	0.758	S	S	*	*			trans	82.4	114.2	162.4	-52	-179.2	0	0	0	118.4
173	L	30.2	Very low	35.2	Very low	155 Å²	155	130.2 Å²	130.2	81%	0.812	76%	0.759	S	S	*	*			trans	70.1	145.2	158.3	-102	68.2	0	0	0	122.7
174	S	33.2	Very low	34.9	Very low	111 Å²	111	130.3 Å²	130.3	78%	0.776	76%	0.759	S	S	*	*			trans	61.8	137.6	159	-68.3	0	0	0	0	119.3
175	S	38.5	Very low	34.8	Very low	112 Å²	112	131.5 Å²	131.5	78%	0.783	76%	0.762	S	S	*	*			cis	-154.7	147.2	-3.8	45.8	0	0	0	0	112.3
176	Q	39.1	Very low	34.7	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	76%	0.758	S	S	*	*			trans	-67.2	170.4	162.5	-84.4	-158.8	22.5	0	0	111.3
177	P	43.8	Very low	34.7	Very low	110 Å²	110	131.2 Å²	131.2	71%	0.714	76%	0.763	S	S	*	*			cis	-130.1	-171.2	21.8	36.5	-12.9	0	0	0	113.3
178	M	37.6	Very low	34.7	Very low	160 Å²	160	127.7 Å²	127.7	79%	0.788	76%	0.757	S	S	*	*			cis	-141.9	147.3	23.5	-75	-179	70.6	0	0	115.6
179	V	38.7	Very low	34.7	Very low	110 Å²	110	127.1 Å²	127.1	67%	0.667	76%	0.758	S	S	*	*			trans	-12.7	156.8	147.5	-75.1	0	0	0	0	119.7
180	L	35.4	Very low	34.3	Very low	135 Å²	135	131.3 Å²	131.3	71%	0.707	77%	0.768	S	S	*	*			cis	-153	145.9	13	-169.6	58.7	0	0	0	113.5
181	P	35.7	Very low	34.5	Very low	118 Å²	118	130.4 Å²	130.4	77%	0.766	77%	0.768	S	S	*	*			trans	-128.6	115.9	159.9	35.4	-20.4	0	0	0	114.3
182	T	35.3	Very low	34.7	Very low	103 Å²	103	134.8 Å²	134.8	63%	0.632	77%	0.768	S	S	*	*			trans	-170	156.2	175	42.5	0	0	0	0	109.3
183	L	34.7	Very low	34.9	Very low	154 Å²	154	132.8 Å²	132.8	81%	0.806	76%	0.763	S	S	*	*			cis	-166.6	159.2	-14.5	-101.6	168.3	0	0	0	107
184	P	34.6	Very low	35.1	Very low	108 Å²	108	131.9 Å²	131.9	70%	0.701	76%	0.759	S	S	*	*			trans	-89.9	156.4	166.2	36.5	-32.6	0	0	0	112.2
185	V	33.6	Very low	35.3	Very low	137 Å²	137	131.5 Å²	131.5	83%	0.83	76%	0.757	S	S	*	*			trans	-171.8	158.7	153.9	129.3	0	0	0	0	110.3	F187	V185-F187 HydrophobicContact CG1-CD2 4.45Å; V185-F187 HydrophobicContact CG1-CE2 4.25Å
186	A	29.1	Very low	35.3	Very low	83 Å²	83	132.6 Å²	132.6	69%	0.686	76%	0.759	S	S	*	*			trans	-116	154.1	-177.4	0	0	0	0	0	113.8
187	F	31.8	Very low	35.3	Very low	186 Å²	186	127.6 Å²	127.6	82%	0.816	75%	0.754	S	S	*	*			trans	-139.9	133.2	160.9	-80.9	-92.4	0	0	0	106.7	V185	V185-F187 HydrophobicContact CG1-CD2 4.45Å; V185-F187 HydrophobicContact CG1-CE2 4.25Å
188	S	31.1	Very low	35.1	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	76%	0.757	S	S	*	*			cis	74.3	95.9	31.3	-60.1	0	0	0	0	115.9
189	N	33.1	Very low	35.1	Very low	162 Å²	162	128.2 Å²	128.2	87%	0.866	76%	0.758	S	S	*	*			trans	-163.4	116.5	152	-85	-38.2	0	0	0	105.1
190	Q	31.4	Very low	35.3	Very low	192 Å²	192	127.8 Å²	127.8	90%	0.897	76%	0.757	S	S	*	*			cis	87.4	86.4	30.6	-157.9	-174.5	100.9	0	0	114.8
191	A	35.3	Very low	35.5	Very low	93 Å²	93	128.5 Å²	128.5	77%	0.769	76%	0.76	S	S	*	*			trans	-166	146.1	159.9	0	0	0	0	0	108.4
192	Q	35.7	Very low	35.9	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	76%	0.758	S	S	*	*			cis	-165.5	148.4	-20.7	-125.7	176	30.9	0	0	108.8
193	T	34.6	Very low	36.1	Very low	119 Å²	119	131 Å²	131	73%	0.73	77%	0.768	S	S	*	*			trans	65.5	153.6	166.3	69.1	0	0	0	0	117.1
194	N	34.4	Very low	36.1	Very low	136 Å²	136	126.5 Å²	126.5	73%	0.727	76%	0.758	S	S	*	*			cis	-152.9	141.6	9.5	-120	-20.6	0	0	0	112.2
195	S	38.2	Very low	36.3	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	77%	0.765	S	S	*	*			trans	54.1	140.7	134.7	84.3	0	0	0	0	121.8
196	V	38.5	Very low	36.6	Very low	136 Å²	136	127 Å²	127	82%	0.824	75%	0.753	S	S	*	*			cis	-154.7	137.1	5.2	-178.3	0	0	0	0	111.1
197	G	38.5	Very low	36.8	Very low	69 Å²	69	131.7 Å²	131.7	71%	0.711	76%	0.761	S	S	*	*			trans	65.9	170.4	146.9	0	0	0	0	0	120
198	V	39.1	Very low	36.9	Very low	127 Å²	127	128.1 Å²	128.1	77%	0.77	76%	0.759	S	S	*	*			cis	-149.7	117.2	-14.3	-171.1	0	0	0	0	104.4
199	L	38.9	Very low	36.9	Very low	156 Å²	156	131 Å²	131	82%	0.817	77%	0.766	S	S	*	*				51.5	155.2	86.2	-67.8	175.7	0	0	0	115.5
200	P	42.7	Very low	37.2	Very low	100 Å²	100	128.3 Å²	128.3	65%	0.649	76%	0.758	S	S	*	*			cis	-145.8	-162.2	-41.2	39.2	-19.5	0	0	0	114.8
201	I	39.8	Very low	37.3	Very low	150 Å²	150	123.4 Å²	123.4	77%	0.769	74%	0.744	S	S	*	*			trans	109.3	140.9	147.1	-79.9	160.9	0	0	0	120.3
202	P	44.5	Very low	37.1	Very low	110 Å²	110	126.1 Å²	126.1	71%	0.714	75%	0.746	S	S	*	*			trans	-131.7	-125.6	-162.2	41.2	-17.7	0	0	0	113.8
203	I	37.6	Very low	37	Very low	165 Å²	165	122.5 Å²	122.5	85%	0.846	74%	0.739	S	S	*	*			trans	91.4	131.7	-177.5	-52.7	155.1	0	0	0	112.8
204	G	36.4	Very low	36.9	Very low	59 Å²	59	123.5 Å²	123.5	61%	0.608	74%	0.739	S	S	*	*			cis	-161	155.9	-5.3	0	0	0	0	0	109.4
205	I	38.9	Very low	36.9	Very low	166 Å²	166	122.4 Å²	122.4	85%	0.851	74%	0.737	S	S	*	*				73.2	129.6	57.2	-66.7	174.2	0	0	0	112.5
206	P	38.4	Very low	36.8	Very low	88 Å²	88	125.4 Å²	125.4	57%	0.571	74%	0.739	S	S	*	*			cis	-146.7	-171.6	-24.5	41.4	-20.6	0	0	0	115.9
207	Q	33.4	Very low	36.7	Very low	183 Å²	183	123.4 Å²	123.4	86%	0.855	73%	0.728	S	S	*	*			trans	61.3	162.4	143.1	-77	151.1	16.3	0	0	120.6
208	S	34.9	Very low	36.7	Very low	111 Å²	111	125.6 Å²	125.6	78%	0.776	73%	0.727	S	S	*	*			cis	-158.5	170.4	-9.5	46.3	0	0	0	0	112.8
209	L	30.5	Very low	36.5	Very low	159 Å²	159	125.9 Å²	125.9	83%	0.832	73%	0.725	S	S	*	*			trans	-56.1	177.4	161.4	-98.3	70.6	0	0	0	113.8
210	P	39.3	Very low	36.1	Very low	106 Å²	106	122 Å²	122	69%	0.688	71%	0.71	S	S	*	*			cis	-142.7	-166.9	14.5	39.9	-18	0	0	0	117.4
211	S	34.2	Very low	35.6	Very low	89 Å²	89	125.7 Å²	125.7	62%	0.622	72%	0.717	S	S	*	*			trans	82.9	123.6	138.3	-72.9	0	0	0	0	123.7
212	N	31.4	Very low	35	Very low	150 Å²	150	126 Å²	126	80%	0.802	72%	0.719	S	S	*	*				61.7	142.4	126.1	-61.1	-3.6	0	0	0	120.7
213	S	33.1	Very low	34.4	Very low	90 Å²	90	126.9 Å²	126.9	63%	0.629	72%	0.722	S	S	*	*			cis	-175.9	174.3	-1.7	45.6	0	0	0	0	112
214	I	32.6	Very low	33.9	Very low	141 Å²	141	123.9 Å²	123.9	72%	0.723	72%	0.716	S	S	*	*			trans	82.1	110.8	150.6	-78.2	159.5	0	0	0	118.4
215	T	33.8	Very low	33.6	Very low	112 Å²	112	126.1 Å²	126.1	69%	0.687	72%	0.722	S	S	*	*			trans	65.9	143.4	148.8	60	0	0	0	0	119.9
216	E	36	Very low	33.3	Very low	166 Å²	166	122.8 Å²	122.8	78%	0.776	71%	0.714	S	S	*	*			cis	-156	162.4	2.1	-129.5	178.9	-135.2	0	0	115.6
217	T	36.7	Very low	33	Very low	95 Å²	95	124.7 Å²	124.7	58%	0.583	72%	0.719	S	S	*	*			trans	65.9	85.3	144.4	-54	0	0	0	0	120.8
218	T	38.8	Very low	33	Very low	114 Å²	114	126.3 Å²	126.3	70%	0.699	72%	0.719	S	S	*	*			trans	68	155	140	67.7	0	0	0	0	120.7
219	N	35.3	Very low	33	Very low	134 Å²	134	126.6 Å²	126.6	72%	0.717	72%	0.716	S	S	*	*			cis	-161	125.2	-24.4	-97.5	-7.9	0	0	0	104.9
220	S	30.9	Very low	33.4	Very low	74 Å²	74	123.9 Å²	123.9	52%	0.517	71%	0.706	S	S	.	*				59.4	128.6	74	86.4	0	0	0	0	113.2
221	F	31.4	Very low	33.3	Very low	178 Å²	178	123.2 Å²	123.2	78%	0.781	70%	0.702	S	S	*	*			cis	-148.9	143.7	14.1	-82.5	-68.4	0	0	0	109.7
222	L	28.2	Very low	33.4	Very low	155 Å²	155	122 Å²	122	81%	0.812	69%	0.688	S	S	*	*				52.5	147.9	96.5	-62	-177.4	0	0	0	119.2
223	V	30	Very low	33.6	Very low	129 Å²	129	120.3 Å²	120.3	78%	0.782	67%	0.671	S	S	*	*			trans	86.4	97.8	158.4	-179.5	0	0	0	0	119.9
224	S	28.2	Very low	33.9	Very low	102 Å²	102	120.5 Å²	120.5	71%	0.713	67%	0.669	S	S	*	*				63.3	125.6	122.7	-50.6	0	0	0	0	125.3
225	S	29.8	Very low	34	Very low	107 Å²	107	118.3 Å²	118.3	75%	0.748	67%	0.671	S	S	*	*				81	110	129.9	-63.3	0	0	0	0	122.8
226	S	31.9	Very low	34.1	Very low	96 Å²	96	119.3 Å²	119.3	67%	0.671	68%	0.677	S	S	*	*				99	139.4	122.2	75.7	0	0	0	0	121.7
227	N	32.2	Very low	34.1	Very low	127 Å²	127	117.5 Å²	117.5	68%	0.679	67%	0.672	S	S	*	*			trans	90.2	146.2	153.6	-52.5	-40.2	0	0	0	121.1
228	Y	33.9	Very low	34	Very low	217 Å²	217	121.5 Å²	121.5	85%	0.851	68%	0.682	S	S	*	*			trans	88.9	141.9	159.3	-60	-66.9	0	0	0	122.4
229	T	35	Very low	33.9	Very low	118 Å²	118	121 Å²	121	72%	0.724	68%	0.681	S	S	*	*			trans	-57.5	148.9	-177	41.6	0	0	0	0	117.2
230	T	38.2	Very low	33.9	Very low	102 Å²	102	121.2 Å²	121.2	63%	0.626	68%	0.681	S	S	*	*			trans	-2.7	154.7	133	62.4	0	0	0	0	118.6	P386	T230-P386 HydrophobicContact CG2-CG 3.78Å
231	P	37.6	Very low	34.2	Very low	92 Å²	92	125.2 Å²	125.2	60%	0.597	70%	0.697	S	S	*	*			cis	-148.6	165.4	13.8	43.9	-23.1	0	0	0	119.6	P386	P231-P386 HydrophobicContact CB-CB 3.65Å; P231-P386 HydrophobicContact CB-CG 3.78Å
232	I	35.8	Very low	34.4	Very low	63 Å²	63	123.8 Å²	123.8	32%	0.323	70%	0.697	S	S	.	*			trans	72.9	160.2	153	2.2	171.2	0	0	0	125.9	P386 S389 H390	I232-P386 HydrophobicContact CB-CB 4.44Å; I232-P386 HydrophobicContact CG1-CB 4.07Å; I232-P386 VanDerWaalsContact CG2-C 3.4Å; I232-P386 HydrophobicContact CG2-CB 4.45Å; I232-P386 WeakPolarHBondContact CG2-O 3.31Å; I232-S389 WeakPolarHBondContact CD1-OG 3.08Å; I232-H390 WeakPolarHBondContact CD1-CD2 3.48Å; I232-H390 HydrophobicContact CG2-CB 3.48Å; I232-H390 VanDerWaalsContact CG2-CB 3.48Å
233	Y	37.3	Very low	35.3	Very low	114 Å²	114	121 Å²	121	45%	0.447	69%	0.688	S	S	.	*			trans	-77.8	178.1	-163.6	-86.6	-143.7	0	0	0	118.2	S387 H390	Y233-S387 VanDerWaalsContact CE2-OG 3.32Å; Y233-S387 WeakPolarHBondContact CE2-OG 3.46Å; Y233-S387 PolarHBondContact OH-OG 3.25Å; Y233-H390 HydrophobicContact CG-CB 4.45Å; Y233-H390 PolarHBondContact O-CE1 3.26Å; Y233-H390 PolarHBondContact O-ND1 2.91Å
234	T	38.5	Very low	35.7	Very low	95 Å²	95	120.2 Å²	120.2	58%	0.583	68%	0.684	S	S	*	*			trans	79.2	132.3	144.2	27.7	0	0	0	0	119	H390 D394	T234-H390 PolarHBondContact OG1-ND1 2.85Å; T234-H390 VanDerWaalsContact OG1-ND1 3.11Å; T234-D394 PolarHBondContact OG1-OD2 2.96Å
235	A	35.5	Very low	36.2	Very low	94 Å²	94	122.4 Å²	122.4	78%	0.777	69%	0.686	S	S	*	*			trans	-154.2	156.6	-170.9	0	0	0	0	0	111.1
236	T	34.6	Very low	36.4	Very low	133 Å²	133	125.2 Å²	125.2	82%	0.816	69%	0.692	S	S	*	*			trans	-151.5	157.1	171.7	53.1	0	0	0	0	110.3
237	L	36.2	Very low	36.7	Very low	129 Å²	129	125.9 Å²	125.9	68%	0.675	69%	0.694	S	S	*	*			cis	-164.3	149.2	-27.9	-104.8	-176.4	0	0	0	109.2
238	F	35.1	Very low	36.8	Very low	178 Å²	178	127.6 Å²	127.6	78%	0.781	70%	0.702	S	S	*	*			trans	66.8	171.8	150.4	-79.9	-44.5	0	0	0	119.3
239	P	37.5	Very low	36.7	Very low	104 Å²	104	122.8 Å²	122.8	68%	0.675	70%	0.695	S	S	*	*			cis	-149.9	179.3	29	46.6	-25.8	0	0	0	122.5
240	L	35	Very low	36.5	Very low	139 Å²	139	122.4 Å²	122.4	73%	0.728	69%	0.693	S	S	*	*			trans	73.1	114.3	146.6	-82.1	158.3	0	0	0	122.2
241	N	37.4	Very low	36.2	Very low	158 Å²	158	124.1 Å²	124.1	85%	0.845	70%	0.702	S	S	*	*				-170.1	176.6	93.1	-98.7	-39	0	0	0	114.4
242	N	34.9	Very low	35.9	Very low	147 Å²	147	123.5 Å²	123.5	79%	0.786	71%	0.705	S	S	*	*			trans	-134.8	-168.8	-155.8	-146.7	14.9	0	0	0	110.5
243	P	47.8	Very low	35.5	Very low	96 Å²	96	125.3 Å²	125.3	62%	0.623	72%	0.724	S	S	*	*			cis	-120.1	-145	-16.8	24.4	3	0	0	0	112.2
244	T	37.6	Very low	35.2	Very low	114 Å²	114	127.5 Å²	127.5	70%	0.699	74%	0.742	S	S	*	*			cis	-168.7	165.8	16.7	-22.8	0	0	0	0	113.3
245	I	38.4	Very low	34.8	Very low	148 Å²	148	127.9 Å²	127.9	76%	0.759	75%	0.749	S	S	*	*			trans	58.7	94.3	162.6	-44.4	-177.8	0	0	0	117.7
246	L	34.9	Very low	34.6	Very low	166 Å²	166	128.7 Å²	128.7	87%	0.869	75%	0.749	S	S	*	*				69.4	149	78.8	-69.8	177.8	0	0	0	117.1
247	P	37.6	Very low	34.8	Very low	109 Å²	109	129.3 Å²	129.3	71%	0.708	75%	0.747	S	S	*	*			trans	-120.8	176.5	-140.1	43.7	-34.7	0	0	0	115.9
248	I	34.9	Very low	34.7	Very low	164 Å²	164	129.4 Å²	129.4	84%	0.841	76%	0.755	S	S	*	*			trans	-152.5	146	145.1	-107.9	152.6	0	0	0	113.3
249	T	31.9	Very low	34.5	Very low	115 Å²	115	126.2 Å²	126.2	71%	0.706	75%	0.751	S	S	*	*			trans	-38	161.8	176.3	-30.8	0	0	0	0	119.8
250	T	30.9	Very low	34.2	Very low	111 Å²	111	125.5 Å²	125.5	68%	0.681	75%	0.748	S	S	*	*			trans	99	121	144.6	-21.9	0	0	0	0	118.1
251	V	31.7	Very low	34.1	Very low	137 Å²	137	128 Å²	128	83%	0.83	75%	0.749	S	S	*	*			trans	51.3	152.9	159.1	-66.1	0	0	0	0	119.8
252	A	30	Very low	34	Very low	80 Å²	80	127.2 Å²	127.2	66%	0.661	74%	0.744	S	S	*	*			cis	-170	-172.6	-24.9	0	0	0	0	0	107.6
253	S	28.3	Very low	34.1	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	74%	0.744	S	S	*	*			trans	69.8	120.6	149.4	-58.8	0	0	0	0	120.9
254	L	30.5	Very low	33.5	Very low	159 Å²	159	125.8 Å²	125.8	83%	0.832	75%	0.745	S	S	*	*			trans	61.1	115.1	140.1	-59.5	159.3	0	0	0	117.7
255	S	29.8	Very low	33.5	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	75%	0.749	S	S	*	*				70.1	109.1	58.3	-170.4	0	0	0	0	115.1
256	S	32.4	Very low	33.3	Very low	110 Å²	110	127 Å²	127	77%	0.769	75%	0.754	S	S	*	*				173	150.2	116.4	44.6	0	0	0	0	113.4
257	N	37.4	Very low	33.4	Very low	147 Å²	147	122.6 Å²	122.6	79%	0.786	75%	0.749	S	S	*	*			trans	-79.4	172	158	-70.5	-24.9	0	0	0	109.4
258	P	34.2	Very low	33.3	Very low	130 Å²	130	124.1 Å²	124.1	84%	0.844	75%	0.751	S	S	*	*				-140.2	176.1	115.2	37.6	-25.9	0	0	0	115.2
259	T	31.1	Very low	33.5	Very low	112 Å²	112	124.9 Å²	124.9	69%	0.687	75%	0.75	S	S	*	*			trans	-136.4	160.2	-174.1	-44.9	0	0	0	0	110
260	S	32.3	Very low	33.6	Very low	89 Å²	89	123.5 Å²	123.5	62%	0.622	75%	0.75	S	S	*	*			trans	69.8	161.7	154.3	67.4	0	0	0	0	120.9
261	Y	32.4	Very low	33.6	Very low	192 Å²	192	123.5 Å²	123.5	75%	0.753	76%	0.755	S	S	*	*			trans	144.5	116.9	146.6	-74.4	-62.2	0	0	0	107.8
262	L	34.2	Very low	33.7	Very low	140 Å²	140	122.9 Å²	122.9	73%	0.733	75%	0.752	S	S	*	*				60	129.9	63	-70.9	167	0	0	0	112.6
263	P	38.1	Very low	33.8	Very low	120 Å²	120	126.5 Å²	126.5	78%	0.779	76%	0.758	S	S	*	*				-138.3	-169.2	83	20.5	2.9	0	0	0	113.6
264	S	33.9	Very low	33.9	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	76%	0.758	S	S	*	*			cis	158.8	138.9	-37.2	-73.8	0	0	0	0	108.3
265	T	38.9	Very low	34.1	Very low	127 Å²	127	124 Å²	124	78%	0.779	75%	0.754	S	S	*	*			trans	162.3	117.6	150.6	36.7	0	0	0	0	107.8
266	N	34.5	Very low	34.4	Very low	161 Å²	161	128.3 Å²	128.3	86%	0.861	76%	0.76	S	S	*	*				95.4	126.7	62.2	-73.1	13.3	0	0	0	111.7
267	G	37.4	Very low	34.5	Very low	74 Å²	74	131 Å²	131	76%	0.763	77%	0.765	S	S	*	*			trans	153.7	116.6	177.8	0	0	0	0	0	112.3
268	D	34.5	Very low	34.4	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	76%	0.759	S	S	*	*			trans	-106.9	175.3	-163.1	-62.6	-86.6	0	0	0	115.3
269	H	38.4	Very low	34.3	Very low	180 Å²	180	132.9 Å²	132.9	83%	0.833	76%	0.755	S	S	*	*			trans	82.3	107	156.4	-59.9	-58.5	0	0	0	121.6
270	A	34.6	Very low	34.3	Very low	85 Å²	85	132.9 Å²	132.9	70%	0.702	76%	0.757	S	S	*	*				75.4	115.8	119	0	0	0	0	0	121.8
271	S	31	Very low	34.2	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	77%	0.767	S	S	*	*			trans	61.3	114.5	133.5	-53.9	0	0	0	0	120.4
272	T	33.2	Very low	34.2	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	77%	0.767	S	S	*	*				161.7	120.1	109.8	-67.2	0	0	0	0	112.2
273	I	32.1	Very low	34.2	Very low	155 Å²	155	131.4 Å²	131.4	80%	0.795	77%	0.769	S	S	*	*			trans	19.9	112.9	143.2	-44.6	168.7	0	0	0	117.3
274	S	31.2	Very low	33.8	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	77%	0.77	S	S	*	*				172.2	164.9	94	-148.8	0	0	0	0	115.8
275	S	34.8	Very low	33.9	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	78%	0.776	S	S	*	*			trans	57.6	94.2	147.1	-61.3	0	0	0	0	121.1
276	K	35.8	Very low	33.5	Very low	195 Å²	195	131.7 Å²	131.7	85%	0.848	78%	0.775	S	S	*	*			trans	-22.2	133.9	144.5	-54.6	168.9	179.5	178.4	0	115.6
277	N	34.9	Very low	33.7	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	78%	0.775	S	S	*	*				-151.4	162.4	117.4	-150.9	-4.8	0	0	0	110.5
278	E	35.8	Very low	33.6	Very low	142 Å²	142	136.6 Å²	136.6	66%	0.664	78%	0.779	S	S	*	*			trans	-95.4	150.9	-160.2	-73.8	-156.4	80.3	0	0	118
279	K	32.5	Very low	33.4	Very low	175 Å²	175	133.5 Å²	133.5	76%	0.761	78%	0.781	S	S	*	*			trans	58.1	104.9	145.6	-74.2	165.8	179.4	142.5	0	119.6
280	P	30.6	Very low	33.3	Very low	112 Å²	112	131.2 Å²	131.2	73%	0.727	78%	0.775	S	S	*	*			trans	-108.6	164.5	177.9	41.6	-35	0	0	0	115.2
281	L	30	Very low	33.8	Very low	157 Å²	157	131.8 Å²	131.8	82%	0.822	77%	0.769	S	S	*	*			trans	58.2	143	158.6	-82.7	81.9	0	0	0	119.1
282	V	32.1	Very low	34	Very low	123 Å²	123	135.8 Å²	135.8	75%	0.745	77%	0.767	S	S	*	*			cis	109.2	142.6	19.9	162.9	0	0	0	0	114
283	S	34.3	Very low	34.4	Very low	111 Å²	111	134.9 Å²	134.9	78%	0.776	76%	0.758	S	S	*	*			trans	85.5	161	162.6	74	0	0	0	0	119.9
284	V	29.5	Very low	34.9	Very low	135 Å²	135	129.1 Å²	129.1	82%	0.818	73%	0.728	S	S	*	*			trans	-134.1	-153	-159.8	-153.8	0	0	0	0	110.7
285	P	36.6	Very low	35.9	Very low	119 Å²	119	131.2 Å²	131.2	77%	0.773	73%	0.727	S	S	*	*				-109.2	173	-125.9	42.5	-29.1	0	0	0	116.6
286	A	30.5	Very low	36.3	Very low	92 Å²	92	130.1 Å²	130.1	76%	0.76	73%	0.725	S	S	*	*			trans	174.9	157.3	134.6	0	0	0	0	0	115.7
287	K	37.6	Very low	36.6	Very low	196 Å²	196	126.3 Å²	126.3	85%	0.852	71%	0.713	S	S	*	*			trans	61.8	133.7	161.1	-74.1	173.7	172.9	171.8	0	118.7
288	V	35	Very low	37.4	Very low	141 Å²	141	123.5 Å²	123.5	86%	0.855	69%	0.694	S	S	*	*			cis	105.9	117.1	18.9	172	0	0	0	0	113.6
289	G	31.4	Very low	38	Very low	76 Å²	76	119.2 Å²	119.2	78%	0.784	68%	0.683	S	S	*	*			trans	77.1	135.8	-179.6	0	0	0	0	0	112.3
290	N	35.9	Very low	38.9	Very low	132 Å²	132	114.3 Å²	114.3	71%	0.706	67%	0.668	S	S	*	*			cis	-151.3	-177.6	6.4	-145.5	7.1	0	0	0	106.3
291	V	44.8	Very low	40.2	Very low	97 Å²	97	111.9 Å²	111.9	59%	0.588	65%	0.649	S	S	*	*	S	Bend	cis	-132.5	120.9	13.2	-177.2	0	0	0	0	111.5	N293	V291-N293 PolarHBondContact O-N 3Å
292	R	36.3	Very low	41.9	Very low	196 Å²	196	111.3 Å²	111.3	74%	0.74	64%	0.64	S	S	*	*	S	Bend	trans	20.7	89	150.9	-56.7	177.6	-173.9	156.6	1.2	118.3	K447	R292-K447 WeakPolarHBondContact O-CE 3.36Å
293	N	41.1	Very low	44.1	Very low	105 Å²	105	107.2 Å²	107.2	56%	0.561	61%	0.613	S	S	*	*	S	Bend	cis	177	93.8	-8.4	178.4	12.2	0	0	0	105.6	V291 K447	V291-N293 PolarHBondContact O-N 3Å; N293-K447 VanDerWaalsContact N-CE 3.29Å; N293-K447 WeakPolarHBondContact O-CE 3.16Å
294	L	42.6	Very low	46.4	Very low	34 Å²	34	106.3 Å²	106.3	18%	0.178	59%	0.592	C	S	.	*			trans	-152.2	-12.7	168.9	-134.3	64.7	0	0	0	115.8	A296 L297 K447 S448 I449	L294-A296 PolarHBondContact O-N 2.87Å; L294-L297 HydrophobicContact CD1-CD1 3.5Å; L294-L297 HydrophobicContact CG-CD1 3.97Å; L294-L297 PolarHBondContact O-N 2.9Å; L294-K447 HydrophobicContact CB-CB 3.81Å; L294-K447 HydrophobicContact CB-CG 3.96Å; L294-K447 HydrophobicContact CD2-CB 3.79Å; L294-K447 HydrophobicContact CG-CB 4.34Å; L294-S448 VanDerWaalsContact CD2-C 3.4Å; L294-S448 WeakPolarHBondContact CD2-O 3.32Å; L294-I449 HydrophobicContact CD2-CG1 3.83Å
295	Q	51.1	Low	49.1	Very low	146 Å²	146	105.5 Å²	105.5	68%	0.682	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-8.7	166.5	-118.7	74.7	45.9	0	0	114.9	E298	Q295-E298 PolarHBondContact NE2-OE2 3.44Å
296	A	43.6	Very low	51.5	Low	84 Å²	84	100.6 Å²	100.6	69%	0.694	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-5.5	175.2	0	0	0	0	0	114.5	L294	L294-A296 PolarHBondContact O-N 2.87Å
297	L	42.9	Very low	54.2	Low	115 Å²	115	96.2 Å²	96.2	60%	0.602	52%	0.517	S	S	*	.	S	Bend	trans	-107	-3.1	-173.7	-91.3	155.3	0	0	0	115	L294 A299 V300	L294-L297 HydrophobicContact CD1-CD1 3.5Å; L294-L297 HydrophobicContact CG-CD1 3.97Å; L294-L297 PolarHBondContact O-N 2.9Å; L297-A299 PolarHBondContact O-N 3.04Å; L297-V300 VanDerWaalsContact O-CG2 3.23Å; L297-V300 WeakPolarHBondContact O-CG2 3.42Å
298	E	50.6	Low	56.7	Low	105 Å²	105	87.3 Å²	87.3	49%	0.491	48%	0.478	S	S	.	.			trans	-99.6	20.7	-161.2	-147.2	148.3	-139	0	0	114.1	Q295 S448	Q295-E298 PolarHBondContact NE2-OE2 3.44Å; E298-S448 PolarHBondContact OE2-OG 2.77Å
299	A	49.1	Very low	59.2	Low	53 Å²	53	82.7 Å²	82.7	44%	0.438	45%	0.449	S	S	.	.	S	Bend	trans	-110.2	31	-173.5	0	0	0	0	0	114.4	L297 R347 I599	L297-A299 PolarHBondContact O-N 3.04Å; A299-R347 PolarHBondContact O-NH1 3.06Å; A299-R347 PolarHBondContact O-NH2 3.17Å; A299-I599 HydrophobicContact CB-CD1 4.32Å
300	V	50.6	Low	62.1	Low	72 Å²	72	79.1 Å²	79.1	44%	0.436	41%	0.412	S	S	.	.			trans	-112.4	160.9	-152	169.3	0	0	0	0	113.4	L297 R347	L297-V300 VanDerWaalsContact O-CG2 3.23Å; L297-V300 WeakPolarHBondContact O-CG2 3.42Å; V300-R347 HydrophobicContact CG1-CB 3.99Å; V300-R347 HydrophobicContact CG1-CG 4.02Å; V300-R347 HydrophobicContact CG2-CG 4.2Å
301	D	59.4	Low	64.7	Low	61 Å²	61	72.9 Å²	72.9	33%	0.326	38%	0.379	S	S	.	.			trans	90.1	25	167.2	-93.5	33.6	0	0	0	123.7	R304	D301-R304 IonicContact OD2-NH1 3.6Å; D301-R304 PolarHBondContact OD2-NH1 3.29Å
302	F	65.8	Low	66.8	Low	144 Å²	144	69.5 Å²	69.5	63%	0.632	36%	0.357	S	S	*	.			trans	-75.4	167.1	168	-141.3	-114.3	0	0	0	113.3	R304 C344	F302-R304 VanDerWaalsContact C-N 3.29Å; F302-R304 PolarHBondContact O-N 2.79Å; F302-R304 VanDerWaalsContact O-N 3.1Å; F302-C344 VanDerWaalsContact C-SG 3.56Å; F302-C344 VanDerWaalsContact O-CB 3.25Å; F302-C344 WeakPolarHBondContact O-CB 3.16Å; F302-C344 PolarHBondContact O-SG 3.28Å
303	H	77.7	Confident	69.3	Low	38 Å²	38	63 Å²	63	18%	0.176	33%	0.334	C	S	.	.	S	Bend	trans	52.3	26.1	174	-64	-39.2	0	0	0	118.7	I307 I336 Q340 C344	H303-I307 HydrophobicContact CB-CD1 4.2Å; H303-I307 WeakPolarHBondContact O-CB 3.21Å; H303-I307 WeakPolarHBondContact O-CG1 3.28Å; H303-I307 PolarHBondContact O-N 2.8Å; H303-I336 HydrophobicContact CB-CD1 4.2Å; H303-I336 VanDerWaalsContact CD2-CG2 3.43Å; H303-I336 WeakPolarHBondContact CD2-CG2 3.43Å; H303-I336 WeakPolarHBondContact NE2-CG2 3.2Å; H303-Q340 PolarHBondContact NE2-OE1 3.15Å; H303-C344 HydrophobicContact CB-CB 4Å
304	R	83.5	Confident	71.6	Confident	92 Å²	92	58.2 Å²	58.2	35%	0.347	31%	0.309	S	S	.	.	H	α-helix	trans	-53.3	-69.3	-175.6	-178	154.5	-176.8	143.2	-1.2	115.5	D301 F302 A306 I307 L308 L348 A353	D301-R304 IonicContact OD2-NH1 3.6Å; D301-R304 PolarHBondContact OD2-NH1 3.29Å; F302-R304 VanDerWaalsContact C-N 3.29Å; F302-R304 PolarHBondContact O-N 2.79Å; F302-R304 VanDerWaalsContact O-N 3.1Å; R304-A306 VanDerWaalsContact C-N 3.33Å; R304-A306 PolarHBondContact O-N 3.38Å; R304-I307 PolarHBondContact O-N 2.93Å; R304-L308 HydrophobicContact CG-CD1 4.24Å; R304-L308 WeakPolarHBondContact O-CG 3.48Å; R304-L308 PolarHBondContact O-N 3Å; R304-L348 HydrophobicContact CB-CD2 3.83Å; R304-L348 HydrophobicContact CG-CD2 3.57Å; R304-A353 VanDerWaalsContact NH2-CB 3.34Å
305	D	85.1	Confident	73.6	Confident	117 Å²	117	60.3 Å²	60.3	63%	0.626	31%	0.314	S	S	*	.	H	α-helix	trans	-75.5	-27	-169.1	-56.4	-72.5	0	0	0	112.8	L308 D309	D305-L308 PolarHBondContact O-N 2.8Å; D305-D309 WeakPolarHBondContact O-CB 3.49Å; D305-D309 PolarHBondContact O-N 3.07Å
306	A	86.6	Confident	75.2	Confident	17 Å²	17	60.5 Å²	60.5	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-51.4	-59.6	166.1	0	0	0	0	0	111.6	R304 L308 D309 A310 L330 Q334 I336	R304-A306 VanDerWaalsContact C-N 3.33Å; R304-A306 PolarHBondContact O-N 3.38Å; A306-L308 VanDerWaalsContact C-N 3.27Å; A306-L308 PolarHBondContact O-N 3.44Å; A306-D309 PolarHBondContact O-N 2.74Å; A306-A310 PolarHBondContact O-N 3.03Å; A306-L330 HydrophobicContact CB-CD2 4.06Å; A306-L330 WeakPolarHBondContact O-CD2 3.25Å; A306-Q334 VanDerWaalsContact CA-OE1 3.24Å; A306-I336 HydrophobicContact CB-CD1 3.59Å
307	I	88.4	Confident	77	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57	-40.2	178	-79.3	166.5	0	0	0	111.7	H303 R304 A310 I311 L330 C344 L345 L348 V354	H303-I307 HydrophobicContact CB-CD1 4.2Å; H303-I307 WeakPolarHBondContact O-CB 3.21Å; H303-I307 WeakPolarHBondContact O-CG1 3.28Å; H303-I307 PolarHBondContact O-N 2.8Å; R304-I307 PolarHBondContact O-N 2.93Å; I307-A310 PolarHBondContact O-N 3.19Å; I307-I311 HydrophobicContact CG2-CD1 3.68Å; I307-I311 HydrophobicContact CG2-CG1 4.47Å; I307-I311 WeakPolarHBondContact O-CB 3.5Å; I307-I311 WeakPolarHBondContact O-CD1 3.48Å; I307-I311 WeakPolarHBondContact O-CG1 3.32Å; I307-I311 PolarHBondContact O-N 2.94Å; I307-L330 HydrophobicContact CG1-CD1 3.63Å; I307-C344 HydrophobicContact CD1-CB 3.51Å; I307-L345 HydrophobicContact CD1-CB 4.22Å; I307-L345 HydrophobicContact CG2-CD1 3.49Å; I307-L345 VanDerWaalsContact CG2-CD1 3.49Å; I307-L348 HydrophobicContact CB-CD1 3.93Å; I307-L348 HydrophobicContact CD1-CD1 3.71Å; I307-L348 HydrophobicContact CG1-CD1 4.41Å; I307-L348 HydrophobicContact CG2-CD1 3.83Å; I307-V354 HydrophobicContact CG2-CG2 4.07Å
308	L	90.1	Very high	79	Confident	8 Å²	8	63 Å²	63	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-43.2	179.8	-69.7	169.5	0	0	0	112.7	R304 D305 A306 I311 D312 A353 V354 N367	R304-L308 HydrophobicContact CG-CD1 4.24Å; R304-L308 WeakPolarHBondContact O-CG 3.48Å; R304-L308 PolarHBondContact O-N 3Å; D305-L308 PolarHBondContact O-N 2.8Å; A306-L308 VanDerWaalsContact C-N 3.27Å; A306-L308 PolarHBondContact O-N 3.44Å; L308-I311 WeakPolarHBondContact O-CB 3.25Å; L308-I311 PolarHBondContact O-N 3.46Å; L308-D312 VanDerWaalsContact O-CG 3.24Å; L308-D312 PolarHBondContact O-N 3.35Å; L308-D312 VanDerWaalsContact O-N 3.11Å; L308-D312 VanDerWaalsContact O-OD2 3.06Å; L308-A353 WeakPolarHBondContact CD2-O 3.47Å; L308-V354 HydrophobicContact CD2-CG2 3.62Å; L308-V354 HydrophobicContact CG-CG2 4.39Å; L308-N367 HydrophobicContact CD2-CB 3.86Å
309	D	87	Confident	80.6	Confident	44 Å²	44	59.1 Å²	59.1	24%	0.235	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-42.3	175.7	-179.3	57.2	0	0	0	112.2	D305 A306 I311 D312 K313	D305-D309 WeakPolarHBondContact O-CB 3.49Å; D305-D309 PolarHBondContact O-N 3.07Å; A306-D309 PolarHBondContact O-N 2.74Å; D309-I311 PolarHBondContact O-N 3.32Å; D309-D312 PolarHBondContact O-N 2.95Å; D309-K313 WeakPolarHBondContact O-CB 3.11Å; D309-K313 WeakPolarHBondContact O-CG 3.41Å; D309-K313 PolarHBondContact O-N 3.32Å; D309-K313 WeakPolarHBondContact OD1-CE 3.46Å; D309-K313 IonicContact OD1-NZ 3.57Å; D309-K313 WeakPolarHBondContact OD2-CE 3.3Å; D309-K313 IonicContact OD2-NZ 2.74Å; D309-K313 PolarHBondContact OD2-NZ 3.11Å
310	A	91.7	Very high	82.4	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-38.7	174.8	0	0	0	0	0	112.9	A306 I307 D312 L314 I326 L329 L330	A306-A310 PolarHBondContact O-N 3.03Å; I307-A310 PolarHBondContact O-N 3.19Å; A310-D312 VanDerWaalsContact C-N 3.33Å; A310-D312 PolarHBondContact O-N 3.48Å; A310-L314 WeakPolarHBondContact O-CD1 3.47Å; A310-L314 VanDerWaalsContact O-CG 3.29Å; A310-L314 WeakPolarHBondContact O-CG 3.23Å; A310-L314 PolarHBondContact O-N 2.96Å; A310-I326 HydrophobicContact CB-CG2 4.24Å; A310-L329 HydrophobicContact CB-CB 4.42Å; A310-L329 HydrophobicContact CB-CD2 3.97Å; A310-L329 HydrophobicContact CB-CG 4.36Å; A310-L329 WeakPolarHBondContact O-CD2 3.36Å; A310-L330 HydrophobicContact CB-CD2 3.49Å; A310-L330 VanDerWaalsContact CB-CD2 3.49Å; A310-L330 HydrophobicContact CB-CG 3.76Å
311	I	91.2	Very high	84.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-45.9	172.7	-76.2	163.4	0	0	0	110.9	I307 L308 D309 R315 P321 I326 L345 V354 Y365	I307-I311 HydrophobicContact CG2-CD1 3.68Å; I307-I311 HydrophobicContact CG2-CG1 4.47Å; I307-I311 WeakPolarHBondContact O-CB 3.5Å; I307-I311 WeakPolarHBondContact O-CD1 3.48Å; I307-I311 WeakPolarHBondContact O-CG1 3.32Å; I307-I311 PolarHBondContact O-N 2.94Å; L308-I311 WeakPolarHBondContact O-CB 3.25Å; L308-I311 PolarHBondContact O-N 3.46Å; D309-I311 PolarHBondContact O-N 3.32Å; I311-R315 VanDerWaalsContact O-CG 3.26Å; I311-R315 WeakPolarHBondContact O-CG 3.23Å; I311-R315 PolarHBondContact O-N 2.94Å; I311-P321 HydrophobicContact CB-CB 4.44Å; I311-P321 HydrophobicContact CG1-CB 4.4Å; I311-P321 HydrophobicContact CG2-CB 4.21Å; I311-I326 HydrophobicContact CD1-CD1 4.28Å; I311-I326 HydrophobicContact CG1-CD1 3.55Å; I311-I326 HydrophobicContact CG1-CG1 4.06Å; I311-L345 HydrophobicContact CD1-CD1 4.21Å; I311-V354 HydrophobicContact CD1-CG1 3.82Å; I311-V354 HydrophobicContact CD1-CG2 3.86Å; I311-Y365 WeakPolarHBondContact CG2-O 3.48Å
312	D	89.4	Confident	85.7	Confident	26 Å²	26	53.4 Å²	53.4	14%	0.139	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-46.3	-177.3	-63.5	-37.8	0	0	0	111.9	L308 D309 A310 L314 R315 E316 N367 K370	L308-D312 VanDerWaalsContact O-CG 3.24Å; L308-D312 PolarHBondContact O-N 3.35Å; L308-D312 VanDerWaalsContact O-N 3.11Å; L308-D312 VanDerWaalsContact O-OD2 3.06Å; D309-D312 PolarHBondContact O-N 2.95Å; A310-D312 VanDerWaalsContact C-N 3.33Å; A310-D312 PolarHBondContact O-N 3.48Å; D312-L314 PolarHBondContact O-N 2.76Å; D312-R315 WeakPolarHBondContact O-CB 3.32Å; D312-R315 PolarHBondContact O-N 3.12Å; D312-E316 PolarHBondContact O-N 3.28Å; D312-N367 WeakPolarHBondContact OD1-CB 3.44Å; D312-N367 PolarHBondContact OD2-ND2 3.42Å; D312-K370 WeakPolarHBondContact OD2-CD 3.06Å; D312-K370 WeakPolarHBondContact OD2-CE 3.12Å; D312-K370 IonicContact OD2-NZ 2.79Å; D312-K370 PolarHBondContact OD2-NZ 3.34Å
313	K	87.9	Confident	86.8	Confident	60 Å²	60	49.1 Å²	49.1	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-26	177.8	-78	171.9	175.4	170.4	0	114.2	D309 R317 L329	D309-K313 WeakPolarHBondContact O-CB 3.11Å; D309-K313 WeakPolarHBondContact O-CG 3.41Å; D309-K313 PolarHBondContact O-N 3.32Å; D309-K313 WeakPolarHBondContact OD1-CE 3.46Å; D309-K313 IonicContact OD1-NZ 3.57Å; D309-K313 WeakPolarHBondContact OD2-CE 3.3Å; D309-K313 IonicContact OD2-NZ 2.74Å; D309-K313 PolarHBondContact OD2-NZ 3.11Å; K313-R317 WeakPolarHBondContact O-CD 3.39Å; K313-R317 WeakPolarHBondContact O-CG 3.23Å; K313-R317 PolarHBondContact O-NH1 2.97Å; K313-L329 HydrophobicContact CB-CD2 3.7Å
314	L	89.2	Confident	87.2	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-78.9	-39.8	171.6	-70.1	166.5	0	0	0	111.6	A310 D312 E316 R317 A319 P321 R325 I326 L329	A310-L314 WeakPolarHBondContact O-CD1 3.47Å; A310-L314 VanDerWaalsContact O-CG 3.29Å; A310-L314 WeakPolarHBondContact O-CG 3.23Å; A310-L314 PolarHBondContact O-N 2.96Å; D312-L314 PolarHBondContact O-N 2.76Å; L314-E316 VanDerWaalsContact C-N 3.29Å; L314-E316 PolarHBondContact O-N 3.37Å; L314-R317 PolarHBondContact O-N 3.41Å; L314-A319 CarbonylContact C-O 3.59Å; L314-A319 HydrophobicContact CB-CB 4.48Å; L314-A319 HydrophobicContact CD2-CB 4.19Å; L314-A319 CarbonylContact O-C 3.51Å; L314-A319 WeakPolarHBondContact O-CA 3.31Å; L314-A319 VanDerWaalsContact O-CB 3.31Å; L314-A319 WeakPolarHBondContact O-CB 3.33Å; L314-A319 PolarHBondContact O-N 3.34Å; L314-P321 HydrophobicContact CB-CB 4.08Å; L314-P321 HydrophobicContact CD1-CB 4.3Å; L314-R325 HydrophobicContact CD1-CB 3.74Å; L314-R325 HydrophobicContact CD2-CB 3.9Å; L314-R325 HydrophobicContact CG-CB 4.49Å; L314-I326 HydrophobicContact CD1-CB 4.41Å; L314-I326 HydrophobicContact CD1-CG1 3.69Å; L314-L329 HydrophobicContact CD1-CD2 4.35Å; L314-L329 HydrophobicContact CD2-CD2 4.19Å; L314-L329 HydrophobicContact CG-CD2 3.82Å
315	R	85.7	Confident	87.5	Confident	77 Å²	77	55.4 Å²	55.4	29%	0.291	26%	0.255	S	S	.	.	H	α-helix	trans	-61	-39.8	177.3	-71.6	178.2	161.5	-59.7	-26.1	112.4	I311 D312 K318 P321 S364 Y365	I311-R315 VanDerWaalsContact O-CG 3.26Å; I311-R315 WeakPolarHBondContact O-CG 3.23Å; I311-R315 PolarHBondContact O-N 2.94Å; D312-R315 WeakPolarHBondContact O-CB 3.32Å; D312-R315 PolarHBondContact O-N 3.12Å; R315-K318 PolarHBondContact O-N 2.77Å; R315-P321 HydrophobicContact CG-CB 4.47Å; R315-P321 HydrophobicContact CG-CG 3.73Å; R315-P321 VanDerWaalsContact NH2-CG 3.26Å; R315-S364 PolarHBondContact NH2-OG 3.11Å; R315-Y365 PolarHBondContact NE-O 2.82Å; R315-Y365 PolarHBondContact NH2-O 3.35Å
316	E	82.9	Confident	87.8	Confident	150 Å²	150	49.9 Å²	49.9	70%	0.701	23%	0.226	S	C	*	.	H	α-helix	trans	-57.7	-48.6	176.1	-171.1	165.7	-112.1	0	0	112.2	D312 L314 K318	D312-E316 PolarHBondContact O-N 3.28Å; L314-E316 VanDerWaalsContact C-N 3.29Å; L314-E316 PolarHBondContact O-N 3.37Å; E316-K318 PolarHBondContact O-N 2.92Å
317	R	83	Confident	87.7	Confident	84 Å²	84	49.7 Å²	49.7	32%	0.317	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	10.5	178.7	-70.2	166.6	167.5	65.8	11.7	115.3	K313 L314 A319 D824	K313-R317 WeakPolarHBondContact O-CD 3.39Å; K313-R317 WeakPolarHBondContact O-CG 3.23Å; K313-R317 PolarHBondContact O-NH1 2.97Å; L314-R317 PolarHBondContact O-N 3.41Å; R317-A319 HydrophobicContact CB-CB 3.95Å; R317-A319 PolarHBondContact O-N 3.09Å; R317-D824 WeakPolarHBondContact CD-OD2 3.42Å; R317-D824 IonicContact CZ-OD2 3.96Å; R317-D824 IonicContact NE-OD2 3.01Å; R317-D824 PolarHBondContact NE-OD2 3.41Å
318	K	83.3	Confident	87.5	Confident	169 Å²	169	52.9 Å²	52.9	74%	0.735	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	14.7	-162.8	-59.4	171.2	-176.9	168.7	0	112.6	R315 E316 D839	R315-K318 PolarHBondContact O-N 2.77Å; E316-K318 PolarHBondContact O-N 2.92Å; K318-D839 IonicContact NZ-OD1 2.76Å; K318-D839 PolarHBondContact NZ-OD1 3.33Å; K318-D839 IonicContact NZ-OD2 3.81Å
319	A	85.2	Confident	87.2	Confident	22 Å²	22	52.9 Å²	52.9	18%	0.182	25%	0.245	C	C	.	.			trans	-83.5	159.4	-178.3	0	0	0	0	0	110.3	L314 R317 P321	L314-A319 CarbonylContact C-O 3.59Å; L314-A319 HydrophobicContact CB-CB 4.48Å; L314-A319 HydrophobicContact CD2-CB 4.19Å; L314-A319 CarbonylContact O-C 3.51Å; L314-A319 WeakPolarHBondContact O-CA 3.31Å; L314-A319 VanDerWaalsContact O-CB 3.31Å; L314-A319 WeakPolarHBondContact O-CB 3.33Å; L314-A319 PolarHBondContact O-N 3.34Å; R317-A319 HydrophobicContact CB-CB 3.95Å; R317-A319 PolarHBondContact O-N 3.09Å; A319-P321 WeakPolarHBondContact O-CD 3.32Å
320	R	86.2	Confident	87.2	Confident	40 Å²	40	50.9 Å²	50.9	15%	0.151	23%	0.234	C	C	.	.			trans	-75.8	127.8	174.7	-172.9	174.9	-171.1	106.5	18.9	109.5	D322 R325 Y359 N362 L363	R320-D322 VanDerWaalsContact C-N 3.27Å; R320-D322 WeakPolarHBondContact CB-OD2 3.27Å; R320-D322 WeakPolarHBondContact CD-OD2 3.49Å; R320-D322 HydrophobicContact CG-CB 3.82Å; R320-D322 VanDerWaalsContact CG-OD2 3.32Å; R320-D322 WeakPolarHBondContact CG-OD2 2.93Å; R320-D322 PolarHBondContact O-N 2.98Å; R320-D322 VanDerWaalsContact O-N 3.16Å; R320-R325 WeakPolarHBondContact O-CD 3.45Å; R320-Y359 PolarHBondContact NH1-O 3.17Å; R320-Y359 PolarHBondContact NH2-O 2.91Å; R320-N362 VanDerWaalsContact NH2-CB 3.32Å; R320-N362 PolarHBondContact NH2-O 3.24Å; R320-L363 PolarHBondContact NE-O 3.19Å; R320-L363 VanDerWaalsContact NH2-C 3.32Å; R320-L363 PolarHBondContact NH2-O 3.13Å
321	P	90.4	Very high	86.5	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.026	26%	0.263	C	S	.	.			trans	-82.4	83.1	159.2	32.3	-31.7	0	0	0	107.4	I311 L314 R315 A319 I326 S364 Y365	I311-P321 HydrophobicContact CB-CB 4.44Å; I311-P321 HydrophobicContact CG1-CB 4.4Å; I311-P321 HydrophobicContact CG2-CB 4.21Å; L314-P321 HydrophobicContact CB-CB 4.08Å; L314-P321 HydrophobicContact CD1-CB 4.3Å; R315-P321 HydrophobicContact CG-CB 4.47Å; R315-P321 HydrophobicContact CG-CG 3.73Å; R315-P321 VanDerWaalsContact NH2-CG 3.26Å; A319-P321 WeakPolarHBondContact O-CD 3.32Å; P321-I326 HydrophobicContact CB-CD1 4.27Å; P321-I326 HydrophobicContact CB-CG1 4.42Å; P321-S364 WeakPolarHBondContact CG-OG 3.33Å; P321-S364 CarbonylContact O-C 3.57Å; P321-S364 WeakPolarHBondContact O-CA 3.42Å; P321-S364 PolarHBondContact O-OG 3.34Å; P321-S364 VanDerWaalsContact O-OG 3.13Å; P321-Y365 WeakPolarHBondContact CG-O 3.19Å; P321-Y365 PolarHBondContact O-N 2.98Å
322	D	89.8	Confident	85.7	Confident	23 Å²	23	61.6 Å²	61.6	12%	0.123	28%	0.278	C	S	.	.			trans	-103.7	170.3	167.2	53.3	50	0	0	0	109.5	R320 E324 R325 I326	R320-D322 VanDerWaalsContact C-N 3.27Å; R320-D322 WeakPolarHBondContact CB-OD2 3.27Å; R320-D322 WeakPolarHBondContact CD-OD2 3.49Å; R320-D322 HydrophobicContact CG-CB 3.82Å; R320-D322 VanDerWaalsContact CG-OD2 3.32Å; R320-D322 WeakPolarHBondContact CG-OD2 2.93Å; R320-D322 PolarHBondContact O-N 2.98Å; R320-D322 VanDerWaalsContact O-N 3.16Å; D322-E324 VanDerWaalsContact C-N 3.35Å; D322-E324 PolarHBondContact O-N 3.15Å; D322-E324 PolarHBondContact OD1-N 2.96Å; D322-R325 VanDerWaalsContact OD1-CB 3.27Å; D322-R325 WeakPolarHBondContact OD1-CB 3.19Å; D322-R325 WeakPolarHBondContact OD1-CD 3.46Å; D322-R325 WeakPolarHBondContact OD1-CG 3.36Å; D322-R325 PolarHBondContact OD1-N 3.38Å; D322-R325 WeakPolarHBondContact OD2-CD 3.4Å; D322-R325 IonicContact OD2-NE 3.99Å; D322-R325 PolarHBondContact OD2-NE 3.36Å; D322-I326 VanDerWaalsContact O-CB 3.3Å; D322-I326 WeakPolarHBondContact O-CB 3.32Å; D322-I326 VanDerWaalsContact O-CD1 3.27Å; D322-I326 WeakPolarHBondContact O-CD1 3.37Å; D322-I326 WeakPolarHBondContact O-CG1 3.45Å; D322-I326 PolarHBondContact O-N 2.66Å
323	F	88.4	Confident	84.7	Confident	54 Å²	54	65.2 Å²	65.2	24%	0.237	29%	0.294	C	S	.	.	H	α-helix	trans	-57.5	-45.2	-176.9	167.9	-112.9	0	0	0	112.7	I326 S327 S338 T341 H342 L345 Y365	F323-I326 PolarHBondContact O-N 3.14Å; F323-S327 WeakPolarHBondContact O-CB 3.26Å; F323-S327 PolarHBondContact O-N 3.36Å; F323-S327 PolarHBondContact O-OG 2.89Å; F323-S338 WeakPolarHBondContact CE2-O 3.39Å; F323-S338 WeakPolarHBondContact CZ-O 3.46Å; F323-S338 VanDerWaalsContact CZ-OG 3.25Å; F323-S338 WeakPolarHBondContact CZ-OG 3.47Å; F323-T341 HydrophobicContact CD2-CG2 4.12Å; F323-T341 HydrophobicContact CE2-CG2 3.87Å; F323-H342 HydrophobicContact CD2-CB 4.47Å; F323-H342 HydrophobicContact CE2-CB 3.64Å; F323-H342 HydrophobicContact CZ-CB 3.84Å; F323-L345 HydrophobicContact CB-CD2 4.31Å; F323-L345 HydrophobicContact CD2-CD2 3.94Å; F323-Y365 HydrophobicContact CB-CE2 4.43Å
324	E	86.7	Confident	83.7	Confident	142 Å²	142	66.2 Å²	66.2	66%	0.664	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-55	-179	-66	179.9	173	0	0	111	D322 I326 S327 C328	D322-E324 VanDerWaalsContact C-N 3.35Å; D322-E324 PolarHBondContact O-N 3.15Å; D322-E324 PolarHBondContact OD1-N 2.96Å; E324-I326 VanDerWaalsContact C-N 3.33Å; E324-I326 PolarHBondContact O-N 3.11Å; E324-S327 PolarHBondContact O-N 2.84Å; E324-S327 VanDerWaalsContact O-N 3.12Å; E324-S327 PolarHBondContact O-OG 3.49Å; E324-C328 PolarHBondContact O-N 2.98Å; E324-C328 PolarHBondContact O-SG 3.43Å; E324-C328 VanDerWaalsContact O-SG 3.37Å
325	R	89.6	Confident	83	Confident	120 Å²	120	72.8 Å²	72.8	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-65.7	-35.4	-178	-66.1	166.8	-172.5	-119	2	112.3	L314 R320 D322 L329	L314-R325 HydrophobicContact CD1-CB 3.74Å; L314-R325 HydrophobicContact CD2-CB 3.9Å; L314-R325 HydrophobicContact CG-CB 4.49Å; R320-R325 WeakPolarHBondContact O-CD 3.45Å; D322-R325 VanDerWaalsContact OD1-CB 3.27Å; D322-R325 WeakPolarHBondContact OD1-CB 3.19Å; D322-R325 WeakPolarHBondContact OD1-CD 3.46Å; D322-R325 WeakPolarHBondContact OD1-CG 3.36Å; D322-R325 PolarHBondContact OD1-N 3.38Å; D322-R325 WeakPolarHBondContact OD2-CD 3.4Å; D322-R325 IonicContact OD2-NE 3.99Å; D322-R325 PolarHBondContact OD2-NE 3.36Å; R325-L329 VanDerWaalsContact O-CB 3.25Å; R325-L329 WeakPolarHBondContact O-CB 3.35Å; R325-L329 PolarHBondContact O-N 2.95Å
326	I	90.2	Very high	82.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-52.2	171.3	-68.9	163.5	0	0	0	108.9	A310 I311 L314 P321 D322 F323 E324 C328 L329 L330 T341 L345 Y365	A310-I326 HydrophobicContact CB-CG2 4.24Å; I311-I326 HydrophobicContact CD1-CD1 4.28Å; I311-I326 HydrophobicContact CG1-CD1 3.55Å; I311-I326 HydrophobicContact CG1-CG1 4.06Å; L314-I326 HydrophobicContact CD1-CB 4.41Å; L314-I326 HydrophobicContact CD1-CG1 3.69Å; P321-I326 HydrophobicContact CB-CD1 4.27Å; P321-I326 HydrophobicContact CB-CG1 4.42Å; D322-I326 VanDerWaalsContact O-CB 3.3Å; D322-I326 WeakPolarHBondContact O-CB 3.32Å; D322-I326 VanDerWaalsContact O-CD1 3.27Å; D322-I326 WeakPolarHBondContact O-CD1 3.37Å; D322-I326 WeakPolarHBondContact O-CG1 3.45Å; D322-I326 PolarHBondContact O-N 2.66Å; F323-I326 PolarHBondContact O-N 3.14Å; E324-I326 VanDerWaalsContact C-N 3.33Å; E324-I326 PolarHBondContact O-N 3.11Å; I326-C328 PolarHBondContact O-N 3.39Å; I326-L329 PolarHBondContact O-N 3.24Å; I326-L330 HydrophobicContact CG2-CD1 3.64Å; I326-L330 HydrophobicContact CG2-CG 4.17Å; I326-L330 WeakPolarHBondContact O-CB 3.28Å; I326-L330 VanDerWaalsContact O-CG 3.23Å; I326-L330 WeakPolarHBondContact O-CG 3.45Å; I326-L330 PolarHBondContact O-N 2.98Å; I326-T341 HydrophobicContact CG2-CG2 3.95Å; I326-L345 HydrophobicContact CD1-CD1 4.25Å; I326-L345 HydrophobicContact CD1-CD2 4.26Å; I326-Y365 HydrophobicContact CD1-CD2 3.62Å; I326-Y365 HydrophobicContact CD1-CE2 4.5Å; I326-Y365 HydrophobicContact CD1-CG 4.04Å
327	S	85.7	Confident	82.2	Confident	14 Å²	14	66.9 Å²	66.9	10%	0.098	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-40.5	-179.9	76.3	0	0	0	0	112.9	F323 E324 L330 K331	F323-S327 WeakPolarHBondContact O-CB 3.26Å; F323-S327 PolarHBondContact O-N 3.36Å; F323-S327 PolarHBondContact O-OG 2.89Å; E324-S327 PolarHBondContact O-N 2.84Å; E324-S327 VanDerWaalsContact O-N 3.12Å; E324-S327 PolarHBondContact O-OG 3.49Å; S327-L330 PolarHBondContact O-N 3.3Å; S327-K331 VanDerWaalsContact O-CB 3.22Å; S327-K331 WeakPolarHBondContact O-CB 3.38Å; S327-K331 PolarHBondContact O-N 3.35Å
328	C	84.6	Confident	82	Confident	67 Å²	67	65.3 Å²	65.3	45%	0.453	32%	0.315	S	S	.	.	H	α-helix	trans	-66.4	-39.2	176.3	-69.8	0	0	0	0	112.4	E324 I326 R332	E324-C328 PolarHBondContact O-N 2.98Å; E324-C328 PolarHBondContact O-SG 3.43Å; E324-C328 VanDerWaalsContact O-SG 3.37Å; I326-C328 PolarHBondContact O-N 3.39Å; C328-R332 PolarHBondContact O-N 3.27Å; C328-R332 VanDerWaalsContact O-N 3.1Å
329	L	83.7	Confident	81.7	Confident	8 Å²	8	63 Å²	63	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-71.4	-39	178.4	-169.7	66.1	0	0	0	111.6	A310 K313 L314 R325 I326 R332 H333	A310-L329 HydrophobicContact CB-CB 4.42Å; A310-L329 HydrophobicContact CB-CD2 3.97Å; A310-L329 HydrophobicContact CB-CG 4.36Å; A310-L329 WeakPolarHBondContact O-CD2 3.36Å; K313-L329 HydrophobicContact CB-CD2 3.7Å; L314-L329 HydrophobicContact CD1-CD2 4.35Å; L314-L329 HydrophobicContact CD2-CD2 4.19Å; L314-L329 HydrophobicContact CG-CD2 3.82Å; R325-L329 VanDerWaalsContact O-CB 3.25Å; R325-L329 WeakPolarHBondContact O-CB 3.35Å; R325-L329 PolarHBondContact O-N 2.95Å; I326-L329 PolarHBondContact O-N 3.24Å; L329-R332 VanDerWaalsContact CD1-NH1 3.25Å; L329-R332 PolarHBondContact O-N 2.95Å; L329-H333 WeakPolarHBondContact CD1-CD2 3.48Å; L329-H333 WeakPolarHBondContact CD1-NE2 3.27Å; L329-H333 PolarHBondContact O-CD2 2.8Å; L329-H333 VanDerWaalsContact O-CD2 3.31Å; L329-H333 PolarHBondContact O-N 3.31Å
330	L	85.6	Confident	81.5	Confident	1 Å²	1	66 Å²	66	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-68.2	-40.7	173.9	-65.9	175.8	0	0	0	112.3	A306 I307 A310 I326 S327 R332 H333 Q334 N335 I336 T341	A306-L330 HydrophobicContact CB-CD2 4.06Å; A306-L330 WeakPolarHBondContact O-CD2 3.25Å; I307-L330 HydrophobicContact CG1-CD1 3.63Å; A310-L330 HydrophobicContact CB-CD2 3.49Å; A310-L330 VanDerWaalsContact CB-CD2 3.49Å; A310-L330 HydrophobicContact CB-CG 3.76Å; I326-L330 HydrophobicContact CG2-CD1 3.64Å; I326-L330 HydrophobicContact CG2-CG 4.17Å; I326-L330 WeakPolarHBondContact O-CB 3.28Å; I326-L330 VanDerWaalsContact O-CG 3.23Å; I326-L330 WeakPolarHBondContact O-CG 3.45Å; I326-L330 PolarHBondContact O-N 2.98Å; S327-L330 PolarHBondContact O-N 3.3Å; L330-R332 VanDerWaalsContact C-N 3.27Å; L330-R332 PolarHBondContact O-N 2.97Å; L330-H333 PolarHBondContact O-N 2.98Å; L330-Q334 CarbonylContact O-C 3.46Å; L330-Q334 WeakPolarHBondContact O-CA 3.43Å; L330-Q334 PolarHBondContact O-N 3.39Å; L330-N335 PolarHBondContact O-N 3.27Å; L330-I336 HydrophobicContact CB-CB 4.1Å; L330-I336 HydrophobicContact CB-CD1 4.44Å; L330-I336 HydrophobicContact CD2-CD1 4.25Å; L330-T341 HydrophobicContact CD1-CG2 3.83Å
331	K	77.2	Confident	81.4	Confident	141 Å²	141	64.1 Å²	64.1	61%	0.613	31%	0.31	S	S	*	.	H	α-helix	trans	-57.8	-41.4	173	-173.5	178.1	-179.9	-176.4	0	111	S327	S327-K331 VanDerWaalsContact O-CB 3.22Å; S327-K331 WeakPolarHBondContact O-CB 3.38Å; S327-K331 PolarHBondContact O-N 3.35Å
332	R	74.6	Confident	81	Confident	87 Å²	87	68.2 Å²	68.2	33%	0.328	33%	0.329	S	S	.	.	H	α-helix	trans	-69.8	-48.6	177.5	-168.7	-164.7	-55.2	139.3	0.1	113.8	C328 L329 L330 Y778	C328-R332 PolarHBondContact O-N 3.27Å; C328-R332 VanDerWaalsContact O-N 3.1Å; L329-R332 VanDerWaalsContact CD1-NH1 3.25Å; L329-R332 PolarHBondContact O-N 2.95Å; L330-R332 VanDerWaalsContact C-N 3.27Å; L330-R332 PolarHBondContact O-N 2.97Å; R332-Y778 VanDerWaalsContact NH2-CD2 3.34Å
333	H	69.5	Low	80.7	Confident	101 Å²	101	70.6 Å²	70.6	47%	0.468	34%	0.342	S	S	.	.	H	α-helix	trans	-93.8	-23	-169.3	-71.4	-72.9	0	0	0	114.6	L329 L330	L329-H333 WeakPolarHBondContact CD1-CD2 3.48Å; L329-H333 WeakPolarHBondContact CD1-NE2 3.27Å; L329-H333 PolarHBondContact O-CD2 2.8Å; L329-H333 VanDerWaalsContact O-CD2 3.31Å; L329-H333 PolarHBondContact O-N 3.31Å; L330-H333 PolarHBondContact O-N 2.98Å
334	Q	66.7	Low	80.5	Confident	81 Å²	81	68.3 Å²	68.3	38%	0.379	33%	0.332	S	S	.	.	H	α-helix	trans	-141.9	5	-165.6	-73.9	164.6	-7.7	0	0	113.6	A306 L330 I336	A306-Q334 VanDerWaalsContact CA-OE1 3.24Å; L330-Q334 CarbonylContact O-C 3.46Å; L330-Q334 WeakPolarHBondContact O-CA 3.43Å; L330-Q334 PolarHBondContact O-N 3.39Å; Q334-I336 VanDerWaalsContact C-N 3.34Å; Q334-I336 HydrophobicContact CB-CD1 4.11Å; Q334-I336 HydrophobicContact CB-CG1 4.26Å; Q334-I336 PolarHBondContact O-N 3.11Å
335	N	75.1	Confident	80.6	Confident	143 Å²	143	61.6 Å²	61.6	77%	0.765	30%	0.301	S	S	*	.			trans	51.2	42.2	177.8	-158.8	5.8	0	0	0	115.1	L330	L330-N335 PolarHBondContact O-N 3.27Å
336	I	73.7	Confident	80.1	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.041	30%	0.302	C	S	.	.			trans	-95.8	132.7	179	-60.7	170.9	0	0	0	110.3	H303 A306 L330 Q334 Q340	H303-I336 HydrophobicContact CB-CD1 4.2Å; H303-I336 VanDerWaalsContact CD2-CG2 3.43Å; H303-I336 WeakPolarHBondContact CD2-CG2 3.43Å; H303-I336 WeakPolarHBondContact NE2-CG2 3.2Å; A306-I336 HydrophobicContact CB-CD1 3.59Å; L330-I336 HydrophobicContact CB-CB 4.1Å; L330-I336 HydrophobicContact CB-CD1 4.44Å; L330-I336 HydrophobicContact CD2-CD1 4.25Å; Q334-I336 VanDerWaalsContact C-N 3.34Å; Q334-I336 HydrophobicContact CB-CD1 4.11Å; Q334-I336 HydrophobicContact CB-CG1 4.26Å; Q334-I336 PolarHBondContact O-N 3.11Å; I336-Q340 HydrophobicContact CG2-CB 4.16Å
337	N	76.6	Confident	79.7	Confident	96 Å²	96	64 Å²	64	51%	0.513	31%	0.314	S	S	.	.			trans	-72.9	155.4	178.8	-166.3	10.1	0	0	0	112.5	E339 Q340 T341	N337-E339 PolarHBondContact O-N 3.12Å; N337-Q340 HydrophobicContact CB-CG 4.37Å; N337-Q340 PolarHBondContact O-N 3.23Å; N337-T341 WeakPolarHBondContact O-CB 3.34Å; N337-T341 PolarHBondContact O-N 3.36Å; N337-T341 PolarHBondContact O-OG1 3.23Å
338	S	80	Confident	79.8	Confident	50 Å²	50	63.3 Å²	63.3	35%	0.35	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-44.6	179.9	-177.9	0	0	0	0	112.7	F323 Q340 T341 H342	F323-S338 WeakPolarHBondContact CE2-O 3.39Å; F323-S338 WeakPolarHBondContact CZ-O 3.46Å; F323-S338 VanDerWaalsContact CZ-OG 3.25Å; F323-S338 WeakPolarHBondContact CZ-OG 3.47Å; S338-Q340 PolarHBondContact O-N 2.97Å; S338-T341 CarbonylContact O-C 3.6Å; S338-T341 WeakPolarHBondContact O-CA 3.36Å; S338-T341 VanDerWaalsContact O-CB 3.3Å; S338-T341 WeakPolarHBondContact O-CB 3.45Å; S338-T341 PolarHBondContact O-N 2.96Å; S338-H342 PolarHBondContact O-N 3.1Å
339	E	77.3	Confident	79.9	Confident	121 Å²	121	61.4 Å²	61.4	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-62.3	-45.2	176.8	179.8	179.3	-150.8	0	0	112.6	N337 T341 H342 L343	N337-E339 PolarHBondContact O-N 3.12Å; E339-T341 VanDerWaalsContact C-N 3.3Å; E339-T341 PolarHBondContact O-N 3.35Å; E339-H342 PolarHBondContact O-N 3.31Å; E339-H342 VanDerWaalsContact O-N 3.17Å; E339-L343 HydrophobicContact CG-CD1 4.22Å; E339-L343 PolarHBondContact O-N 2.8Å
340	Q	79	Confident	79.6	Confident	85 Å²	85	66.9 Å²	66.9	40%	0.397	33%	0.328	S	S	.	.	H	α-helix	trans	-62.5	-41.5	175.1	-64.7	-175.8	-12	0	0	110.5	H303 I336 N337 S338 H342 C344	H303-Q340 PolarHBondContact NE2-OE1 3.15Å; I336-Q340 HydrophobicContact CG2-CB 4.16Å; N337-Q340 HydrophobicContact CB-CG 4.37Å; N337-Q340 PolarHBondContact O-N 3.23Å; S338-Q340 PolarHBondContact O-N 2.97Å; Q340-H342 VanDerWaalsContact C-N 3.33Å; Q340-H342 PolarHBondContact O-N 3.25Å; Q340-C344 VanDerWaalsContact O-CB 3.26Å; Q340-C344 WeakPolarHBondContact O-CB 3.5Å; Q340-C344 PolarHBondContact O-N 3.35Å; Q340-C344 PolarHBondContact O-SG 2.86Å
341	T	85.6	Confident	79.3	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.8	-46.7	173.1	-58	0	0	0	0	110.5	F323 I326 L330 N337 S338 E339 C344 L345	F323-T341 HydrophobicContact CD2-CG2 4.12Å; F323-T341 HydrophobicContact CE2-CG2 3.87Å; I326-T341 HydrophobicContact CG2-CG2 3.95Å; L330-T341 HydrophobicContact CD1-CG2 3.83Å; N337-T341 WeakPolarHBondContact O-CB 3.34Å; N337-T341 PolarHBondContact O-N 3.36Å; N337-T341 PolarHBondContact O-OG1 3.23Å; S338-T341 CarbonylContact O-C 3.6Å; S338-T341 WeakPolarHBondContact O-CA 3.36Å; S338-T341 VanDerWaalsContact O-CB 3.3Å; S338-T341 WeakPolarHBondContact O-CB 3.45Å; S338-T341 PolarHBondContact O-N 2.96Å; E339-T341 VanDerWaalsContact C-N 3.3Å; E339-T341 PolarHBondContact O-N 3.35Å; T341-C344 PolarHBondContact O-N 2.93Å; T341-L345 WeakPolarHBondContact O-CB 3.38Å; T341-L345 PolarHBondContact O-N 2.96Å
342	H	82.2	Confident	79.5	Confident	91 Å²	91	63.7 Å²	63.7	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-53.2	-178.5	-176.8	-79.8	0	0	0	111.7	F323 S338 E339 Q340 C344 L345 Q346	F323-H342 HydrophobicContact CD2-CB 4.47Å; F323-H342 HydrophobicContact CE2-CB 3.64Å; F323-H342 HydrophobicContact CZ-CB 3.84Å; S338-H342 PolarHBondContact O-N 3.1Å; E339-H342 PolarHBondContact O-N 3.31Å; E339-H342 VanDerWaalsContact O-N 3.17Å; Q340-H342 VanDerWaalsContact C-N 3.33Å; Q340-H342 PolarHBondContact O-N 3.25Å; H342-C344 VanDerWaalsContact C-N 3.3Å; H342-C344 PolarHBondContact O-N 3.07Å; H342-L345 PolarHBondContact O-N 3.02Å; H342-Q346 WeakPolarHBondContact O-CB 3.3Å; H342-Q346 PolarHBondContact O-N 2.79Å
343	L	82.8	Confident	79.7	Confident	73 Å²	73	59.9 Å²	59.9	38%	0.382	32%	0.318	S	S	.	.	H	α-helix	trans	-55.5	-46.9	178.6	-79.4	163.7	0	0	0	111.3	E339 R347	E339-L343 HydrophobicContact CG-CD1 4.22Å; E339-L343 PolarHBondContact O-N 2.8Å; L343-R347 WeakPolarHBondContact O-CB 3.39Å; L343-R347 WeakPolarHBondContact O-CD 3.47Å; L343-R347 WeakPolarHBondContact O-CG 3.34Å; L343-R347 PolarHBondContact O-N 3.45Å; L343-R347 VanDerWaalsContact O-N 3.11Å
344	C	83.3	Confident	80.6	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-72.1	-41.8	-178.1	-60.6	0	0	0	0	111.6	F302 H303 I307 Q340 T341 H342 Q346 R347 L348	F302-C344 VanDerWaalsContact C-SG 3.56Å; F302-C344 VanDerWaalsContact O-CB 3.25Å; F302-C344 WeakPolarHBondContact O-CB 3.16Å; F302-C344 PolarHBondContact O-SG 3.28Å; H303-C344 HydrophobicContact CB-CB 4Å; I307-C344 HydrophobicContact CD1-CB 3.51Å; Q340-C344 VanDerWaalsContact O-CB 3.26Å; Q340-C344 WeakPolarHBondContact O-CB 3.5Å; Q340-C344 PolarHBondContact O-N 3.35Å; Q340-C344 PolarHBondContact O-SG 2.86Å; T341-C344 PolarHBondContact O-N 2.93Å; H342-C344 VanDerWaalsContact C-N 3.3Å; H342-C344 PolarHBondContact O-N 3.07Å; C344-Q346 PolarHBondContact O-N 3.08Å; C344-R347 PolarHBondContact O-N 2.74Å; C344-L348 WeakPolarHBondContact O-CB 3.12Å; C344-L348 WeakPolarHBondContact O-CD1 3.45Å; C344-L348 WeakPolarHBondContact O-CG 3.35Å; C344-L348 PolarHBondContact O-N 2.8Å
345	L	88.8	Confident	81.5	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-38.2	179.2	-172.6	65.7	0	0	0	112.5	I307 I311 F323 I326 T341 H342 A349 V354 Y365	I307-L345 HydrophobicContact CD1-CB 4.22Å; I307-L345 HydrophobicContact CG2-CD1 3.49Å; I307-L345 VanDerWaalsContact CG2-CD1 3.49Å; I311-L345 HydrophobicContact CD1-CD1 4.21Å; F323-L345 HydrophobicContact CB-CD2 4.31Å; F323-L345 HydrophobicContact CD2-CD2 3.94Å; I326-L345 HydrophobicContact CD1-CD1 4.25Å; I326-L345 HydrophobicContact CD1-CD2 4.26Å; T341-L345 WeakPolarHBondContact O-CB 3.38Å; T341-L345 PolarHBondContact O-N 2.96Å; H342-L345 PolarHBondContact O-N 3.02Å; L345-A349 PolarHBondContact O-N 2.99Å; L345-A349 VanDerWaalsContact O-N 3.14Å; L345-V354 HydrophobicContact CD1-CG1 4.32Å; L345-Y365 HydrophobicContact CD1-CD1 3.59Å; L345-Y365 HydrophobicContact CD1-CD2 4.29Å; L345-Y365 HydrophobicContact CD1-CE1 3.94Å; L345-Y365 HydrophobicContact CD1-CG 3.77Å; L345-Y365 HydrophobicContact CD2-CD1 4.12Å; L345-Y365 HydrophobicContact CD2-CD2 3.91Å; L345-Y365 HydrophobicContact CD2-CE1 3.76Å; L345-Y365 HydrophobicContact CD2-CE2 3.56Å; L345-Y365 HydrophobicContact CD2-CG 4.19Å; L345-Y365 VanDerWaalsContact CD2-CZ 3.46Å; L345-Y365 HydrophobicContact CG-CD1 3.75Å; L345-Y365 HydrophobicContact CG-CD2 4.41Å; L345-Y365 HydrophobicContact CG-CE1 3.52Å; L345-Y365 HydrophobicContact CG-CE2 4.25Å; L345-Y365 HydrophobicContact CG-CG 4.19Å
346	Q	80.3	Confident	82	Confident	104 Å²	104	49.4 Å²	49.4	49%	0.486	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-50.1	171.5	-178.1	178.2	-8.4	0	0	111.3	H342 C344 L348 A349 D350	H342-Q346 WeakPolarHBondContact O-CB 3.3Å; H342-Q346 PolarHBondContact O-N 2.79Å; C344-Q346 PolarHBondContact O-N 3.08Å; Q346-L348 VanDerWaalsContact C-N 3.32Å; Q346-L348 PolarHBondContact O-N 3.13Å; Q346-A349 WeakPolarHBondContact O-CA 3.33Å; Q346-A349 VanDerWaalsContact O-CB 3.31Å; Q346-A349 WeakPolarHBondContact O-CB 3.47Å; Q346-A349 PolarHBondContact O-N 3.24Å; Q346-D350 PolarHBondContact O-N 2.74Å
347	R	82.5	Confident	82.4	Confident	66 Å²	66	51.1 Å²	51.1	25%	0.249	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-40.6	179.1	-76.5	165.5	179.9	-162.5	-13.2	113.1	A299 V300 L343 C344 A349 D350 A351	A299-R347 PolarHBondContact O-NH1 3.06Å; A299-R347 PolarHBondContact O-NH2 3.17Å; V300-R347 HydrophobicContact CG1-CB 3.99Å; V300-R347 HydrophobicContact CG1-CG 4.02Å; V300-R347 HydrophobicContact CG2-CG 4.2Å; L343-R347 WeakPolarHBondContact O-CB 3.39Å; L343-R347 WeakPolarHBondContact O-CD 3.47Å; L343-R347 WeakPolarHBondContact O-CG 3.34Å; L343-R347 PolarHBondContact O-N 3.45Å; L343-R347 VanDerWaalsContact O-N 3.11Å; C344-R347 PolarHBondContact O-N 2.74Å; R347-A349 VanDerWaalsContact C-N 3.31Å; R347-A349 PolarHBondContact O-N 2.93Å; R347-D350 PolarHBondContact O-N 2.72Å; R347-A351 VanDerWaalsContact O-CB 3.29Å; R347-A351 WeakPolarHBondContact O-CB 3.28Å; R347-A351 PolarHBondContact O-N 3.18Å
348	L	86.7	Confident	82.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.5	-30.4	175.9	-67.1	165.1	0	0	0	111.9	R304 I307 C344 Q346 G352 A353 V354	R304-L348 HydrophobicContact CB-CD2 3.83Å; R304-L348 HydrophobicContact CG-CD2 3.57Å; I307-L348 HydrophobicContact CB-CD1 3.93Å; I307-L348 HydrophobicContact CD1-CD1 3.71Å; I307-L348 HydrophobicContact CG1-CD1 4.41Å; I307-L348 HydrophobicContact CG2-CD1 3.83Å; C344-L348 WeakPolarHBondContact O-CB 3.12Å; C344-L348 WeakPolarHBondContact O-CD1 3.45Å; C344-L348 WeakPolarHBondContact O-CG 3.35Å; C344-L348 PolarHBondContact O-N 2.8Å; Q346-L348 VanDerWaalsContact C-N 3.32Å; Q346-L348 PolarHBondContact O-N 3.13Å; L348-G352 PolarHBondContact O-N 3.12Å; L348-A353 HydrophobicContact CB-CB 4.1Å; L348-A353 HydrophobicContact CD2-CB 3.64Å; L348-A353 CarbonylContact O-C 3.54Å; L348-A353 WeakPolarHBondContact O-CA 3.1Å; L348-A353 WeakPolarHBondContact O-CB 3.4Å; L348-A353 PolarHBondContact O-N 3.29Å; L348-V354 HydrophobicContact CB-CB 4.04Å; L348-V354 HydrophobicContact CB-CG2 3.7Å; L348-V354 HydrophobicContact CD1-CG2 4.28Å; L348-V354 PolarHBondContact O-N 3.18Å
349	A	86.1	Confident	82.3	Confident	27 Å²	27	55.3 Å²	55.3	22%	0.223	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-47.8	170.4	0	0	0	0	0	111.5	L345 Q346 R347 A351 G352 V354 C356	L345-A349 PolarHBondContact O-N 2.99Å; L345-A349 VanDerWaalsContact O-N 3.14Å; Q346-A349 WeakPolarHBondContact O-CA 3.33Å; Q346-A349 VanDerWaalsContact O-CB 3.31Å; Q346-A349 WeakPolarHBondContact O-CB 3.47Å; Q346-A349 PolarHBondContact O-N 3.24Å; R347-A349 VanDerWaalsContact C-N 3.31Å; R347-A349 PolarHBondContact O-N 2.93Å; A349-A351 VanDerWaalsContact C-N 3.33Å; A349-A351 PolarHBondContact O-N 3.24Å; A349-G352 PolarHBondContact O-N 3.36Å; A349-V354 WeakPolarHBondContact CA-O 3.29Å; A349-C356 WeakPolarHBondContact CB-SG 3.44Å
350	D	77.3	Confident	82.2	Confident	123 Å²	123	55.2 Å²	55.2	66%	0.658	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-36.5	178.7	-65.2	-31.5	0	0	0	112.2	Q346 R347 G352	Q346-D350 PolarHBondContact O-N 2.74Å; R347-D350 PolarHBondContact O-N 2.72Å; D350-G352 PolarHBondContact O-N 2.78Å
351	A	79.1	Confident	81.8	Confident	47 Å²	47	54.2 Å²	54.2	39%	0.388	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.3	173.3	0	0	0	0	0	114	R347 A349 A353	R347-A351 VanDerWaalsContact O-CB 3.29Å; R347-A351 WeakPolarHBondContact O-CB 3.28Å; R347-A351 PolarHBondContact O-N 3.18Å; A349-A351 VanDerWaalsContact C-N 3.33Å; A349-A351 PolarHBondContact O-N 3.24Å; A351-A353 HydrophobicContact CB-CB 4.36Å; A351-A353 PolarHBondContact O-N 3.33Å
352	G	81.8	Confident	81.4	Confident	28 Å²	28	59 Å²	59	29%	0.289	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	18.1	-172.7	0	0	0	0	0	114	L348 A349 D350	L348-G352 PolarHBondContact O-N 3.12Å; A349-G352 PolarHBondContact O-N 3.36Å; D350-G352 PolarHBondContact O-N 2.78Å
353	A	79.5	Confident	81.5	Confident	6 Å²	6	59.4 Å²	59.4	5%	0.05	33%	0.334	C	S	.	.	S	Bend	trans	-80.7	-21.8	175.5	0	0	0	0	0	112.5	R304 L308 L348 A351 P368	R304-A353 VanDerWaalsContact NH2-CB 3.34Å; L308-A353 WeakPolarHBondContact CD2-O 3.47Å; L348-A353 HydrophobicContact CB-CB 4.1Å; L348-A353 HydrophobicContact CD2-CB 3.64Å; L348-A353 CarbonylContact O-C 3.54Å; L348-A353 WeakPolarHBondContact O-CA 3.1Å; L348-A353 WeakPolarHBondContact O-CB 3.4Å; L348-A353 PolarHBondContact O-N 3.29Å; A351-A353 HydrophobicContact CB-CB 4.36Å; A351-A353 PolarHBondContact O-N 3.33Å; A353-P368 WeakPolarHBondContact O-CD 3.31Å; A353-P368 WeakPolarHBondContact O-CG 3.38Å
354	V	88.3	Confident	81.9	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	32%	0.317	C	S	.	.	S	Bend	trans	-130.2	133.6	171.3	167.6	0	0	0	0	108	I307 L308 I311 L345 L348 A349 Y365 R366	I307-V354 HydrophobicContact CG2-CG2 4.07Å; L308-V354 HydrophobicContact CD2-CG2 3.62Å; L308-V354 HydrophobicContact CG-CG2 4.39Å; I311-V354 HydrophobicContact CD1-CG1 3.82Å; I311-V354 HydrophobicContact CD1-CG2 3.86Å; L345-V354 HydrophobicContact CD1-CG1 4.32Å; L348-V354 HydrophobicContact CB-CB 4.04Å; L348-V354 HydrophobicContact CB-CG2 3.7Å; L348-V354 HydrophobicContact CD1-CG2 4.28Å; L348-V354 PolarHBondContact O-N 3.18Å; A349-V354 WeakPolarHBondContact CA-O 3.29Å; V354-Y365 HydrophobicContact CG1-CD1 3.75Å; V354-Y365 HydrophobicContact CG1-CG 4.22Å; V354-R366 CarbonylContact C-O 3.48Å; V354-R366 WeakPolarHBondContact CA-O 3.45Å
355	V	85.5	Confident	82.3	Confident	46 Å²	46	56.9 Å²	56.9	28%	0.279	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.4	173.6	-165.4	0	0	0	0	109.8	V357 Y365 R366 P368	V355-V357 HydrophobicContact CG1-CG2 3.99Å; V355-Y365 CarbonylContact O-C 3.26Å; V355-Y365 WeakPolarHBondContact O-CA 3.46Å; V355-R366 HydrophobicContact CB-CB 4.14Å; V355-R366 HydrophobicContact CB-CG 4.44Å; V355-R366 PolarHBondContact N-O 2.83Å; V355-R366 PolarHBondContact O-N 2.67Å; V355-P368 HydrophobicContact CG2-CB 4.15Å; V355-P368 HydrophobicContact CG2-CG 3.88Å
356	C	84.9	Confident	82.4	Confident	57 Å²	57	59.8 Å²	59.8	39%	0.385	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.7	166.8	-69.3	0	0	0	0	110.6	A349 Y365	A349-C356 WeakPolarHBondContact CB-SG 3.44Å; C356-Y365 VanDerWaalsContact SG-CD1 3.58Å; C356-Y365 WeakPolarHBondContact SG-CE1 3.49Å
357	V	82.1	Confident	82.6	Confident	45 Å²	45	55.3 Å²	55.3	27%	0.273	31%	0.31	S	S	.	.			trans	-141.8	121.7	179.2	176.6	0	0	0	0	108.4	V355 Y359 S364 R366	V355-V357 HydrophobicContact CG1-CG2 3.99Å; V357-Y359 PolarHBondContact O-N 2.79Å; V357-S364 PolarHBondContact N-O 3.48Å; V357-S364 WeakPolarHBondContact O-CA 3.37Å; V357-S364 VanDerWaalsContact O-CB 3.31Å; V357-S364 WeakPolarHBondContact O-CB 3.41Å; V357-S364 PolarHBondContact O-N 3.37Å; V357-S364 VanDerWaalsContact O-O 3.11Å; V357-R366 HydrophobicContact CG2-CG 4.05Å
358	D	79.6	Confident	82.5	Confident	103 Å²	103	54 Å²	54	55%	0.551	31%	0.31	S	S	*	.			trans	-63	138.9	168.6	-168.3	-61.7	0	0	0	109.5	K360 G361	D358-K360 PolarHBondContact OD1-N 3.39Å; D358-G361 PolarHBondContact OD1-N 3.46Å
359	Y	75.9	Confident	81.7	Confident	131 Å²	131	57.1 Å²	57.1	51%	0.514	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-141.1	119.8	163.8	-179.5	-109	0	0	0	108.5	R320 V357 G361 N362	R320-Y359 PolarHBondContact NH1-O 3.17Å; R320-Y359 PolarHBondContact NH2-O 2.91Å; V357-Y359 PolarHBondContact O-N 2.79Å; Y359-G361 VanDerWaalsContact C-N 3.34Å; Y359-G361 PolarHBondContact O-N 3.28Å; Y359-N362 PolarHBondContact N-O 3.07Å; Y359-N362 VanDerWaalsContact N-O 3.11Å; Y359-N362 PolarHBondContact O-N 3.17Å
360	K	74.2	Confident	80.7	Confident	119 Å²	119	62 Å²	62	52%	0.517	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.7	179.4	-58	-173.1	177.2	-173.9	0	114.2	D358 N362 P581	D358-K360 PolarHBondContact OD1-N 3.39Å; K360-N362 VanDerWaalsContact C-N 3.34Å; K360-N362 PolarHBondContact O-N 3.01Å; K360-P581 HydrophobicContact CB-CG 4.44Å; K360-P581 HydrophobicContact CD-CG 4.34Å
361	G	70.9	Confident	79.7	Confident	63 Å²	63	61.1 Å²	61.1	65%	0.649	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	24.6	171.4	0	0	0	0	0	114.4	D358 Y359	D358-G361 PolarHBondContact OD1-N 3.46Å; Y359-G361 VanDerWaalsContact C-N 3.34Å; Y359-G361 PolarHBondContact O-N 3.28Å
362	N	78.3	Confident	78.2	Confident	101 Å²	101	67.7 Å²	67.7	54%	0.54	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-136.1	155.8	173.5	-86.1	-62.2	0	0	0	107.3	R320 Y359 K360	R320-N362 VanDerWaalsContact NH2-CB 3.32Å; R320-N362 PolarHBondContact NH2-O 3.24Å; Y359-N362 PolarHBondContact N-O 3.07Å; Y359-N362 VanDerWaalsContact N-O 3.11Å; Y359-N362 PolarHBondContact O-N 3.17Å; K360-N362 VanDerWaalsContact C-N 3.34Å; K360-N362 PolarHBondContact O-N 3.01Å
363	L	83.9	Confident	76.6	Confident	100 Å²	100	75 Å²	75	52%	0.524	37%	0.374	S	S	.	.			trans	-71.8	150.6	171	-68.4	173.6	0	0	0	111.1	R320 Y365	R320-L363 PolarHBondContact NE-O 3.19Å; R320-L363 VanDerWaalsContact NH2-C 3.32Å; R320-L363 PolarHBondContact NH2-O 3.13Å; L363-Y365 HydrophobicContact CB-CE2 4.27Å
364	S	90.4	Very high	74.5	Confident	5 Å²	5	79.9 Å²	79.9	4%	0.035	40%	0.404	C	S	.	.			trans	-147.6	140.5	171.7	-171.6	0	0	0	0	110.7	R315 P321 V357	R315-S364 PolarHBondContact NH2-OG 3.11Å; P321-S364 WeakPolarHBondContact CG-OG 3.33Å; P321-S364 CarbonylContact O-C 3.57Å; P321-S364 WeakPolarHBondContact O-CA 3.42Å; P321-S364 PolarHBondContact O-OG 3.34Å; P321-S364 VanDerWaalsContact O-OG 3.13Å; V357-S364 PolarHBondContact N-O 3.48Å; V357-S364 WeakPolarHBondContact O-CA 3.37Å; V357-S364 VanDerWaalsContact O-CB 3.31Å; V357-S364 WeakPolarHBondContact O-CB 3.41Å; V357-S364 PolarHBondContact O-N 3.37Å; V357-S364 VanDerWaalsContact O-O 3.11Å
365	Y	92.2	Very high	72.3	Confident	21 Å²	21	80.2 Å²	80.2	8%	0.082	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	151.8	-170.1	-57.1	-87.9	0	0	0	111.3	I311 R315 P321 F323 I326 L345 V354 V355 C356 L363	I311-Y365 WeakPolarHBondContact CG2-O 3.48Å; R315-Y365 PolarHBondContact NE-O 2.82Å; R315-Y365 PolarHBondContact NH2-O 3.35Å; P321-Y365 WeakPolarHBondContact CG-O 3.19Å; P321-Y365 PolarHBondContact O-N 2.98Å; F323-Y365 HydrophobicContact CB-CE2 4.43Å; I326-Y365 HydrophobicContact CD1-CD2 3.62Å; I326-Y365 HydrophobicContact CD1-CE2 4.5Å; I326-Y365 HydrophobicContact CD1-CG 4.04Å; L345-Y365 HydrophobicContact CD1-CD1 3.59Å; L345-Y365 HydrophobicContact CD1-CD2 4.29Å; L345-Y365 HydrophobicContact CD1-CE1 3.94Å; L345-Y365 HydrophobicContact CD1-CG 3.77Å; L345-Y365 HydrophobicContact CD2-CD1 4.12Å; L345-Y365 HydrophobicContact CD2-CD2 3.91Å; L345-Y365 HydrophobicContact CD2-CE1 3.76Å; L345-Y365 HydrophobicContact CD2-CE2 3.56Å; L345-Y365 HydrophobicContact CD2-CG 4.19Å; L345-Y365 VanDerWaalsContact CD2-CZ 3.46Å; L345-Y365 HydrophobicContact CG-CD1 3.75Å; L345-Y365 HydrophobicContact CG-CD2 4.41Å; L345-Y365 HydrophobicContact CG-CE1 3.52Å; L345-Y365 HydrophobicContact CG-CE2 4.25Å; L345-Y365 HydrophobicContact CG-CG 4.19Å; V354-Y365 HydrophobicContact CG1-CD1 3.75Å; V354-Y365 HydrophobicContact CG1-CG 4.22Å; V355-Y365 CarbonylContact O-C 3.26Å; V355-Y365 WeakPolarHBondContact O-CA 3.46Å; C356-Y365 VanDerWaalsContact SG-CD1 3.58Å; C356-Y365 WeakPolarHBondContact SG-CE1 3.49Å; L363-Y365 HydrophobicContact CB-CE2 4.27Å
366	R	90.2	Very high	70	Confident	61 Å²	61	81.5 Å²	81.5	23%	0.23	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.1	-178.6	-37.4	-156.8	166.2	-141.2	-1.5	111.8	V354 V355 V357 P368	V354-R366 CarbonylContact C-O 3.48Å; V354-R366 WeakPolarHBondContact CA-O 3.45Å; V355-R366 HydrophobicContact CB-CB 4.14Å; V355-R366 HydrophobicContact CB-CG 4.44Å; V355-R366 PolarHBondContact N-O 2.83Å; V355-R366 PolarHBondContact O-N 2.67Å; V357-R366 HydrophobicContact CG2-CG 4.05Å; R366-P368 WeakPolarHBondContact O-CD 3.36Å
367	N	85.3	Confident	68	Low	10 Å²	10	84.5 Å²	84.5	5%	0.053	44%	0.438	C	S	.	.			trans	-82.1	112.9	173.4	-177.5	-17.8	0	0	0	111.2	L308 D312 S369 K370 W371	L308-N367 HydrophobicContact CD2-CB 3.86Å; D312-N367 WeakPolarHBondContact OD1-CB 3.44Å; D312-N367 PolarHBondContact OD2-ND2 3.42Å; N367-S369 VanDerWaalsContact C-N 3.27Å; N367-S369 PolarHBondContact O-N 3.49Å; N367-S369 WeakPolarHBondContact OD1-CA 3.32Å; N367-S369 VanDerWaalsContact OD1-CB 3.3Å; N367-S369 WeakPolarHBondContact OD1-CB 3.29Å; N367-S369 PolarHBondContact OD1-N 2.85Å; N367-K370 HydrophobicContact CB-CB 4.48Å; N367-K370 PolarHBondContact OD1-N 3.32Å; N367-W371 WeakPolarHBondContact O-CB 3.44Å; N367-W371 PolarHBondContact O-N 3.22Å; N367-W371 VanDerWaalsContact O-N 3.12Å
368	P	81.2	Confident	65.9	Low	39 Å²	39	85.8 Å²	85.8	25%	0.253	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.9	178.7	-5.4	18.6	0	0	0	113.1	A353 V355 R366	A353-P368 WeakPolarHBondContact O-CD 3.31Å; A353-P368 WeakPolarHBondContact O-CG 3.38Å; V355-P368 HydrophobicContact CG2-CB 4.15Å; V355-P368 HydrophobicContact CG2-CG 3.88Å; R366-P368 WeakPolarHBondContact O-CD 3.36Å
369	S	68.7	Low	63.7	Low	66 Å²	66	81.7 Å²	81.7	46%	0.462	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-30.8	-175.2	-56.6	0	0	0	0	113.4	N367 R372	N367-S369 VanDerWaalsContact C-N 3.27Å; N367-S369 PolarHBondContact O-N 3.49Å; N367-S369 WeakPolarHBondContact OD1-CA 3.32Å; N367-S369 VanDerWaalsContact OD1-CB 3.3Å; N367-S369 WeakPolarHBondContact OD1-CB 3.29Å; N367-S369 PolarHBondContact OD1-N 2.85Å; S369-R372 PolarHBondContact O-NE 2.86Å; S369-R372 PolarHBondContact O-NH2 2.98Å; S369-R372 VanDerWaalsContact O-NH2 3.07Å
370	K	65	Low	62.3	Low	128 Å²	128	82.2 Å²	82.2	56%	0.557	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-13.9	171.6	-66.6	-167.2	-155.4	151.1	0	113.5	D312 N367 R372	D312-K370 WeakPolarHBondContact OD2-CD 3.06Å; D312-K370 WeakPolarHBondContact OD2-CE 3.12Å; D312-K370 IonicContact OD2-NZ 2.79Å; D312-K370 PolarHBondContact OD2-NZ 3.34Å; N367-K370 HydrophobicContact CB-CB 4.48Å; N367-K370 PolarHBondContact OD1-N 3.32Å; K370-R372 PolarHBondContact O-N 3.48Å
371	W	57.6	Low	60.9	Low	106 Å²	106	79 Å²	79	40%	0.402	45%	0.449	S	S	.	.			trans	-62.7	5.2	168.6	171.3	-104.9	0	0	0	114.5	N367 A375	N367-W371 WeakPolarHBondContact O-CB 3.44Å; N367-W371 PolarHBondContact O-N 3.22Å; N367-W371 VanDerWaalsContact O-N 3.12Å; W371-A375 HydrophobicContact CD2-CB 3.74Å; W371-A375 HydrophobicContact CG-CB 3.86Å; W371-A375 HydrophobicContact CZ2-CB 3.87Å; W371-A375 WeakPolarHBondContact O-CB 3.37Å
372	R	47.6	Very low	60.3	Low	184 Å²	184	77.7 Å²	77.7	69%	0.694	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	142.4	178.5	-97.1	-179.8	-77.2	-175.5	-3.8	112.7	S369 K370	S369-R372 PolarHBondContact O-NE 2.86Å; S369-R372 PolarHBondContact O-NH2 2.98Å; S369-R372 VanDerWaalsContact O-NH2 3.07Å; K370-R372 PolarHBondContact O-N 3.48Å
373	K	47.1	Very low	59.7	Low	181 Å²	181	76.3 Å²	76.3	79%	0.787	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.9	73.6	163.3	-56.7	179.5	179.8	-176.2	0	113.7
374	T	36.1	Very low	59.2	Low	110 Å²	110	72 Å²	72	68%	0.675	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn		-104.7	-4	54.9	-15.4	0	0	0	0	116.1	A376 T377	T374-A376 VanDerWaalsContact C-N 3.26Å; T374-A376 PolarHBondContact O-N 3.01Å; T374-T377 CarbonylContact O-C 3.51Å; T374-T377 WeakPolarHBondContact O-CA 3.5Å; T374-T377 WeakPolarHBondContact O-CB 3.01Å; T374-T377 PolarHBondContact O-N 3.24Å; T374-T377 PolarHBondContact O-OG1 2.88Å
375	A	42.4	Very low	58.5	Low	9 Å²	9	77 Å²	77	7%	0.074	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-79.5	-1.2	-176.1	0	0	0	0	0	115.6	W371 T377 S378 G379	W371-A375 HydrophobicContact CD2-CB 3.74Å; W371-A375 HydrophobicContact CG-CB 3.86Å; W371-A375 HydrophobicContact CZ2-CB 3.87Å; W371-A375 WeakPolarHBondContact O-CB 3.37Å; A375-T377 PolarHBondContact O-N 3.49Å; A375-S378 VanDerWaalsContact C-N 3.33Å; A375-S378 CarbonylContact O-C 3.59Å; A375-S378 PolarHBondContact O-N 3.49Å; A375-G379 WeakPolarHBondContact O-CA 3.22Å; A375-G379 PolarHBondContact O-N 2.96Å
376	A	36.9	Very low	57.5	Low	73 Å²	73	77.2 Å²	77.2	60%	0.603	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-64	-15.7	155.5	0	0	0	0	0	111.8	T374	T374-A376 VanDerWaalsContact C-N 3.26Å; T374-A376 PolarHBondContact O-N 3.01Å
377	T	41.5	Very low	57	Low	119 Å²	119	75.1 Å²	75.1	73%	0.73	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-109.4	22.5	168.7	-33.6	0	0	0	0	110.8	T374 A375	T374-T377 CarbonylContact O-C 3.51Å; T374-T377 WeakPolarHBondContact O-CA 3.5Å; T374-T377 WeakPolarHBondContact O-CB 3.01Å; T374-T377 PolarHBondContact O-N 3.24Å; T374-T377 PolarHBondContact O-OG1 2.88Å; A375-T377 PolarHBondContact O-N 3.49Å
378	S	39.5	Very low	56.8	Low	72 Å²	72	75.3 Å²	75.3	50%	0.503	43%	0.426	S	S	.	.	S	Bend	trans	-156.9	50.4	174.6	-53.5	0	0	0	0	111.5	A375 T380	A375-S378 VanDerWaalsContact C-N 3.33Å; A375-S378 CarbonylContact O-C 3.59Å; A375-S378 PolarHBondContact O-N 3.49Å; S378-T380 PolarHBondContact O-N 3.02Å
379	G	33.2	Very low	57	Low	18 Å²	18	73.9 Å²	73.9	19%	0.186	42%	0.417	C	S	.	.			trans	-91.4	20.6	-158.8	0	0	0	0	0	118.7	A375 G381 N382	A375-G379 WeakPolarHBondContact O-CA 3.22Å; A375-G379 PolarHBondContact O-N 2.96Å; G379-G381 VanDerWaalsContact C-N 3.29Å; G379-G381 PolarHBondContact O-N 3.14Å; G379-N382 WeakPolarHBondContact O-CB 3.49Å; G379-N382 VanDerWaalsContact O-CG 3.25Å; G379-N382 PolarHBondContact O-N 2.99Å; G379-N382 PolarHBondContact O-OD1 3.31Å
380	T	45.1	Very low	57.5	Low	142 Å²	142	71.9 Å²	71.9	87%	0.871	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	4.6	-172.1	-23.2	0	0	0	0	115.1	S378	S378-T380 PolarHBondContact O-N 3.02Å
381	G	46.7	Very low	58.6	Low	50 Å²	50	68 Å²	68	52%	0.515	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-0.6	164.7	0	0	0	0	0	113.4	G379 R463	G379-G381 VanDerWaalsContact C-N 3.29Å; G379-G381 PolarHBondContact O-N 3.14Å; G381-R463 PolarHBondContact O-NH2 3.4Å
382	N	57.5	Low	60.1	Low	37 Å²	37	63 Å²	63	20%	0.198	36%	0.364	C	S	.	.			trans	-108.1	6.6	-154.3	-54	16.9	0	0	0	114.7	G379 R463 H467	G379-N382 WeakPolarHBondContact O-CB 3.49Å; G379-N382 VanDerWaalsContact O-CG 3.25Å; G379-N382 PolarHBondContact O-N 2.99Å; G379-N382 PolarHBondContact O-OD1 3.31Å; N382-R463 WeakPolarHBondContact O-CD 3.39Å; N382-R463 WeakPolarHBondContact O-CG 3.3Å; N382-R463 PolarHBondContact O-NE 3.41Å; N382-H467 HydrophobicContact CB-CB 4.39Å; N382-H467 WeakPolarHBondContact CB-CD2 3.21Å; N382-H467 VanDerWaalsContact CB-NE2 3.3Å; N382-H467 WeakPolarHBondContact CB-NE2 3.46Å; N382-H467 PolarHBondContact ND2-CE1 2.94Å; N382-H467 PolarHBondContact ND2-NE2 3.13Å; N382-H467 VanDerWaalsContact ND2-NE2 3.13Å
383	T	66	Low	62	Low	72 Å²	72	54.2 Å²	54.2	44%	0.442	33%	0.332	S	S	.	.	S	Bend	trans	-79.5	157.7	176.7	45	0	0	0	0	112.8	R463 H467	T383-R463 VanDerWaalsContact C-NE 3.28Å; T383-R463 PolarHBondContact O-NE 3.42Å; T383-R463 PolarHBondContact O-NH2 3.25Å; T383-H467 HydrophobicContact CG2-CB 3.92Å; T383-H467 WeakPolarHBondContact CG2-O 3.32Å
384	N	72	Confident	63.8	Low	9 Å²	9	47.4 Å²	47.4	5%	0.048	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-60.2	161.6	175.9	-78.6	-60	0	0	0	112.8	P386 V388 C460 R463 E464	N384-P386 WeakPolarHBondContact O-CD 3.37Å; N384-V388 HydrophobicContact CB-CB 4.39Å; N384-V388 HydrophobicContact CB-CG1 4.46Å; N384-C460 PolarHBondContact ND2-O 2.95Å; N384-C460 WeakPolarHBondContact OD1-CA 3.44Å; N384-C460 WeakPolarHBondContact OD1-CB 3.21Å; N384-C460 PolarHBondContact OD1-SG 3.24Å; N384-C460 VanDerWaalsContact OD1-SG 3.33Å; N384-R463 WeakPolarHBondContact OD1-CD 3.19Å; N384-E464 PolarHBondContact ND2-N 2.89Å; N384-E464 PolarHBondContact ND2-OE2 3.06Å
385	L	75.7	Confident	66.2	Low	109 Å²	109	42.2 Å²	42.2	57%	0.571	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-54.4	126.4	162.6	175.7	73.9	0	0	0	108	S387 V388	L385-S387 PolarHBondContact O-N 3.23Å; L385-S387 VanDerWaalsContact O-N 3.15Å; L385-V388 HydrophobicContact CB-CG2 4.41Å; L385-V388 WeakPolarHBondContact O-CB 3.46Å; L385-V388 PolarHBondContact O-N 2.9Å
386	P	72.2	Confident	68.4	Low	27 Å²	27	41.8 Å²	41.8	18%	0.175	27%	0.268	C	S	.	.	H	α-helix	trans	-19.6	-74.5	173.9	-16.1	-7.8	0	0	0	117	T230 P231 I232 N384 V388 S389	T230-P386 HydrophobicContact CG2-CG 3.78Å; P231-P386 HydrophobicContact CB-CB 3.65Å; P231-P386 HydrophobicContact CB-CG 3.78Å; I232-P386 HydrophobicContact CB-CB 4.44Å; I232-P386 HydrophobicContact CG1-CB 4.07Å; I232-P386 VanDerWaalsContact CG2-C 3.4Å; I232-P386 HydrophobicContact CG2-CB 4.45Å; I232-P386 WeakPolarHBondContact CG2-O 3.31Å; N384-P386 WeakPolarHBondContact O-CD 3.37Å; P386-V388 PolarHBondContact O-N 3.49Å; P386-S389 PolarHBondContact O-N 2.78Å
387	S	79.6	Confident	70.7	Confident	17 Å²	17	41.7 Å²	41.7	12%	0.119	25%	0.252	C	S	.	.	H	α-helix	trans	-51.6	-30.2	-173.5	176.5	0	0	0	0	114.2	Y233 L385 K391 I449	Y233-S387 VanDerWaalsContact CE2-OG 3.32Å; Y233-S387 WeakPolarHBondContact CE2-OG 3.46Å; Y233-S387 PolarHBondContact OH-OG 3.25Å; L385-S387 PolarHBondContact O-N 3.23Å; L385-S387 VanDerWaalsContact O-N 3.15Å; S387-K391 WeakPolarHBondContact O-CG 3.41Å; S387-K391 PolarHBondContact O-N 3.33Å; S387-I449 VanDerWaalsContact OG-CD1 3.32Å; S387-I449 WeakPolarHBondContact OG-CD1 3.23Å
388	V	80.9	Confident	72.8	Confident	14 Å²	14	38.1 Å²	38.1	9%	0.085	23%	0.232	C	C	.	.	H	α-helix	trans	-72.4	-45	178.4	177.7	0	0	0	0	111.4	N384 L385 P386 H390 K391 L392 L452 C460	N384-V388 HydrophobicContact CB-CB 4.39Å; N384-V388 HydrophobicContact CB-CG1 4.46Å; L385-V388 HydrophobicContact CB-CG2 4.41Å; L385-V388 WeakPolarHBondContact O-CB 3.46Å; L385-V388 PolarHBondContact O-N 2.9Å; P386-V388 PolarHBondContact O-N 3.49Å; V388-H390 PolarHBondContact O-N 2.91Å; V388-K391 PolarHBondContact O-N 3.4Å; V388-K391 VanDerWaalsContact O-N 3.12Å; V388-L392 HydrophobicContact CG1-CD1 4.11Å; V388-L392 HydrophobicContact CG1-CG 4.23Å; V388-L392 WeakPolarHBondContact O-CG 3.35Å; V388-L392 PolarHBondContact O-N 3.21Å; V388-L452 HydrophobicContact CG1-CD1 4.23Å; V388-L452 HydrophobicContact CG1-CD2 4.16Å; V388-L452 HydrophobicContact CG2-CD1 4.45Å; V388-C460 HydrophobicContact CG1-CB 3.67Å
389	S	85.9	Confident	74.9	Confident	9 Å²	9	34.7 Å²	34.7	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-56.7	-46.5	-177.1	162.1	0	0	0	0	112.3	I232 P386 L392 V393 E464	I232-S389 WeakPolarHBondContact CD1-OG 3.08Å; P386-S389 PolarHBondContact O-N 2.78Å; S389-L392 PolarHBondContact O-N 2.85Å; S389-V393 WeakPolarHBondContact O-CB 3.14Å; S389-V393 WeakPolarHBondContact O-CG2 3.49Å; S389-V393 PolarHBondContact O-N 2.85Å; S389-E464 WeakPolarHBondContact CB-OE1 3.03Å; S389-E464 VanDerWaalsContact CB-OE2 3.3Å; S389-E464 WeakPolarHBondContact CB-OE2 3.21Å; S389-E464 VanDerWaalsContact OG-CD 3.25Å; S389-E464 PolarHBondContact OG-OE1 3.36Å; S389-E464 PolarHBondContact OG-OE2 2.94Å
390	H	78.4	Confident	77.2	Confident	23 Å²	23	37.4 Å²	37.4	11%	0.106	22%	0.217	C	C	.	.	H	α-helix	trans	-73	-34.4	175.3	-78.1	-155.4	0	0	0	113.3	I232 Y233 T234 V388 L392 V393 D394 K469	I232-H390 WeakPolarHBondContact CD1-CD2 3.48Å; I232-H390 HydrophobicContact CG2-CB 3.48Å; I232-H390 VanDerWaalsContact CG2-CB 3.48Å; Y233-H390 HydrophobicContact CG-CB 4.45Å; Y233-H390 PolarHBondContact O-CE1 3.26Å; Y233-H390 PolarHBondContact O-ND1 2.91Å; T234-H390 PolarHBondContact OG1-ND1 2.85Å; T234-H390 VanDerWaalsContact OG1-ND1 3.11Å; V388-H390 PolarHBondContact O-N 2.91Å; H390-L392 PolarHBondContact O-N 2.79Å; H390-V393 PolarHBondContact O-N 3.05Å; H390-D394 VanDerWaalsContact O-CB 3.25Å; H390-D394 WeakPolarHBondContact O-CB 3.47Å; H390-D394 VanDerWaalsContact O-CG 3.26Å; H390-D394 PolarHBondContact O-N 2.83Å; H390-K469 PolarHBondContact NE2-NZ 2.86Å
391	K	89.3	Confident	78.5	Confident	47 Å²	47	35.9 Å²	35.9	20%	0.204	20%	0.2	C	C	.	.	H	α-helix	trans	-55.2	-40.9	171.4	-83.4	-165.6	173.6	-151.8	0	111.5	S387 V388 A395 L436 N440 L452	S387-K391 WeakPolarHBondContact O-CG 3.41Å; S387-K391 PolarHBondContact O-N 3.33Å; V388-K391 PolarHBondContact O-N 3.4Å; V388-K391 VanDerWaalsContact O-N 3.12Å; K391-A395 WeakPolarHBondContact O-CB 3.39Å; K391-A395 PolarHBondContact O-N 3.44Å; K391-A395 VanDerWaalsContact O-N 3.11Å; K391-L436 HydrophobicContact CB-CD2 3.92Å; K391-L436 WeakPolarHBondContact O-CD2 3.42Å; K391-N440 PolarHBondContact NZ-OD1 2.89Å; K391-L452 HydrophobicContact CB-CD1 4.13Å; K391-L452 HydrophobicContact CD-CD1 3.78Å
392	L	89.1	Confident	79.5	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-45.5	176.1	-61.1	178.8	0	0	0	113.1	V388 S389 H390 I396 L436 L452 L457 C460 L461 E464 L470	V388-L392 HydrophobicContact CG1-CD1 4.11Å; V388-L392 HydrophobicContact CG1-CG 4.23Å; V388-L392 WeakPolarHBondContact O-CG 3.35Å; V388-L392 PolarHBondContact O-N 3.21Å; S389-L392 PolarHBondContact O-N 2.85Å; H390-L392 PolarHBondContact O-N 2.79Å; L392-I396 PolarHBondContact O-N 2.84Å; L392-I396 VanDerWaalsContact O-N 3.1Å; L392-L436 HydrophobicContact CD2-CD1 4.14Å; L392-L452 HydrophobicContact CD2-CD2 4.06Å; L392-L457 HydrophobicContact CD2-CD1 3.47Å; L392-L457 VanDerWaalsContact CD2-CD1 3.47Å; L392-C460 HydrophobicContact CD1-CB 3.93Å; L392-C460 WeakPolarHBondContact CD1-O 3.3Å; L392-L461 HydrophobicContact CB-CD2 4.23Å; L392-L461 HydrophobicContact CD1-CD2 4.1Å; L392-L461 HydrophobicContact CD1-CG 4.26Å; L392-L461 HydrophobicContact CD2-CD2 3.89Å; L392-L461 HydrophobicContact CD2-CG 3.95Å; L392-L461 HydrophobicContact CG-CD2 4.29Å; L392-E464 HydrophobicContact CD1-CB 4.17Å; L392-L470 HydrophobicContact CB-CD1 4.31Å
393	V	87.3	Confident	79.7	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-44.1	179.5	158.9	0	0	0	0	111.7	S389 H390 I396 R397 K469 L470 L480	S389-V393 WeakPolarHBondContact O-CB 3.14Å; S389-V393 WeakPolarHBondContact O-CG2 3.49Å; S389-V393 PolarHBondContact O-N 2.85Å; H390-V393 PolarHBondContact O-N 3.05Å; V393-I396 PolarHBondContact O-N 3.35Å; V393-R397 VanDerWaalsContact CG1-NH2 3.28Å; V393-R397 PolarHBondContact O-N 2.88Å; V393-K469 HydrophobicContact CG2-CB 3.96Å; V393-K469 HydrophobicContact CG2-CD 4.3Å; V393-L470 HydrophobicContact CG2-CD2 4.26Å; V393-L480 HydrophobicContact CB-CD2 4.36Å; V393-L480 HydrophobicContact CG1-CD2 3.92Å; V393-L480 HydrophobicContact CG2-CD2 4.13Å
394	D	84.4	Confident	79.4	Confident	38 Å²	38	37.7 Å²	37.7	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-74.9	-32.7	-177.7	-63.4	-19.2	0	0	0	111.1	T234 H390 R397 S398	T234-D394 PolarHBondContact OG1-OD2 2.96Å; H390-D394 VanDerWaalsContact O-CB 3.25Å; H390-D394 WeakPolarHBondContact O-CB 3.47Å; H390-D394 VanDerWaalsContact O-CG 3.26Å; H390-D394 PolarHBondContact O-N 2.83Å; D394-R397 PolarHBondContact O-N 2.87Å; D394-R397 IonicContact OD1-CZ 3.24Å; D394-R397 IonicContact OD1-NH1 2.87Å; D394-R397 PolarHBondContact OD1-NH1 3.45Å; D394-S398 VanDerWaalsContact O-CB 3.3Å; D394-S398 WeakPolarHBondContact O-CB 3.25Å; D394-S398 PolarHBondContact O-N 3.37Å
395	A	87.2	Confident	78.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-40.8	169.1	0	0	0	0	0	112.8	K391 L399 V432 A435 L436 L439	K391-A395 WeakPolarHBondContact O-CB 3.39Å; K391-A395 PolarHBondContact O-N 3.44Å; K391-A395 VanDerWaalsContact O-N 3.11Å; A395-L399 WeakPolarHBondContact O-CG 3.41Å; A395-L399 PolarHBondContact O-N 3.32Å; A395-L399 VanDerWaalsContact O-N 3.12Å; A395-V432 HydrophobicContact CB-CG1 4.04Å; A395-A435 HydrophobicContact CB-CB 4.09Å; A395-L436 HydrophobicContact CB-CD2 3.93Å; A395-L436 HydrophobicContact CB-CG 3.82Å; A395-L439 HydrophobicContact CB-CD1 4.07Å
396	I	88.8	Confident	77.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-71.5	-37.9	176.6	-73.2	168.2	0	0	0	111.6	L392 V393 L399 M400 Y427 V432 L461 L470 L480	L392-I396 PolarHBondContact O-N 2.84Å; L392-I396 VanDerWaalsContact O-N 3.1Å; V393-I396 PolarHBondContact O-N 3.35Å; I396-L399 PolarHBondContact O-N 3.21Å; I396-M400 WeakPolarHBondContact O-CG 3.26Å; I396-M400 PolarHBondContact O-N 2.78Å; I396-M400 VanDerWaalsContact O-N 3.08Å; I396-Y427 HydrophobicContact CG2-CD2 3.93Å; I396-Y427 HydrophobicContact CG2-CE2 4.36Å; I396-V432 HydrophobicContact CD1-CG2 4.12Å; I396-V432 HydrophobicContact CG1-CG1 4.29Å; I396-V432 HydrophobicContact CG1-CG2 3.7Å; I396-L461 HydrophobicContact CD1-CD2 4.14Å; I396-L470 HydrophobicContact CD1-CD1 3.5Å; I396-L470 VanDerWaalsContact CD1-CD1 3.5Å; I396-L470 HydrophobicContact CD1-CD2 3.63Å; I396-L470 HydrophobicContact CD1-CG 4.22Å; I396-L480 HydrophobicContact CG2-CD1 3.98Å; I396-L480 HydrophobicContact CG2-CG 3.8Å
397	R	84.3	Confident	75.7	Confident	72 Å²	72	46.6 Å²	46.6	27%	0.272	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-43.1	174.4	-162.7	176.2	-61.4	97.7	1.5	111.8	V393 D394 L399 M400 E401 L480 E482	V393-R397 VanDerWaalsContact CG1-NH2 3.28Å; V393-R397 PolarHBondContact O-N 2.88Å; D394-R397 PolarHBondContact O-N 2.87Å; D394-R397 IonicContact OD1-CZ 3.24Å; D394-R397 IonicContact OD1-NH1 2.87Å; D394-R397 PolarHBondContact OD1-NH1 3.45Å; R397-L399 VanDerWaalsContact C-N 3.3Å; R397-L399 PolarHBondContact O-N 2.92Å; R397-M400 WeakPolarHBondContact O-CB 3.43Å; R397-M400 PolarHBondContact O-N 3.42Å; R397-E401 PolarHBondContact O-N 2.98Å; R397-L480 HydrophobicContact CB-CD1 4Å; R397-L480 HydrophobicContact CG-CD1 4.46Å; R397-E482 IonicContact CZ-OE1 2.65Å; R397-E482 IonicContact NH2-OE1 2.71Å; R397-E482 PolarHBondContact NH2-OE1 2.85Å
398	S	86.1	Confident	73.6	Confident	43 Å²	43	50.2 Å²	50.2	30%	0.301	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-39.1	174.5	-177.1	0	0	0	0	112.5	D394 E401 S402	D394-S398 VanDerWaalsContact O-CB 3.3Å; D394-S398 WeakPolarHBondContact O-CB 3.25Å; D394-S398 PolarHBondContact O-N 3.37Å; S398-E401 PolarHBondContact O-N 3.21Å; S398-S402 WeakPolarHBondContact O-CB 3.25Å; S398-S402 PolarHBondContact O-N 2.8Å
399	L	83.8	Confident	71.5	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-41.3	173.3	-72.7	164.5	0	0	0	112.4	A395 I396 R397 S402 N403 Y427 Q431 V432 A435	A395-L399 WeakPolarHBondContact O-CG 3.41Å; A395-L399 PolarHBondContact O-N 3.32Å; A395-L399 VanDerWaalsContact O-N 3.12Å; I396-L399 PolarHBondContact O-N 3.21Å; R397-L399 VanDerWaalsContact C-N 3.3Å; R397-L399 PolarHBondContact O-N 2.92Å; L399-S402 PolarHBondContact O-N 2.75Å; L399-S402 PolarHBondContact O-OG 3Å; L399-N403 PolarHBondContact O-N 3.49Å; L399-N403 PolarHBondContact O-ND2 2.97Å; L399-Y427 HydrophobicContact CB-CD1 3.65Å; L399-Y427 HydrophobicContact CB-CD2 4.27Å; L399-Y427 HydrophobicContact CB-CE1 3.63Å; L399-Y427 HydrophobicContact CB-CE2 4.25Å; L399-Y427 HydrophobicContact CB-CG 3.99Å; L399-Y427 HydrophobicContact CD1-CD1 3.83Å; L399-Y427 HydrophobicContact CD1-CG 3.76Å; L399-Y427 HydrophobicContact CD2-CD1 4.46Å; L399-Y427 HydrophobicContact CG-CD1 4.2Å; L399-Y427 HydrophobicContact CG-CG 4.48Å; L399-Q431 HydrophobicContact CD1-CB 3.98Å; L399-Q431 HydrophobicContact CD2-CB 4.18Å; L399-V432 HydrophobicContact CD1-CG2 4.07Å; L399-A435 HydrophobicContact CD1-CB 3.99Å; L399-A435 HydrophobicContact CD2-CB 4.06Å; L399-A435 HydrophobicContact CG-CB 3.78Å
400	M	81.8	Confident	69	Low	75 Å²	75	63.9 Å²	63.9	37%	0.369	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-48.9	174.4	-67.7	174.7	65.5	0	0	111.7	I396 R397 S402 N403 L404 Y427 L480	I396-M400 WeakPolarHBondContact O-CG 3.26Å; I396-M400 PolarHBondContact O-N 2.78Å; I396-M400 VanDerWaalsContact O-N 3.08Å; R397-M400 WeakPolarHBondContact O-CB 3.43Å; R397-M400 PolarHBondContact O-N 3.42Å; M400-S402 VanDerWaalsContact C-N 3.32Å; M400-S402 PolarHBondContact O-N 3.08Å; M400-N403 PolarHBondContact O-N 2.75Å; M400-N403 VanDerWaalsContact O-N 3.12Å; M400-L404 VanDerWaalsContact O-CD1 3.26Å; M400-L404 WeakPolarHBondContact O-CD1 3.3Å; M400-L404 PolarHBondContact O-N 3.38Å; M400-Y427 WeakPolarHBondContact CA-OH 3.48Å; M400-Y427 HydrophobicContact CG-CE2 3.53Å; M400-Y427 WeakPolarHBondContact CG-OH 3.5Å; M400-L480 HydrophobicContact SD-CB 4.48Å; M400-L480 HydrophobicContact SD-CD1 3.93Å
401	E	71.6	Confident	66.7	Low	109 Å²	109	69.1 Å²	69.1	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-66.2	-33.1	-179.8	-71.1	156.5	172.1	0	0	112.3	R397 S398 N403 L404 S405	R397-E401 PolarHBondContact O-N 2.98Å; S398-E401 PolarHBondContact O-N 3.21Å; E401-N403 PolarHBondContact O-N 3.45Å; E401-L404 PolarHBondContact O-N 3.01Å; E401-S405 PolarHBondContact O-N 3.12Å; E401-S405 PolarHBondContact O-OG 3.32Å
402	S	68.4	Low	63.9	Low	31 Å²	31	71.2 Å²	71.2	22%	0.217	40%	0.404	C	S	.	.	H	α-helix	trans	-63.1	-26.1	173.6	81.5	0	0	0	0	113.6	S398 L399 M400 S419	S398-S402 WeakPolarHBondContact O-CB 3.25Å; S398-S402 PolarHBondContact O-N 2.8Å; L399-S402 PolarHBondContact O-N 2.75Å; L399-S402 PolarHBondContact O-OG 3Å; M400-S402 VanDerWaalsContact C-N 3.32Å; M400-S402 PolarHBondContact O-N 3.08Å; S402-S419 VanDerWaalsContact OG-CB 3.31Å; S402-S419 WeakPolarHBondContact OG-CB 3.2Å; S402-S419 PolarHBondContact OG-OG 3.2Å
403	N	61.2	Low	61.4	Low	21 Å²	21	76 Å²	76	11%	0.112	43%	0.434	C	S	.	.	H	α-helix	trans	-87.9	-24.6	178.7	-72.5	-53.8	0	0	0	114.1	L399 M400 E401 S405 S406 S419 Q420 Y427	L399-N403 PolarHBondContact O-N 3.49Å; L399-N403 PolarHBondContact O-ND2 2.97Å; M400-N403 PolarHBondContact O-N 2.75Å; M400-N403 VanDerWaalsContact O-N 3.12Å; E401-N403 PolarHBondContact O-N 3.45Å; N403-S405 VanDerWaalsContact C-N 3.26Å; N403-S406 PolarHBondContact O-OG 2.82Å; N403-S406 VanDerWaalsContact O-OG 3.09Å; N403-S419 PolarHBondContact ND2-O 3.49Å; N403-S419 WeakPolarHBondContact OD1-CB 3.45Å; N403-S419 PolarHBondContact OD1-O 2.88Å; N403-Q420 VanDerWaalsContact OD1-CA 3.27Å; N403-Q420 WeakPolarHBondContact OD1-CA 3.42Å; N403-Q420 PolarHBondContact OD1-N 3.45Å; N403-Q420 PolarHBondContact OD1-NE2 2.97Å; N403-Y427 WeakPolarHBondContact ND2-CE1 3Å; N403-Y427 PolarHBondContact ND2-OH 3.32Å
404	L	59.5	Low	59.2	Low	146 Å²	146	83.6 Å²	83.6	76%	0.764	47%	0.474	S	S	*	.	H	α-helix	trans	-73.6	-24.1	170.5	-83.5	75.4	0	0	0	111.5	M400 E401 S406	M400-L404 VanDerWaalsContact O-CD1 3.26Å; M400-L404 WeakPolarHBondContact O-CD1 3.3Å; M400-L404 PolarHBondContact O-N 3.38Å; E401-L404 PolarHBondContact O-N 3.01Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 2.66Å
405	S	52.1	Low	57.3	Low	71 Å²	71	87.4 Å²	87.4	50%	0.497	49%	0.494	S	S	.	.	S	Bend	trans	-76.6	-11.7	-175.5	-58.4	0	0	0	0	114.7	E401 N403 Q407	E401-S405 PolarHBondContact O-N 3.12Å; E401-S405 PolarHBondContact O-OG 3.32Å; N403-S405 VanDerWaalsContact C-N 3.26Å; S405-Q407 PolarHBondContact O-N 2.84Å
406	S	48	Very low	55.7	Low	80 Å²	80	89.2 Å²	89.2	56%	0.559	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	23	-176	50	0	0	0	0	115.6	N403 L404	N403-S406 PolarHBondContact O-OG 2.82Å; N403-S406 VanDerWaalsContact O-OG 3.09Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-S406 PolarHBondContact O-N 2.66Å
407	Q	41.8	Very low	53.5	Low	180 Å²	180	92.4 Å²	92.4	84%	0.841	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	32.6	176.9	-66.7	-164.6	14.2	0	0	114.8	S405	S405-Q407 PolarHBondContact O-N 2.84Å
408	S	36.6	Very low	52	Low	94 Å²	94	96.7 Å²	96.7	66%	0.657	55%	0.545	S	S	*	.	S	Bend	trans	-164.6	148	152.9	25.9	0	0	0	0	113.8
409	T	35.8	Very low	50.7	Low	121 Å²	121	95.6 Å²	95.6	74%	0.742	54%	0.537	S	S	*	.			trans	38.3	89.9	155.6	53.7	0	0	0	0	118.6
410	Q	33.6	Very low	49.9	Very low	188 Å²	188	101.1 Å²	101.1	88%	0.879	56%	0.563	S	S	*	*	S	Bend	trans	19.6	136.6	132.3	-60.8	173.7	-2	0	0	119
411	S	31.1	Very low	49.6	Very low	133 Å²	133	99.9 Å²	99.9	93%	0.93	56%	0.56	S	S	*	*	S	Bend	trans	100.1	12.6	175.1	77.2	0	0	0	0	118.4
412	C	28.8	Very low	49.8	Very low	91 Å²	91	95.1 Å²	95.1	62%	0.615	54%	0.541	S	S	*	.			trans	-138.4	175.8	164	62.5	0	0	0	0	112.1
413	T	38.3	Very low	50	Low	102 Å²	102	99.1 Å²	99.1	63%	0.626	57%	0.566	S	S	*	*			trans	88.8	-11.5	177.4	74.3	0	0	0	0	120.8	L415 I416	T413-L415 PolarHBondContact O-N 2.74Å; T413-I416 PolarHBondContact O-N 2.87Å
414	N	41.1	Very low	50.5	Low	159 Å²	159	101.7 Å²	101.7	85%	0.85	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	11.6	-168.3	-84.3	-5	0	0	0	119.8
415	L	44.3	Very low	51.5	Low	118 Å²	118	96.2 Å²	96.2	62%	0.618	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	-7	-179	-71.4	169.1	0	0	0	115.2	T413 P417 R434 F438	T413-L415 PolarHBondContact O-N 2.74Å; L415-P417 WeakPolarHBondContact O-CD 3.4Å; L415-R434 PolarHBondContact O-NE 2.83Å; L415-R434 VanDerWaalsContact O-NE 3.07Å; L415-R434 PolarHBondContact O-NH2 2.9Å; L415-F438 HydrophobicContact CB-CE1 3.59Å; L415-F438 HydrophobicContact CB-CE2 4.43Å; L415-F438 HydrophobicContact CB-CZ 3.56Å; L415-F438 HydrophobicContact CD1-CE1 4.08Å; L415-F438 HydrophobicContact CG-CE1 4.34Å; L415-F438 VanDerWaalsContact O-CE2 3.28Å; L415-F438 WeakPolarHBondContact O-CE2 3.45Å; L415-F438 WeakPolarHBondContact O-CZ 3.5Å
416	I	51.8	Low	53.2	Low	39 Å²	39	92.9 Å²	92.9	20%	0.2	54%	0.535	C	S	.	.			trans	-117.8	84.1	167.1	-52.8	-178.3	0	0	0	110.6	T413 R434 F438	T413-I416 PolarHBondContact O-N 2.87Å; I416-R434 HydrophobicContact CG1-CG 4.4Å; I416-R434 HydrophobicContact CG2-CG 4.47Å; I416-F438 HydrophobicContact CD1-CD2 3.64Å; I416-F438 HydrophobicContact CD1-CE2 4.24Å; I416-F438 HydrophobicContact CD1-CG 4.38Å; I416-F438 HydrophobicContact CG1-CD2 3.47Å; I416-F438 VanDerWaalsContact CG1-CD2 3.47Å; I416-F438 HydrophobicContact CG1-CE2 3.54Å; I416-F438 HydrophobicContact CG1-CG 4.39Å; I416-F438 HydrophobicContact CG1-CZ 4.48Å
417	P	43.1	Very low	55.2	Low	67 Å²	67	89.4 Å²	89.4	44%	0.435	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	138.3	154.2	-18.3	32.4	0	0	0	109.3	L415	L415-P417 WeakPolarHBondContact O-CD 3.4Å
418	F	52.8	Low	57.4	Low	162 Å²	162	82.4 Å²	82.4	71%	0.711	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	44.4	177.9	-42.9	-73.6	0	0	0	116.8	Q420 Q431	F418-Q420 PolarHBondContact O-N 3.36Å; F418-Q431 PolarHBondContact O-NE2 3.5Å
419	S	58.9	Low	60	Low	20 Å²	20	79.5 Å²	79.5	14%	0.14	46%	0.458	C	S	.	.			trans	-59.9	-29.1	165.3	-77.4	0	0	0	0	114.2	S402 N403 Q431	S402-S419 VanDerWaalsContact OG-CB 3.31Å; S402-S419 WeakPolarHBondContact OG-CB 3.2Å; S402-S419 PolarHBondContact OG-OG 3.2Å; N403-S419 PolarHBondContact ND2-O 3.49Å; N403-S419 WeakPolarHBondContact OD1-CB 3.45Å; N403-S419 PolarHBondContact OD1-O 2.88Å; S419-Q431 PolarHBondContact O-NE2 3.46Å
420	Q	67.4	Low	62.5	Low	117 Å²	117	79.1 Å²	79.1	55%	0.547	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-52.9	136.3	-166.6	-70.2	-66.3	-48	0	0	114.3	N403 F418 Q431	N403-Q420 VanDerWaalsContact OD1-CA 3.27Å; N403-Q420 WeakPolarHBondContact OD1-CA 3.42Å; N403-Q420 PolarHBondContact OD1-N 3.45Å; N403-Q420 PolarHBondContact OD1-NE2 2.97Å; F418-Q420 PolarHBondContact O-N 3.36Å; Q420-Q431 PolarHBondContact O-NE2 2.79Å
421	P	76	Confident	65.1	Low	49 Å²	49	70.6 Å²	70.6	32%	0.318	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-65.3	163.7	-178.7	-14.6	29	0	0	0	112.5	Y427	P421-Y427 HydrophobicContact CB-CE1 4.24Å; P421-Y427 HydrophobicContact CG-CE1 4.28Å
422	G	75	Confident	67.8	Low	9 Å²	9	64.3 Å²	64.3	9%	0.093	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-67.2	170.6	164.7	0	0	0	0	0	112.9	N424 G425 G426	G422-N424 PolarHBondContact O-N 3.1Å; G422-G425 PolarHBondContact O-N 2.86Å; G422-G426 PolarHBondContact N-O 3.18Å
423	P	71.9	Confident	70.6	Confident	115 Å²	115	62.2 Å²	62.2	75%	0.747	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.7	177.1	25.5	-35.2	0	0	0	113.5
424	N	73.6	Confident	72.9	Confident	74 Å²	74	61 Å²	61	40%	0.396	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	16.4	175.3	-59.1	-45.7	0	0	0	113.6	G422 G426 T473 S474 D475	G422-N424 PolarHBondContact O-N 3.1Å; N424-G426 PolarHBondContact O-N 3.01Å; N424-G426 VanDerWaalsContact O-N 3.12Å; N424-T473 HydrophobicContact CB-CG2 4.08Å; N424-S474 PolarHBondContact ND2-OG 2.81Å; N424-D475 VanDerWaalsContact ND2-CG 3.3Å; N424-D475 PolarHBondContact ND2-OD1 2.87Å
425	G	80.1	Confident	74.9	Confident	32 Å²	32	53.5 Å²	53.5	33%	0.33	29%	0.287	S	S	.	.	S	Bend	trans	74.7	-9.1	-179.6	0	0	0	0	0	116.3	G422	G422-G425 PolarHBondContact O-N 2.86Å
426	G	86.9	Confident	76.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.			trans	-80.5	163.9	178.6	0	0	0	0	0	114.5	G422 N424 R477 Y478	G422-G426 PolarHBondContact N-O 3.18Å; N424-G426 PolarHBondContact O-N 3.01Å; N424-G426 VanDerWaalsContact O-N 3.12Å; G426-R477 WeakPolarHBondContact O-CD 3.17Å; G426-Y478 CarbonylContact C-O 3.44Å; G426-Y478 WeakPolarHBondContact CA-O 3.12Å
427	Y	91.3	Very high	78.3	Confident	7 Å²	7	50.3 Å²	50.3	3%	0.027	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-104.6	134.1	179.1	-62.2	-78.7	0	0	0	112.3	I396 L399 M400 N403 P421 R477 Y478	I396-Y427 HydrophobicContact CG2-CD2 3.93Å; I396-Y427 HydrophobicContact CG2-CE2 4.36Å; L399-Y427 HydrophobicContact CB-CD1 3.65Å; L399-Y427 HydrophobicContact CB-CD2 4.27Å; L399-Y427 HydrophobicContact CB-CE1 3.63Å; L399-Y427 HydrophobicContact CB-CE2 4.25Å; L399-Y427 HydrophobicContact CB-CG 3.99Å; L399-Y427 HydrophobicContact CD1-CD1 3.83Å; L399-Y427 HydrophobicContact CD1-CG 3.76Å; L399-Y427 HydrophobicContact CD2-CD1 4.46Å; L399-Y427 HydrophobicContact CG-CD1 4.2Å; L399-Y427 HydrophobicContact CG-CG 4.48Å; M400-Y427 WeakPolarHBondContact CA-OH 3.48Å; M400-Y427 HydrophobicContact CG-CE2 3.53Å; M400-Y427 WeakPolarHBondContact CG-OH 3.5Å; N403-Y427 WeakPolarHBondContact ND2-CE1 3Å; N403-Y427 PolarHBondContact ND2-OH 3.32Å; P421-Y427 HydrophobicContact CB-CE1 4.24Å; P421-Y427 HydrophobicContact CG-CE1 4.28Å; Y427-R477 WeakPolarHBondContact O-CA 3.19Å; Y427-R477 VanDerWaalsContact O-CB 3.29Å; Y427-R477 WeakPolarHBondContact O-CB 3.16Å; Y427-Y478 PolarHBondContact N-O 3.34Å; Y427-Y478 PolarHBondContact O-N 3.36Å
428	S	87.8	Confident	80.1	Confident	34 Å²	34	49.4 Å²	49.4	24%	0.238	26%	0.258	C	S	.	.			trans	-68.4	156.3	173.9	66.9	0	0	0	0	110.6	F430 Q431 V432	S428-F430 VanDerWaalsContact C-N 3.26Å; S428-F430 PolarHBondContact O-N 3.28Å; S428-Q431 WeakPolarHBondContact O-CB 2.91Å; S428-Q431 PolarHBondContact O-N 2.95Å; S428-Q431 WeakPolarHBondContact OG-CG 3.34Å; S428-Q431 PolarHBondContact OG-OE1 2.57Å; S428-V432 PolarHBondContact O-N 3.19Å
429	L	90.4	Very high	81.1	Confident	32 Å²	32	44.2 Å²	44.2	17%	0.168	24%	0.237	C	C	.	.	H	α-helix	trans	-53.7	-43.3	-180	-179.9	136.1	0	0	0	112.5	Q431 V432 E433 L457 R458 L461	L429-Q431 VanDerWaalsContact C-N 3.26Å; L429-Q431 PolarHBondContact O-N 2.66Å; L429-V432 PolarHBondContact O-N 3.32Å; L429-V432 VanDerWaalsContact O-N 3.13Å; L429-E433 WeakPolarHBondContact CD2-OE2 3.41Å; L429-E433 VanDerWaalsContact O-CB 3.27Å; L429-E433 WeakPolarHBondContact O-CB 3.37Å; L429-E433 PolarHBondContact O-N 2.83Å; L429-L457 HydrophobicContact CD1-CB 4.36Å; L429-L457 HydrophobicContact CD1-CD2 4.29Å; L429-L457 HydrophobicContact CD1-CG 4.01Å; L429-L457 HydrophobicContact CD2-CD2 4.12Å; L429-L457 HydrophobicContact CG-CD2 3.82Å; L429-L457 HydrophobicContact CG-CG 4.09Å; L429-R458 HydrophobicContact CD1-CB 4.13Å; L429-R458 HydrophobicContact CD1-CG 3.24Å; L429-L461 HydrophobicContact CD1-CD1 4.19Å; L429-L461 HydrophobicContact CG-CD1 4.43Å
430	F	87.5	Confident	81.9	Confident	114 Å²	114	46.1 Å²	46.1	50%	0.5	25%	0.246	S	C	.	.	H	α-helix	trans	-60.1	-33.7	178.3	-179	-101.8	0	0	0	113.1	S428 R434	S428-F430 VanDerWaalsContact C-N 3.26Å; S428-F430 PolarHBondContact O-N 3.28Å; F430-R434 VanDerWaalsContact O-CB 3.23Å; F430-R434 WeakPolarHBondContact O-CB 3.31Å; F430-R434 PolarHBondContact O-N 3.05Å
431	Q	88.6	Confident	81.8	Confident	9 Å²	9	45 Å²	45	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-70.5	-43.3	175.5	-66.3	167.9	-74.8	0	0	110.9	L399 F418 S419 Q420 S428 L429 R434 A435	L399-Q431 HydrophobicContact CD1-CB 3.98Å; L399-Q431 HydrophobicContact CD2-CB 4.18Å; F418-Q431 PolarHBondContact O-NE2 3.5Å; S419-Q431 PolarHBondContact O-NE2 3.46Å; Q420-Q431 PolarHBondContact O-NE2 2.79Å; S428-Q431 WeakPolarHBondContact O-CB 2.91Å; S428-Q431 PolarHBondContact O-N 2.95Å; S428-Q431 WeakPolarHBondContact OG-CG 3.34Å; S428-Q431 PolarHBondContact OG-OE1 2.57Å; L429-Q431 VanDerWaalsContact C-N 3.26Å; L429-Q431 PolarHBondContact O-N 2.66Å; Q431-R434 PolarHBondContact O-N 2.8Å; Q431-A435 WeakPolarHBondContact O-CB 3.27Å; Q431-A435 PolarHBondContact O-N 2.85Å
432	V	88.3	Confident	81.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-41.4	176.9	-174.3	0	0	0	0	111.2	A395 I396 L399 S428 L429 R434 A435 L436 L457 L461	A395-V432 HydrophobicContact CB-CG1 4.04Å; I396-V432 HydrophobicContact CD1-CG2 4.12Å; I396-V432 HydrophobicContact CG1-CG1 4.29Å; I396-V432 HydrophobicContact CG1-CG2 3.7Å; L399-V432 HydrophobicContact CD1-CG2 4.07Å; S428-V432 PolarHBondContact O-N 3.19Å; L429-V432 PolarHBondContact O-N 3.32Å; L429-V432 VanDerWaalsContact O-N 3.13Å; V432-R434 PolarHBondContact O-N 2.99Å; V432-A435 PolarHBondContact O-N 2.68Å; V432-L436 HydrophobicContact CG1-CD1 4Å; V432-L436 HydrophobicContact CG1-CG 4.42Å; V432-L436 WeakPolarHBondContact O-CB 3.3Å; V432-L436 WeakPolarHBondContact O-CD1 3.41Å; V432-L436 VanDerWaalsContact O-CG 3.23Å; V432-L436 WeakPolarHBondContact O-CG 3.2Å; V432-L436 PolarHBondContact O-N 3.13Å; V432-L457 HydrophobicContact CG1-CD1 4.43Å; V432-L461 HydrophobicContact CB-CD1 4.31Å; V432-L461 HydrophobicContact CG1-CD1 4.26Å; V432-L461 HydrophobicContact CG1-CD2 4.3Å
433	E	88.2	Confident	80.6	Confident	47 Å²	47	54.2 Å²	54.2	22%	0.22	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-47	173.8	-165.8	161.4	-151	0	0	111.3	L429 L436 Q437 T453 G454 L457	L429-E433 WeakPolarHBondContact CD2-OE2 3.41Å; L429-E433 VanDerWaalsContact O-CB 3.27Å; L429-E433 WeakPolarHBondContact O-CB 3.37Å; L429-E433 PolarHBondContact O-N 2.83Å; E433-L436 PolarHBondContact O-N 3.26Å; E433-Q437 PolarHBondContact O-N 3.11Å; E433-T453 HydrophobicContact CG-CG2 4.15Å; E433-T453 VanDerWaalsContact OE1-CA 3.25Å; E433-T453 WeakPolarHBondContact OE1-CA 3.33Å; E433-T453 VanDerWaalsContact OE1-CB 3.28Å; E433-T453 WeakPolarHBondContact OE1-CB 3.44Å; E433-G454 PolarHBondContact OE1-N 2.85Å; E433-L457 HydrophobicContact CB-CD2 3.42Å; E433-L457 VanDerWaalsContact CB-CD2 3.42Å; E433-L457 HydrophobicContact CG-CD2 3.8Å
434	R	85	Confident	79.4	Confident	76 Å²	76	54.6 Å²	54.6	29%	0.287	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-42.1	176.4	-169.7	164.9	-168.5	124.2	7.7	112.2	L415 I416 F430 Q431 V432 Q437 F438	L415-R434 PolarHBondContact O-NE 2.83Å; L415-R434 VanDerWaalsContact O-NE 3.07Å; L415-R434 PolarHBondContact O-NH2 2.9Å; I416-R434 HydrophobicContact CG1-CG 4.4Å; I416-R434 HydrophobicContact CG2-CG 4.47Å; F430-R434 VanDerWaalsContact O-CB 3.23Å; F430-R434 WeakPolarHBondContact O-CB 3.31Å; F430-R434 PolarHBondContact O-N 3.05Å; Q431-R434 PolarHBondContact O-N 2.8Å; V432-R434 PolarHBondContact O-N 2.99Å; R434-Q437 WeakPolarHBondContact O-CB 3.06Å; R434-Q437 PolarHBondContact O-N 3.48Å; R434-F438 HydrophobicContact CG-CD2 4.08Å; R434-F438 HydrophobicContact CG-CE2 3.65Å; R434-F438 WeakPolarHBondContact O-CD2 3.44Å; R434-F438 PolarHBondContact O-N 3.44Å; R434-F438 VanDerWaalsContact O-N 3.11Å
435	A	83.6	Confident	78	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-38.6	175.3	0	0	0	0	0	112.5	A395 L399 Q431 V432 Q437 F438 L439	A395-A435 HydrophobicContact CB-CB 4.09Å; L399-A435 HydrophobicContact CD1-CB 3.99Å; L399-A435 HydrophobicContact CD2-CB 4.06Å; L399-A435 HydrophobicContact CG-CB 3.78Å; Q431-A435 WeakPolarHBondContact O-CB 3.27Å; Q431-A435 PolarHBondContact O-N 2.85Å; V432-A435 PolarHBondContact O-N 2.68Å; A435-Q437 VanDerWaalsContact C-N 3.32Å; A435-Q437 PolarHBondContact O-N 2.92Å; A435-F438 PolarHBondContact O-N 3.5Å; A435-L439 WeakPolarHBondContact O-CB 3.47Å; A435-L439 WeakPolarHBondContact O-CG 3.26Å; A435-L439 PolarHBondContact O-N 3.43Å
436	L	87.8	Confident	76.2	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-38.2	172.4	-75.1	163.4	0	0	0	111.9	K391 L392 A395 V432 E433 L439 N440 L452 L457	K391-L436 HydrophobicContact CB-CD2 3.92Å; K391-L436 WeakPolarHBondContact O-CD2 3.42Å; L392-L436 HydrophobicContact CD2-CD1 4.14Å; A395-L436 HydrophobicContact CB-CD2 3.93Å; A395-L436 HydrophobicContact CB-CG 3.82Å; V432-L436 HydrophobicContact CG1-CD1 4Å; V432-L436 HydrophobicContact CG1-CG 4.42Å; V432-L436 WeakPolarHBondContact O-CB 3.3Å; V432-L436 WeakPolarHBondContact O-CD1 3.41Å; V432-L436 VanDerWaalsContact O-CG 3.23Å; V432-L436 WeakPolarHBondContact O-CG 3.2Å; V432-L436 PolarHBondContact O-N 3.13Å; E433-L436 PolarHBondContact O-N 3.26Å; L436-L439 PolarHBondContact O-N 2.71Å; L436-N440 WeakPolarHBondContact O-CB 3.32Å; L436-N440 PolarHBondContact O-N 3.42Å; L436-N440 PolarHBondContact O-ND2 3.35Å; L436-L452 HydrophobicContact CD1-CB 4.38Å; L436-L452 HydrophobicContact CD1-CD2 4.46Å; L436-L457 HydrophobicContact CD1-CD1 3.48Å; L436-L457 VanDerWaalsContact CD1-CD1 3.48Å; L436-L457 HydrophobicContact CD1-CD2 4.24Å
437	Q	80.7	Confident	74.2	Confident	85 Å²	85	63.3 Å²	63.3	40%	0.397	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-51.2	173.3	-170	60.7	40.4	0	0	110.9	E433 R434 A435 L439 N440 D441	E433-Q437 PolarHBondContact O-N 3.11Å; R434-Q437 WeakPolarHBondContact O-CB 3.06Å; R434-Q437 PolarHBondContact O-N 3.48Å; A435-Q437 VanDerWaalsContact C-N 3.32Å; A435-Q437 PolarHBondContact O-N 2.92Å; Q437-L439 VanDerWaalsContact C-N 3.31Å; Q437-L439 PolarHBondContact O-N 3.24Å; Q437-N440 WeakPolarHBondContact O-CA 3.27Å; Q437-N440 WeakPolarHBondContact O-CB 3.23Å; Q437-N440 PolarHBondContact O-N 3.13Å; Q437-D441 PolarHBondContact NE2-OD1 3.5Å; Q437-D441 VanDerWaalsContact O-CG 3.23Å; Q437-D441 PolarHBondContact O-N 2.89Å
438	F	79.8	Confident	71.7	Confident	49 Å²	49	64.6 Å²	64.6	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-34.8	178.3	-74.1	-65	0	0	0	113.8	L415 I416 R434 A435 N440 L442	L415-F438 HydrophobicContact CB-CE1 3.59Å; L415-F438 HydrophobicContact CB-CE2 4.43Å; L415-F438 HydrophobicContact CB-CZ 3.56Å; L415-F438 HydrophobicContact CD1-CE1 4.08Å; L415-F438 HydrophobicContact CG-CE1 4.34Å; L415-F438 VanDerWaalsContact O-CE2 3.28Å; L415-F438 WeakPolarHBondContact O-CE2 3.45Å; L415-F438 WeakPolarHBondContact O-CZ 3.5Å; I416-F438 HydrophobicContact CD1-CD2 3.64Å; I416-F438 HydrophobicContact CD1-CE2 4.24Å; I416-F438 HydrophobicContact CD1-CG 4.38Å; I416-F438 HydrophobicContact CG1-CD2 3.47Å; I416-F438 VanDerWaalsContact CG1-CD2 3.47Å; I416-F438 HydrophobicContact CG1-CE2 3.54Å; I416-F438 HydrophobicContact CG1-CG 4.39Å; I416-F438 HydrophobicContact CG1-CZ 4.48Å; R434-F438 HydrophobicContact CG-CD2 4.08Å; R434-F438 HydrophobicContact CG-CE2 3.65Å; R434-F438 WeakPolarHBondContact O-CD2 3.44Å; R434-F438 PolarHBondContact O-N 3.44Å; R434-F438 VanDerWaalsContact O-N 3.11Å; A435-F438 PolarHBondContact O-N 3.5Å; F438-N440 VanDerWaalsContact C-N 3.33Å; F438-L442 WeakPolarHBondContact O-CD1 3.33Å; F438-L442 WeakPolarHBondContact O-CG 3.05Å; F438-L442 PolarHBondContact O-N 2.82Å
439	L	73.9	Confident	70	Confident	53 Å²	53	65.5 Å²	65.5	28%	0.277	35%	0.35	S	S	.	.	H	α-helix	trans	-72.2	-24.6	173.8	-68.8	172.5	0	0	0	113.1	A395 A435 L436 Q437 N443	A395-L439 HydrophobicContact CB-CD1 4.07Å; A435-L439 WeakPolarHBondContact O-CB 3.47Å; A435-L439 WeakPolarHBondContact O-CG 3.26Å; A435-L439 PolarHBondContact O-N 3.43Å; L436-L439 PolarHBondContact O-N 2.71Å; Q437-L439 VanDerWaalsContact C-N 3.31Å; Q437-L439 PolarHBondContact O-N 3.24Å; L439-N443 PolarHBondContact O-ND2 3.32Å
440	N	75.1	Confident	68.3	Low	60 Å²	60	68.3 Å²	68.3	32%	0.321	37%	0.369	S	S	.	.	H	α-helix	trans	-79.4	-42.8	170.7	-69.4	-32.5	0	0	0	111.5	K391 L436 Q437 F438 L442 N443	K391-N440 PolarHBondContact NZ-OD1 2.89Å; L436-N440 WeakPolarHBondContact O-CB 3.32Å; L436-N440 PolarHBondContact O-N 3.42Å; L436-N440 PolarHBondContact O-ND2 3.35Å; Q437-N440 WeakPolarHBondContact O-CA 3.27Å; Q437-N440 WeakPolarHBondContact O-CB 3.23Å; Q437-N440 PolarHBondContact O-N 3.13Å; F438-N440 VanDerWaalsContact C-N 3.33Å; N440-L442 PolarHBondContact O-N 3.39Å; N440-N443 CarbonylContact O-C 3.6Å; N440-N443 PolarHBondContact O-N 2.94Å
441	D	67.2	Low	67.1	Low	94 Å²	94	69.6 Å²	69.6	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-30.9	-179.1	-64.8	-22.2	0	0	0	112.3	Q437 N443	Q437-D441 PolarHBondContact NE2-OD1 3.5Å; Q437-D441 VanDerWaalsContact O-CG 3.23Å; Q437-D441 PolarHBondContact O-N 2.89Å; D441-N443 VanDerWaalsContact C-N 3.32Å
442	L	65	Low	66.6	Low	136 Å²	136	69.6 Å²	69.6	71%	0.712	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-10.8	173.2	-71.8	168.7	0	0	0	114.4	F438 N440	F438-L442 WeakPolarHBondContact O-CD1 3.33Å; F438-L442 WeakPolarHBondContact O-CG 3.05Å; F438-L442 PolarHBondContact O-N 2.82Å; N440-L442 PolarHBondContact O-N 3.39Å
443	N	60.4	Low	66.3	Low	115 Å²	115	71.3 Å²	71.3	62%	0.615	39%	0.388	S	S	*	.			trans	-125.6	60.1	-169.1	-77.8	-74.9	0	0	0	112.5	L439 N440 D441 S445	L439-N443 PolarHBondContact O-ND2 3.32Å; N440-N443 CarbonylContact O-C 3.6Å; N440-N443 PolarHBondContact O-N 2.94Å; D441-N443 VanDerWaalsContact C-N 3.32Å; N443-S445 PolarHBondContact O-N 3.37Å
444	S	45.5	Very low	65.7	Low	122 Å²	122	70 Å²	70	85%	0.853	39%	0.388	S	S	*	.			trans	-68.2	83.5	-178.3	47.2	0	0	0	0	114.2
445	S	45.5	Very low	65.4	Low	88 Å²	88	69.3 Å²	69.3	62%	0.615	40%	0.398	S	S	*	.			trans	-139.4	140.6	161.8	77.8	0	0	0	0	112.2	N443 K447	N443-S445 PolarHBondContact O-N 3.37Å; S445-K447 PolarHBondContact O-N 2.9Å
446	P	41.6	Very low	65.2	Low	87 Å²	87	72.5 Å²	72.5	57%	0.565	42%	0.417	S	S	*	.			trans	-78.7	82	-170.1	31.6	-36.2	0	0	0	112.5
447	K	44.6	Very low	65.3	Low	115 Å²	115	72.2 Å²	72.2	50%	0.5	42%	0.416	S	S	.	.			trans	-138.8	96.6	168.1	-74.4	-161.1	172.5	-179.6	0	111.4	R292 N293 L294 S445 I449	R292-K447 WeakPolarHBondContact O-CE 3.36Å; N293-K447 VanDerWaalsContact N-CE 3.29Å; N293-K447 WeakPolarHBondContact O-CE 3.16Å; L294-K447 HydrophobicContact CB-CB 3.81Å; L294-K447 HydrophobicContact CB-CG 3.96Å; L294-K447 HydrophobicContact CD2-CB 3.79Å; L294-K447 HydrophobicContact CG-CB 4.34Å; S445-K447 PolarHBondContact O-N 2.9Å; K447-I449 PolarHBondContact O-N 3.49Å
448	S	38.4	Very low	65.5	Low	34 Å²	34	74.1 Å²	74.1	24%	0.238	42%	0.419	C	S	.	.			trans	-65.6	91	175	41.1	0	0	0	0	113.4	L294 E298	L294-S448 VanDerWaalsContact CD2-C 3.4Å; L294-S448 WeakPolarHBondContact CD2-O 3.32Å; E298-S448 PolarHBondContact OE2-OG 2.77Å
449	I	52.5	Low	65.8	Low	53 Å²	53	76.3 Å²	76.3	27%	0.272	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-77.8	138.1	154.2	-63	179.8	0	0	0	105.9	L294 S387 K447 E451	L294-I449 HydrophobicContact CD2-CG1 3.83Å; S387-I449 VanDerWaalsContact OG-CD1 3.32Å; S387-I449 WeakPolarHBondContact OG-CD1 3.23Å; K447-I449 PolarHBondContact O-N 3.49Å; I449-E451 PolarHBondContact O-N 3.37Å
450	P	54.3	Low	66.4	Low	90 Å²	90	74.7 Å²	74.7	58%	0.584	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-46.5	134.9	-175.7	-32.1	36.2	0	0	0	112.8	L452	P450-L452 PolarHBondContact O-N 3.3Å; P450-L452 VanDerWaalsContact O-N 3.14Å
451	E	63.7	Low	67.1	Low	142 Å²	142	71.9 Å²	71.9	66%	0.664	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-53.1	120.6	-171.9	-154.6	-169.7	104.2	0	0	110.2	I449 T453	I449-E451 PolarHBondContact O-N 3.37Å; E451-T453 HydrophobicContact CG-CG2 3.95Å; E451-T453 WeakPolarHBondContact CG-OG1 3.12Å; E451-T453 PolarHBondContact O-N 3.09Å; E451-T453 WeakPolarHBondContact OE1-CB 3.34Å; E451-T453 VanDerWaalsContact OE1-CG2 3.32Å; E451-T453 WeakPolarHBondContact OE1-CG2 3.22Å; E451-T453 PolarHBondContact OE1-OG1 3.05Å
452	L	77.6	Confident	68	Low	9 Å²	9	70.1 Å²	70.1	5%	0.047	41%	0.405	C	S	.	.			trans	-88.1	49.7	-166.4	-120.4	168.2	0	0	0	110.4	V388 K391 L392 L436 P450 L457	V388-L452 HydrophobicContact CG1-CD1 4.23Å; V388-L452 HydrophobicContact CG1-CD2 4.16Å; V388-L452 HydrophobicContact CG2-CD1 4.45Å; K391-L452 HydrophobicContact CB-CD1 4.13Å; K391-L452 HydrophobicContact CD-CD1 3.78Å; L392-L452 HydrophobicContact CD2-CD2 4.06Å; L436-L452 HydrophobicContact CD1-CB 4.38Å; L436-L452 HydrophobicContact CD1-CD2 4.46Å; P450-L452 PolarHBondContact O-N 3.3Å; P450-L452 VanDerWaalsContact O-N 3.14Å; L452-L457 HydrophobicContact CD2-CD1 3.91Å; L452-L457 WeakPolarHBondContact O-CB 3.38Å
453	T	82.7	Confident	69	Low	35 Å²	35	66.7 Å²	66.7	22%	0.215	38%	0.382	C	S	.	.			trans	-121.2	167.2	-170	49.6	0	0	0	0	111.1	E433 E451 A455 T456 L457	E433-T453 HydrophobicContact CG-CG2 4.15Å; E433-T453 VanDerWaalsContact OE1-CA 3.25Å; E433-T453 WeakPolarHBondContact OE1-CA 3.33Å; E433-T453 VanDerWaalsContact OE1-CB 3.28Å; E433-T453 WeakPolarHBondContact OE1-CB 3.44Å; E451-T453 HydrophobicContact CG-CG2 3.95Å; E451-T453 WeakPolarHBondContact CG-OG1 3.12Å; E451-T453 PolarHBondContact O-N 3.09Å; E451-T453 WeakPolarHBondContact OE1-CB 3.34Å; E451-T453 VanDerWaalsContact OE1-CG2 3.32Å; E451-T453 WeakPolarHBondContact OE1-CG2 3.22Å; E451-T453 PolarHBondContact OE1-OG1 3.05Å; T453-A455 PolarHBondContact O-N 3.47Å; T453-T456 PolarHBondContact O-N 3.21Å; T453-L457 PolarHBondContact O-N 3.37Å
454	G	75.5	Confident	70.2	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	35%	0.354	C	S	.	.	H	α-helix	trans	48.7	-115.4	169.3	0	0	0	0	0	115.1	E433 R458	E433-G454 PolarHBondContact OE1-N 2.85Å; G454-R458 VanDerWaalsContact O-CZ 3.27Å; G454-R458 PolarHBondContact O-N 2.74Å; G454-R458 PolarHBondContact O-NH1 3.39Å; G454-R458 VanDerWaalsContact O-NH1 3.13Å
455	A	77.4	Confident	72.2	Confident	60 Å²	60	56.1 Å²	56.1	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-77	-35.5	-175.9	0	0	0	0	0	113.1	T453 L457 R458 V459	T453-A455 PolarHBondContact O-N 3.47Å; A455-L457 VanDerWaalsContact C-N 3.31Å; A455-L457 PolarHBondContact O-N 2.88Å; A455-R458 WeakPolarHBondContact O-CB 3.19Å; A455-R458 PolarHBondContact O-N 3.37Å; A455-V459 WeakPolarHBondContact O-CG2 3.46Å; A455-V459 PolarHBondContact O-N 3.29Å
456	T	81.1	Confident	73.9	Confident	69 Å²	69	55.7 Å²	55.7	42%	0.423	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-45.9	174.5	-49.4	0	0	0	0	109.9	T453 R458 V459 C460	T453-T456 PolarHBondContact O-N 3.21Å; T456-R458 PolarHBondContact O-N 3.48Å; T456-V459 PolarHBondContact O-N 3.12Å; T456-C460 WeakPolarHBondContact O-CB 3.49Å; T456-C460 PolarHBondContact O-N 2.87Å
457	L	88.2	Confident	75.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-42.9	174.8	-175.5	55.9	0	0	0	112.6	L392 L429 V432 E433 L436 L452 T453 A455 C460 L461	L392-L457 HydrophobicContact CD2-CD1 3.47Å; L392-L457 VanDerWaalsContact CD2-CD1 3.47Å; L429-L457 HydrophobicContact CD1-CB 4.36Å; L429-L457 HydrophobicContact CD1-CD2 4.29Å; L429-L457 HydrophobicContact CD1-CG 4.01Å; L429-L457 HydrophobicContact CD2-CD2 4.12Å; L429-L457 HydrophobicContact CG-CD2 3.82Å; L429-L457 HydrophobicContact CG-CG 4.09Å; V432-L457 HydrophobicContact CG1-CD1 4.43Å; E433-L457 HydrophobicContact CB-CD2 3.42Å; E433-L457 VanDerWaalsContact CB-CD2 3.42Å; E433-L457 HydrophobicContact CG-CD2 3.8Å; L436-L457 HydrophobicContact CD1-CD1 3.48Å; L436-L457 VanDerWaalsContact CD1-CD1 3.48Å; L436-L457 HydrophobicContact CD1-CD2 4.24Å; L452-L457 HydrophobicContact CD2-CD1 3.91Å; L452-L457 WeakPolarHBondContact O-CB 3.38Å; T453-L457 PolarHBondContact O-N 3.37Å; A455-L457 VanDerWaalsContact C-N 3.31Å; A455-L457 PolarHBondContact O-N 2.88Å; L457-C460 PolarHBondContact O-N 3.18Å; L457-L461 HydrophobicContact CD1-CD1 3.66Å; L457-L461 HydrophobicContact CD1-CG 3.92Å; L457-L461 HydrophobicContact CD2-CD1 4.49Å; L457-L461 HydrophobicContact CG-CD1 3.74Å; L457-L461 HydrophobicContact CG-CG 4.41Å; L457-L461 VanDerWaalsContact O-CB 3.28Å; L457-L461 WeakPolarHBondContact O-CB 3.23Å; L457-L461 WeakPolarHBondContact O-CG 3.38Å; L457-L461 PolarHBondContact O-N 3.39Å
458	R	86.5	Confident	77.4	Confident	124 Å²	124	50.4 Å²	50.4	47%	0.468	29%	0.287	S	S	.	.	H	α-helix	trans	-55.8	-54.3	173.7	-80.8	-177	-81.9	-77.2	11.4	111.7	L429 G454 A455 T456 C460 L461 D462	L429-R458 HydrophobicContact CD1-CB 4.13Å; L429-R458 HydrophobicContact CD1-CG 3.24Å; G454-R458 VanDerWaalsContact O-CZ 3.27Å; G454-R458 PolarHBondContact O-N 2.74Å; G454-R458 PolarHBondContact O-NH1 3.39Å; G454-R458 VanDerWaalsContact O-NH1 3.13Å; A455-R458 WeakPolarHBondContact O-CB 3.19Å; A455-R458 PolarHBondContact O-N 3.37Å; T456-R458 PolarHBondContact O-N 3.48Å; R458-C460 VanDerWaalsContact C-N 3.34Å; R458-C460 PolarHBondContact O-N 3.48Å; R458-L461 PolarHBondContact O-N 2.94Å; R458-D462 WeakPolarHBondContact O-CB 3.44Å; R458-D462 PolarHBondContact O-N 3.16Å
459	V	84.5	Confident	79.5	Confident	96 Å²	96	53 Å²	53	58%	0.582	29%	0.294	S	S	*	.	H	α-helix	trans	-62.4	-42.9	-176.4	173	0	0	0	0	111	A455 T456 D462 R463	A455-V459 WeakPolarHBondContact O-CG2 3.46Å; A455-V459 PolarHBondContact O-N 3.29Å; T456-V459 PolarHBondContact O-N 3.12Å; V459-D462 PolarHBondContact O-N 3.31Å; V459-R463 WeakPolarHBondContact O-CB 3.47Å; V459-R463 PolarHBondContact O-N 3.22Å
460	C	86.5	Confident	81.3	Confident	19 Å²	19	50.4 Å²	50.4	13%	0.128	28%	0.281	C	S	.	.	H	α-helix	trans	-71.7	-39.2	-179.9	-69.9	0	0	0	0	112.7	N384 V388 L392 T456 L457 R458 R463 E464	N384-C460 PolarHBondContact ND2-O 2.95Å; N384-C460 WeakPolarHBondContact OD1-CA 3.44Å; N384-C460 WeakPolarHBondContact OD1-CB 3.21Å; N384-C460 PolarHBondContact OD1-SG 3.24Å; N384-C460 VanDerWaalsContact OD1-SG 3.33Å; V388-C460 HydrophobicContact CG1-CB 3.67Å; L392-C460 HydrophobicContact CD1-CB 3.93Å; L392-C460 WeakPolarHBondContact CD1-O 3.3Å; T456-C460 WeakPolarHBondContact O-CB 3.49Å; T456-C460 PolarHBondContact O-N 2.87Å; L457-C460 PolarHBondContact O-N 3.18Å; R458-C460 VanDerWaalsContact C-N 3.34Å; R458-C460 PolarHBondContact O-N 3.48Å; C460-R463 PolarHBondContact O-N 3.34Å; C460-E464 WeakPolarHBondContact O-CB 3.27Å; C460-E464 PolarHBondContact O-N 3.02Å
461	L	90.4	Very high	82.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-42.1	172.3	-78.9	168.4	0	0	0	112	L392 I396 L429 V432 L457 R458 E464 A465 L470 Y478	L392-L461 HydrophobicContact CB-CD2 4.23Å; L392-L461 HydrophobicContact CD1-CD2 4.1Å; L392-L461 HydrophobicContact CD1-CG 4.26Å; L392-L461 HydrophobicContact CD2-CD2 3.89Å; L392-L461 HydrophobicContact CD2-CG 3.95Å; L392-L461 HydrophobicContact CG-CD2 4.29Å; I396-L461 HydrophobicContact CD1-CD2 4.14Å; L429-L461 HydrophobicContact CD1-CD1 4.19Å; L429-L461 HydrophobicContact CG-CD1 4.43Å; V432-L461 HydrophobicContact CB-CD1 4.31Å; V432-L461 HydrophobicContact CG1-CD1 4.26Å; V432-L461 HydrophobicContact CG1-CD2 4.3Å; L457-L461 HydrophobicContact CD1-CD1 3.66Å; L457-L461 HydrophobicContact CD1-CG 3.92Å; L457-L461 HydrophobicContact CD2-CD1 4.49Å; L457-L461 HydrophobicContact CG-CD1 3.74Å; L457-L461 HydrophobicContact CG-CG 4.41Å; L457-L461 VanDerWaalsContact O-CB 3.28Å; L457-L461 WeakPolarHBondContact O-CB 3.23Å; L457-L461 WeakPolarHBondContact O-CG 3.38Å; L457-L461 PolarHBondContact O-N 3.39Å; R458-L461 PolarHBondContact O-N 2.94Å; L461-E464 PolarHBondContact O-N 2.87Å; L461-A465 WeakPolarHBondContact O-CB 3.46Å; L461-A465 PolarHBondContact O-N 3.47Å; L461-L470 HydrophobicContact CD2-CD1 3.63Å; L461-Y478 HydrophobicContact CB-CD1 4.04Å; L461-Y478 HydrophobicContact CB-CD2 4.15Å; L461-Y478 HydrophobicContact CB-CE1 3.74Å; L461-Y478 HydrophobicContact CB-CE2 3.85Å; L461-Y478 HydrophobicContact CB-CG 4.24Å; L461-Y478 HydrophobicContact CD1-CD2 3.74Å; L461-Y478 HydrophobicContact CD1-CE2 3.72Å; L461-Y478 HydrophobicContact CD1-CG 4.41Å; L461-Y478 HydrophobicContact CD2-CD1 4.38Å; L461-Y478 HydrophobicContact CD2-CD2 4.15Å; L461-Y478 HydrophobicContact CD2-CG 3.99Å; L461-Y478 HydrophobicContact CG-CD2 4.25Å; L461-Y478 HydrophobicContact CG-CE2 4.29Å; L461-Y478 HydrophobicContact CG-CG 4.46Å
462	D	87.2	Confident	84.1	Confident	57 Å²	57	42.1 Å²	42.1	31%	0.305	23%	0.234	S	C	.	.	H	α-helix	trans	-68.1	-35	175.9	-88.1	-34.2	0	0	0	112.9	R458 V459 E464 A465 T466 K472 Y478	R458-D462 WeakPolarHBondContact O-CB 3.44Å; R458-D462 PolarHBondContact O-N 3.16Å; V459-D462 PolarHBondContact O-N 3.31Å; D462-E464 VanDerWaalsContact C-N 3.34Å; D462-A465 PolarHBondContact O-N 3.26Å; D462-T466 WeakPolarHBondContact O-CB 3.16Å; D462-T466 WeakPolarHBondContact O-CG2 3.15Å; D462-T466 PolarHBondContact O-N 3.19Å; D462-T466 PolarHBondContact O-OG1 3.16Å; D462-K472 VanDerWaalsContact OD1-CD 3.31Å; D462-K472 WeakPolarHBondContact OD1-CD 3.31Å; D462-K472 WeakPolarHBondContact OD1-CE 3.21Å; D462-K472 IonicContact OD1-NZ 2.86Å; D462-K472 PolarHBondContact OD1-NZ 3.06Å; D462-K472 IonicContact OD2-NZ 3.94Å; D462-K472 PolarHBondContact OD2-NZ 3.47Å; D462-Y478 PolarHBondContact OD1-OH 3.31Å
463	R	84.4	Confident	84.5	Confident	65 Å²	65	42.5 Å²	42.5	25%	0.245	24%	0.236	C	C	.	.	H	α-helix	trans	-67.4	-33.9	174.2	-167.6	170.2	-175.3	176.1	-1.6	112.2	G381 N382 T383 N384 V459 C460 T466 H467	G381-R463 PolarHBondContact O-NH2 3.4Å; N382-R463 WeakPolarHBondContact O-CD 3.39Å; N382-R463 WeakPolarHBondContact O-CG 3.3Å; N382-R463 PolarHBondContact O-NE 3.41Å; T383-R463 VanDerWaalsContact C-NE 3.28Å; T383-R463 PolarHBondContact O-NE 3.42Å; T383-R463 PolarHBondContact O-NH2 3.25Å; N384-R463 WeakPolarHBondContact OD1-CD 3.19Å; V459-R463 WeakPolarHBondContact O-CB 3.47Å; V459-R463 PolarHBondContact O-N 3.22Å; C460-R463 PolarHBondContact O-N 3.34Å; R463-T466 WeakPolarHBondContact CA-OG1 3.27Å; R463-T466 PolarHBondContact O-OG1 2.96Å; R463-H467 WeakPolarHBondContact O-CB 3.1Å; R463-H467 PolarHBondContact O-N 2.83Å
464	E	85.6	Confident	84.4	Confident	4 Å²	4	46 Å²	46	2%	0.019	26%	0.262	C	S	.	.	H	α-helix	trans	-77	-39.4	173.5	-155.7	66.6	-158.4	0	0	111.6	N384 S389 L392 C460 L461 D462 T466 G468 K469 L470 K487	N384-E464 PolarHBondContact ND2-N 2.89Å; N384-E464 PolarHBondContact ND2-OE2 3.06Å; S389-E464 WeakPolarHBondContact CB-OE1 3.03Å; S389-E464 VanDerWaalsContact CB-OE2 3.3Å; S389-E464 WeakPolarHBondContact CB-OE2 3.21Å; S389-E464 VanDerWaalsContact OG-CD 3.25Å; S389-E464 PolarHBondContact OG-OE1 3.36Å; S389-E464 PolarHBondContact OG-OE2 2.94Å; L392-E464 HydrophobicContact CD1-CB 4.17Å; C460-E464 WeakPolarHBondContact O-CB 3.27Å; C460-E464 PolarHBondContact O-N 3.02Å; L461-E464 PolarHBondContact O-N 2.87Å; D462-E464 VanDerWaalsContact C-N 3.34Å; E464-T466 VanDerWaalsContact C-N 3.26Å; E464-T466 PolarHBondContact O-N 3.37Å; E464-G468 CarbonylContact O-C 3.54Å; E464-G468 VanDerWaalsContact O-C 3.26Å; E464-G468 VanDerWaalsContact O-CA 3.22Å; E464-G468 WeakPolarHBondContact O-CA 3.49Å; E464-G468 PolarHBondContact O-N 2.76Å; E464-G468 WeakPolarHBondContact OE1-CA 3.41Å; E464-K469 PolarHBondContact OE1-N 2.71Å; E464-L470 HydrophobicContact CB-CB 4.33Å; E464-L470 HydrophobicContact CB-CD1 3.96Å; E464-L470 HydrophobicContact CB-CG 4.2Å; E464-L470 HydrophobicContact CG-CB 4.13Å; E464-L470 HydrophobicContact CG-CD1 3.84Å; E464-L470 HydrophobicContact CG-CG 3.69Å; E464-K487 PolarHBondContact O-NZ 2.8Å
465	A	87.2	Confident	84.6	Confident	11 Å²	11	47.6 Å²	47.6	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-65.8	-28	176.5	0	0	0	0	0	113	L461 D462 L470 K472 Y478 K487	L461-A465 WeakPolarHBondContact O-CB 3.46Å; L461-A465 PolarHBondContact O-N 3.47Å; D462-A465 PolarHBondContact O-N 3.26Å; A465-L470 VanDerWaalsContact CA-O 3.31Å; A465-L470 WeakPolarHBondContact CA-O 3.3Å; A465-K472 HydrophobicContact CB-CB 4.01Å; A465-Y478 HydrophobicContact CB-CD1 3.97Å; A465-Y478 HydrophobicContact CB-CE1 3.98Å; A465-K487 WeakPolarHBondContact O-CE 3.44Å; A465-K487 PolarHBondContact O-NZ 3.45Å; A465-K487 VanDerWaalsContact O-NZ 3.13Å
466	T	82	Confident	84.8	Confident	79 Å²	79	46.4 Å²	46.4	49%	0.485	26%	0.259	S	S	.	.	H	α-helix	trans	-87.4	-51.6	173	47.2	0	0	0	0	111.7	D462 R463 E464 K487	D462-T466 WeakPolarHBondContact O-CB 3.16Å; D462-T466 WeakPolarHBondContact O-CG2 3.15Å; D462-T466 PolarHBondContact O-N 3.19Å; D462-T466 PolarHBondContact O-OG1 3.16Å; R463-T466 WeakPolarHBondContact CA-OG1 3.27Å; R463-T466 PolarHBondContact O-OG1 2.96Å; E464-T466 VanDerWaalsContact C-N 3.26Å; E464-T466 PolarHBondContact O-N 3.37Å; T466-K487 WeakPolarHBondContact O-CD 3.48Å; T466-K487 PolarHBondContact O-NZ 3.39Å; T466-K487 VanDerWaalsContact O-NZ 3.08Å
467	H	77.2	Confident	85.3	Confident	68 Å²	68	46.1 Å²	46.1	32%	0.315	25%	0.251	S	S	.	.	H	α-helix	trans	-115.9	-9.3	-167.1	-62.5	-71.3	0	0	0	116.4	N382 T383 R463	N382-H467 HydrophobicContact CB-CB 4.39Å; N382-H467 WeakPolarHBondContact CB-CD2 3.21Å; N382-H467 VanDerWaalsContact CB-NE2 3.3Å; N382-H467 WeakPolarHBondContact CB-NE2 3.46Å; N382-H467 PolarHBondContact ND2-CE1 2.94Å; N382-H467 PolarHBondContact ND2-NE2 3.13Å; N382-H467 VanDerWaalsContact ND2-NE2 3.13Å; T383-H467 HydrophobicContact CG2-CB 3.92Å; T383-H467 WeakPolarHBondContact CG2-O 3.32Å; R463-H467 WeakPolarHBondContact O-CB 3.1Å; R463-H467 PolarHBondContact O-N 2.83Å
468	G	81.9	Confident	85.4	Confident	22 Å²	22	46.5 Å²	46.5	23%	0.227	25%	0.252	C	S	.	.	S	Bend	trans	-113	-150.3	-177.5	0	0	0	0	0	114.9	E464 L470 K487	E464-G468 CarbonylContact O-C 3.54Å; E464-G468 VanDerWaalsContact O-C 3.26Å; E464-G468 VanDerWaalsContact O-CA 3.22Å; E464-G468 WeakPolarHBondContact O-CA 3.49Å; E464-G468 PolarHBondContact O-N 2.76Å; E464-G468 WeakPolarHBondContact OE1-CA 3.41Å; G468-L470 PolarHBondContact O-N 3.36Å; G468-K487 PolarHBondContact O-NZ 2.83Å
469	K	84.1	Confident	85.6	Confident	88 Å²	88	41.6 Å²	41.6	38%	0.383	24%	0.235	S	C	.	.	S	Bend	trans	-85.1	3.4	-173.4	-66.5	178.2	-179.3	169.7	0	115.6	H390 V393 E464 D481	H390-K469 PolarHBondContact NE2-NZ 2.86Å; V393-K469 HydrophobicContact CG2-CB 3.96Å; V393-K469 HydrophobicContact CG2-CD 4.3Å; E464-K469 PolarHBondContact OE1-N 2.71Å; K469-D481 CarbonylContact O-C 3.55Å; K469-D481 PolarHBondContact O-N 3.28Å
470	L	89.5	Confident	85.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	160.5	178	-58.8	-178.4	0	0	0	110.6	L392 V393 I396 L461 E464 A465 G468 I479 L480 K487	L392-L470 HydrophobicContact CB-CD1 4.31Å; V393-L470 HydrophobicContact CG2-CD2 4.26Å; I396-L470 HydrophobicContact CD1-CD1 3.5Å; I396-L470 VanDerWaalsContact CD1-CD1 3.5Å; I396-L470 HydrophobicContact CD1-CD2 3.63Å; I396-L470 HydrophobicContact CD1-CG 4.22Å; L461-L470 HydrophobicContact CD2-CD1 3.63Å; E464-L470 HydrophobicContact CB-CB 4.33Å; E464-L470 HydrophobicContact CB-CD1 3.96Å; E464-L470 HydrophobicContact CB-CG 4.2Å; E464-L470 HydrophobicContact CG-CB 4.13Å; E464-L470 HydrophobicContact CG-CD1 3.84Å; E464-L470 HydrophobicContact CG-CG 3.69Å; A465-L470 VanDerWaalsContact CA-O 3.31Å; A465-L470 WeakPolarHBondContact CA-O 3.3Å; G468-L470 PolarHBondContact O-N 3.36Å; L470-I479 WeakPolarHBondContact CA-O 3.33Å; L470-L480 HydrophobicContact CD2-CD2 3.73Å; L470-L480 HydrophobicContact CD2-CG 4.05Å; L470-K487 WeakPolarHBondContact O-CE 3.38Å; L470-K487 PolarHBondContact O-NZ 3.31Å
471	A	88	Confident	85.6	Confident	2 Å²	2	37.5 Å²	37.5	2%	0.017	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151	161.5	0	0	0	0	0	110.2	Y478 I479 D481 H486	A471-Y478 WeakPolarHBondContact O-CA 3.36Å; A471-I479 HydrophobicContact CB-CG2 4.13Å; A471-I479 PolarHBondContact N-O 3.3Å; A471-I479 PolarHBondContact O-N 3.24Å; A471-D481 HydrophobicContact CB-CB 3.64Å; A471-H486 HydrophobicContact CB-CB 3.49Å; A471-H486 VanDerWaalsContact CB-CB 3.49Å
472	K	87.9	Confident	84.9	Confident	56 Å²	56	43.5 Å²	43.5	24%	0.243	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121	171.7	-160.2	170.3	-163.5	162.1	0	108.7	D462 A465 R477 Y478 Y490	D462-K472 VanDerWaalsContact OD1-CD 3.31Å; D462-K472 WeakPolarHBondContact OD1-CD 3.31Å; D462-K472 WeakPolarHBondContact OD1-CE 3.21Å; D462-K472 IonicContact OD1-NZ 2.86Å; D462-K472 PolarHBondContact OD1-NZ 3.06Å; D462-K472 IonicContact OD2-NZ 3.94Å; D462-K472 PolarHBondContact OD2-NZ 3.47Å; A465-K472 HydrophobicContact CB-CB 4.01Å; K472-R477 CarbonylContact C-O 3.52Å; K472-R477 VanDerWaalsContact CA-O 3.32Å; K472-R477 WeakPolarHBondContact CA-O 3.45Å; K472-Y478 HydrophobicContact CB-CD1 4.48Å; K472-Y478 HydrophobicContact CB-CE1 4.33Å; K472-Y478 HydrophobicContact CD-CE1 4.02Å; K472-Y478 WeakPolarHBondContact CE-OH 3.5Å; K472-Y478 HydrophobicContact CG-CD1 4.34Å; K472-Y478 HydrophobicContact CG-CE1 3.93Å; K472-Y478 PolarHBondContact NZ-OH 2.96Å; K472-Y490 WeakPolarHBondContact O-CD2 3.39Å
473	T	86.4	Confident	84.2	Confident	16 Å²	16	44.6 Å²	44.6	10%	0.098	25%	0.245	C	C	.	.			trans	-74.2	163.9	175.3	58.8	0	0	0	0	110.4	N424 D475 G476 R477 I479	N424-T473 HydrophobicContact CB-CG2 4.08Å; T473-D475 VanDerWaalsContact CB-OD1 3.27Å; T473-D475 WeakPolarHBondContact CB-OD1 3.46Å; T473-D475 PolarHBondContact O-N 3.12Å; T473-D475 PolarHBondContact OG1-OD1 3.31Å; T473-G476 PolarHBondContact O-N 3.22Å; T473-R477 PolarHBondContact N-O 2.85Å; T473-R477 WeakPolarHBondContact OG1-CB 3.45Å; T473-R477 PolarHBondContact OG1-N 2.7Å; T473-R477 PolarHBondContact OG1-O 2.84Å; T473-I479 HydrophobicContact CG2-CB 4.1Å; T473-I479 HydrophobicContact CG2-CG2 3.85Å
474	S	80.8	Confident	83.5	Confident	108 Å²	108	42.4 Å²	42.4	76%	0.755	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.4	-179	48.7	0	0	0	0	113.8	N424 G476	N424-S474 PolarHBondContact ND2-OG 2.81Å; S474-G476 VanDerWaalsContact C-N 3.27Å; S474-G476 PolarHBondContact O-N 3.03Å
475	D	79.3	Confident	82.8	Confident	55 Å²	55	47.8 Å²	47.8	29%	0.294	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	16.3	172.7	67.7	-44.3	0	0	0	113.7	N424 T473 R477	N424-D475 VanDerWaalsContact ND2-CG 3.3Å; N424-D475 PolarHBondContact ND2-OD1 2.87Å; T473-D475 VanDerWaalsContact CB-OD1 3.27Å; T473-D475 WeakPolarHBondContact CB-OD1 3.46Å; T473-D475 PolarHBondContact O-N 3.12Å; T473-D475 PolarHBondContact OG1-OD1 3.31Å; D475-R477 PolarHBondContact O-N 2.87Å; D475-R477 WeakPolarHBondContact OD2-CD 3.44Å; D475-R477 WeakPolarHBondContact OD2-CG 3.26Å; D475-R477 IonicContact OD2-CZ 3.97Å; D475-R477 IonicContact OD2-NE 2.77Å; D475-R477 PolarHBondContact OD2-NE 2.7Å
476	G	83.1	Confident	82	Confident	36 Å²	36	51.8 Å²	51.8	37%	0.371	29%	0.285	S	S	.	.	S	Bend	trans	74	10.8	173.2	0	0	0	0	0	115.1	T473 S474	T473-G476 PolarHBondContact O-N 3.22Å; S474-G476 VanDerWaalsContact C-N 3.27Å; S474-G476 PolarHBondContact O-N 3.03Å
477	R	89.5	Confident	81.5	Confident	63 Å²	63	49.8 Å²	49.8	24%	0.238	27%	0.269	C	S	.	.			trans	-90.8	171.3	176.5	-59.6	-169.6	-162.8	-130.1	-1.2	111.2	G426 Y427 K472 T473 D475	G426-R477 WeakPolarHBondContact O-CD 3.17Å; Y427-R477 WeakPolarHBondContact O-CA 3.19Å; Y427-R477 VanDerWaalsContact O-CB 3.29Å; Y427-R477 WeakPolarHBondContact O-CB 3.16Å; K472-R477 CarbonylContact C-O 3.52Å; K472-R477 VanDerWaalsContact CA-O 3.32Å; K472-R477 WeakPolarHBondContact CA-O 3.45Å; T473-R477 PolarHBondContact N-O 2.85Å; T473-R477 WeakPolarHBondContact OG1-CB 3.45Å; T473-R477 PolarHBondContact OG1-N 2.7Å; T473-R477 PolarHBondContact OG1-O 2.84Å; D475-R477 PolarHBondContact O-N 2.87Å; D475-R477 WeakPolarHBondContact OD2-CD 3.44Å; D475-R477 WeakPolarHBondContact OD2-CG 3.26Å; D475-R477 IonicContact OD2-CZ 3.97Å; D475-R477 IonicContact OD2-NE 2.77Å; D475-R477 PolarHBondContact OD2-NE 2.7Å
478	Y	91.5	Very high	81	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.027	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.4	-178.4	-55.7	-81	0	0	0	110.7	G426 Y427 L461 D462 A465 A471 K472	G426-Y478 CarbonylContact C-O 3.44Å; G426-Y478 WeakPolarHBondContact CA-O 3.12Å; Y427-Y478 PolarHBondContact N-O 3.34Å; Y427-Y478 PolarHBondContact O-N 3.36Å; L461-Y478 HydrophobicContact CB-CD1 4.04Å; L461-Y478 HydrophobicContact CB-CD2 4.15Å; L461-Y478 HydrophobicContact CB-CE1 3.74Å; L461-Y478 HydrophobicContact CB-CE2 3.85Å; L461-Y478 HydrophobicContact CB-CG 4.24Å; L461-Y478 HydrophobicContact CD1-CD2 3.74Å; L461-Y478 HydrophobicContact CD1-CE2 3.72Å; L461-Y478 HydrophobicContact CD1-CG 4.41Å; L461-Y478 HydrophobicContact CD2-CD1 4.38Å; L461-Y478 HydrophobicContact CD2-CD2 4.15Å; L461-Y478 HydrophobicContact CD2-CG 3.99Å; L461-Y478 HydrophobicContact CG-CD2 4.25Å; L461-Y478 HydrophobicContact CG-CE2 4.29Å; L461-Y478 HydrophobicContact CG-CG 4.46Å; D462-Y478 PolarHBondContact OD1-OH 3.31Å; A465-Y478 HydrophobicContact CB-CD1 3.97Å; A465-Y478 HydrophobicContact CB-CE1 3.98Å; A471-Y478 WeakPolarHBondContact O-CA 3.36Å; K472-Y478 HydrophobicContact CB-CD1 4.48Å; K472-Y478 HydrophobicContact CB-CE1 4.33Å; K472-Y478 HydrophobicContact CD-CE1 4.02Å; K472-Y478 WeakPolarHBondContact CE-OH 3.5Å; K472-Y478 HydrophobicContact CG-CD1 4.34Å; K472-Y478 HydrophobicContact CG-CE1 3.93Å; K472-Y478 PolarHBondContact NZ-OH 2.96Å
479	I	90.1	Very high	80.3	Confident	22 Å²	22	53.7 Å²	53.7	11%	0.113	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.6	176.2	-163.5	168.9	0	0	0	109.2	L470 A471 T473 H486	L470-I479 WeakPolarHBondContact CA-O 3.33Å; A471-I479 HydrophobicContact CB-CG2 4.13Å; A471-I479 PolarHBondContact N-O 3.3Å; A471-I479 PolarHBondContact O-N 3.24Å; T473-I479 HydrophobicContact CG2-CB 4.1Å; T473-I479 HydrophobicContact CG2-CG2 3.85Å; I479-H486 HydrophobicContact CG2-CB 4.45Å
480	L	87.7	Confident	79.3	Confident	22 Å²	22	55.9 Å²	55.9	12%	0.115	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.1	168.3	-85.9	162.7	0	0	0	109.6	V393 I396 R397 M400 L470 E482	V393-L480 HydrophobicContact CB-CD2 4.36Å; V393-L480 HydrophobicContact CG1-CD2 3.92Å; V393-L480 HydrophobicContact CG2-CD2 4.13Å; I396-L480 HydrophobicContact CG2-CD1 3.98Å; I396-L480 HydrophobicContact CG2-CG 3.8Å; R397-L480 HydrophobicContact CB-CD1 4Å; R397-L480 HydrophobicContact CG-CD1 4.46Å; M400-L480 HydrophobicContact SD-CB 4.48Å; M400-L480 HydrophobicContact SD-CD1 3.93Å; L470-L480 HydrophobicContact CD2-CD2 3.73Å; L470-L480 HydrophobicContact CD2-CG 4.05Å; L480-E482 HydrophobicContact CD2-CG 4.23Å
481	D	84.2	Confident	77.8	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	32%	0.321	C	S	.	.			trans	-131.6	57.3	-176.9	-174.2	34.3	0	0	0	109.7	K469 A471 T483 G484 E485 H486 K487	K469-D481 CarbonylContact O-C 3.55Å; K469-D481 PolarHBondContact O-N 3.28Å; A471-D481 HydrophobicContact CB-CB 3.64Å; D481-T483 PolarHBondContact O-N 3.21Å; D481-G484 VanDerWaalsContact CG-CA 3.47Å; D481-G484 PolarHBondContact O-N 3.2Å; D481-G484 VanDerWaalsContact OD1-C 3.25Å; D481-G484 WeakPolarHBondContact OD1-CA 3.34Å; D481-G484 PolarHBondContact OD1-N 2.78Å; D481-G484 VanDerWaalsContact OD2-C 3.24Å; D481-G484 WeakPolarHBondContact OD2-CA 3.32Å; D481-E485 PolarHBondContact OD1-N 2.8Å; D481-H486 HydrophobicContact CB-CB 4.21Å; D481-H486 IonicContact OD1-CD2 3.93Å; D481-H486 IonicContact OD1-CG 2.86Å; D481-H486 PolarHBondContact OD1-N 3.45Å; D481-H486 PolarHBondContact OD2-N 2.86Å; D481-K487 WeakPolarHBondContact OD2-CB 3.4Å; D481-K487 PolarHBondContact OD2-N 3.44Å
482	E	74.9	Confident	76.2	Confident	125 Å²	125	63.7 Å²	63.7	58%	0.584	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.2	-175.3	-60.6	-173.3	163.3	0	0	112.2	R397 L480	R397-E482 IonicContact CZ-OE1 2.65Å; R397-E482 IonicContact NH2-OE1 2.71Å; R397-E482 PolarHBondContact NH2-OE1 2.85Å; L480-E482 HydrophobicContact CD2-CG 4.23Å
483	T	73.1	Confident	74.5	Confident	81 Å²	81	67.6 Å²	67.6	50%	0.497	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.7	171.6	60.3	0	0	0	0	113.3	D481 E485 K488	D481-T483 PolarHBondContact O-N 3.21Å; T483-E485 WeakPolarHBondContact CB-OE2 3.32Å; T483-E485 WeakPolarHBondContact CG2-OE2 3.19Å; T483-E485 PolarHBondContact O-N 3.01Å; T483-E485 WeakPolarHBondContact OG1-CB 3.4Å; T483-E485 VanDerWaalsContact OG1-CD 3.32Å; T483-E485 VanDerWaalsContact OG1-CG 3.3Å; T483-E485 WeakPolarHBondContact OG1-CG 3.32Å; T483-E485 PolarHBondContact OG1-N 3.42Å; T483-E485 PolarHBondContact OG1-OE2 2.72Å; T483-K488 PolarHBondContact O-NZ 2.98Å
484	G	70.2	Confident	72.5	Confident	19 Å²	19	70.7 Å²	70.7	20%	0.196	38%	0.384	C	S	.	.	S	Bend	trans	66	14	-171.2	0	0	0	0	0	113.7	D481 K488	D481-G484 VanDerWaalsContact CG-CA 3.47Å; D481-G484 PolarHBondContact O-N 3.2Å; D481-G484 VanDerWaalsContact OD1-C 3.25Å; D481-G484 WeakPolarHBondContact OD1-CA 3.34Å; D481-G484 PolarHBondContact OD1-N 2.78Å; D481-G484 VanDerWaalsContact OD2-C 3.24Å; D481-G484 WeakPolarHBondContact OD2-CA 3.32Å; G484-K488 WeakPolarHBondContact O-CB 3.43Å; G484-K488 WeakPolarHBondContact O-CD 3.4Å; G484-K488 WeakPolarHBondContact O-CE 3.27Å; G484-K488 WeakPolarHBondContact O-CG 3Å; G484-K488 PolarHBondContact O-N 2.88Å
485	E	70.7	Confident	70.3	Confident	117 Å²	117	71.7 Å²	71.7	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-78.4	-34.2	-174.6	-72	169	140.5	0	0	112.9	D481 T483 K488 A489	D481-E485 PolarHBondContact OD1-N 2.8Å; T483-E485 WeakPolarHBondContact CB-OE2 3.32Å; T483-E485 WeakPolarHBondContact CG2-OE2 3.19Å; T483-E485 PolarHBondContact O-N 3.01Å; T483-E485 WeakPolarHBondContact OG1-CB 3.4Å; T483-E485 VanDerWaalsContact OG1-CD 3.32Å; T483-E485 VanDerWaalsContact OG1-CG 3.3Å; T483-E485 WeakPolarHBondContact OG1-CG 3.32Å; T483-E485 PolarHBondContact OG1-N 3.42Å; T483-E485 PolarHBondContact OG1-OE2 2.72Å; E485-K488 PolarHBondContact O-N 2.8Å; E485-A489 VanDerWaalsContact O-CB 3.23Å; E485-A489 WeakPolarHBondContact O-CB 3.44Å; E485-A489 PolarHBondContact O-N 2.99Å
486	H	69.8	Low	68.2	Low	95 Å²	95	75.5 Å²	75.5	44%	0.44	40%	0.399	S	S	.	.	H	α-helix	trans	-70.1	-36.5	172.3	-67.9	-85.9	0	0	0	111.1	A471 I479 D481 A489 Y490	A471-H486 HydrophobicContact CB-CB 3.49Å; A471-H486 VanDerWaalsContact CB-CB 3.49Å; I479-H486 HydrophobicContact CG2-CB 4.45Å; D481-H486 HydrophobicContact CB-CB 4.21Å; D481-H486 IonicContact OD1-CD2 3.93Å; D481-H486 IonicContact OD1-CG 2.86Å; D481-H486 PolarHBondContact OD1-N 3.45Å; D481-H486 PolarHBondContact OD2-N 2.86Å; H486-A489 PolarHBondContact O-N 2.99Å; H486-Y490 VanDerWaalsContact O-CB 3.23Å; H486-Y490 WeakPolarHBondContact O-CB 3.25Å; H486-Y490 PolarHBondContact O-N 3.47Å
487	K	70.6	Confident	65.7	Low	36 Å²	36	82.6 Å²	82.6	16%	0.157	42%	0.422	C	S	.	.	H	α-helix	trans	-68	-42.1	172.9	-172.3	166	-58.4	-164.8	0	111.8	E464 A465 T466 G468 L470 D481 Y490 M491	E464-K487 PolarHBondContact O-NZ 2.8Å; A465-K487 WeakPolarHBondContact O-CE 3.44Å; A465-K487 PolarHBondContact O-NZ 3.45Å; A465-K487 VanDerWaalsContact O-NZ 3.13Å; T466-K487 WeakPolarHBondContact O-CD 3.48Å; T466-K487 PolarHBondContact O-NZ 3.39Å; T466-K487 VanDerWaalsContact O-NZ 3.08Å; G468-K487 PolarHBondContact O-NZ 2.83Å; L470-K487 WeakPolarHBondContact O-CE 3.38Å; L470-K487 PolarHBondContact O-NZ 3.31Å; D481-K487 WeakPolarHBondContact OD2-CB 3.4Å; D481-K487 PolarHBondContact OD2-N 3.44Å; K487-Y490 PolarHBondContact O-N 3.4Å; K487-M491 HydrophobicContact CG-SD 4.36Å; K487-M491 WeakPolarHBondContact O-CB 3.48Å; K487-M491 VanDerWaalsContact O-CG 3.27Å; K487-M491 WeakPolarHBondContact O-CG 3.18Å; K487-M491 PolarHBondContact O-N 3.1Å
488	K	67.9	Low	62.8	Low	124 Å²	124	84.9 Å²	84.9	54%	0.539	44%	0.442	S	S	.	.	H	α-helix	trans	-60.5	-47.8	169.2	-72	156.9	-157.3	155.5	0	110.7	T483 G484 E485 Y490 M491 S492	T483-K488 PolarHBondContact O-NZ 2.98Å; G484-K488 WeakPolarHBondContact O-CB 3.43Å; G484-K488 WeakPolarHBondContact O-CD 3.4Å; G484-K488 WeakPolarHBondContact O-CE 3.27Å; G484-K488 WeakPolarHBondContact O-CG 3Å; G484-K488 PolarHBondContact O-N 2.88Å; E485-K488 PolarHBondContact O-N 2.8Å; K488-Y490 PolarHBondContact O-N 2.95Å; K488-M491 PolarHBondContact O-N 3.46Å; K488-S492 WeakPolarHBondContact O-CA 3.44Å; K488-S492 WeakPolarHBondContact O-CB 3.44Å; K488-S492 PolarHBondContact O-N 2.71Å; K488-S492 PolarHBondContact O-OG 3.23Å
489	A	67.6	Low	59.9	Low	48 Å²	48	90 Å²	90	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-42.3	178.9	0	0	0	0	0	112.4	E485 H486 N493	E485-A489 VanDerWaalsContact O-CB 3.23Å; E485-A489 WeakPolarHBondContact O-CB 3.44Å; E485-A489 PolarHBondContact O-N 2.99Å; H486-A489 PolarHBondContact O-N 2.99Å; A489-N493 VanDerWaalsContact O-CB 3.26Å; A489-N493 WeakPolarHBondContact O-CB 3.37Å; A489-N493 VanDerWaalsContact O-CG 3.3Å; A489-N493 PolarHBondContact O-N 2.65Å
490	Y	62.5	Low	57	Low	135 Å²	135	96.6 Å²	96.6	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-43.9	175.8	-167.4	-91.2	0	0	0	111.7	K472 H486 K487 K488 S494	K472-Y490 WeakPolarHBondContact O-CD2 3.39Å; H486-Y490 VanDerWaalsContact O-CB 3.23Å; H486-Y490 WeakPolarHBondContact O-CB 3.25Å; H486-Y490 PolarHBondContact O-N 3.47Å; K487-Y490 PolarHBondContact O-N 3.4Å; K488-Y490 PolarHBondContact O-N 2.95Å; Y490-S494 PolarHBondContact O-N 3.21Å
491	M	57.9	Low	54.1	Low	113 Å²	113	103.6 Å²	103.6	56%	0.557	55%	0.546	S	S	*	.	H	α-helix	trans	-71.7	-37.4	176.6	-69.8	-175.4	74.5	0	0	112.9	K487 K488 S494 N495	K487-M491 HydrophobicContact CG-SD 4.36Å; K487-M491 WeakPolarHBondContact O-CB 3.48Å; K487-M491 VanDerWaalsContact O-CG 3.27Å; K487-M491 WeakPolarHBondContact O-CG 3.18Å; K487-M491 PolarHBondContact O-N 3.1Å; K488-M491 PolarHBondContact O-N 3.46Å; M491-S494 WeakPolarHBondContact CA-OG 3.4Å; M491-S494 CarbonylContact O-C 3.5Å; M491-S494 WeakPolarHBondContact O-CA 3.29Å; M491-S494 WeakPolarHBondContact O-CB 3.26Å; M491-S494 PolarHBondContact O-N 3.36Å; M491-S494 VanDerWaalsContact O-N 3.09Å; M491-S494 PolarHBondContact O-OG 2.86Å; M491-N495 PolarHBondContact O-N 2.86Å; M491-N495 VanDerWaalsContact O-N 3.12Å
492	S	53.5	Low	51.6	Low	52 Å²	52	108.3 Å²	108.3	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-69.9	-40	177.2	-70.5	0	0	0	0	111.9	K488 S494 N495	K488-S492 WeakPolarHBondContact O-CA 3.44Å; K488-S492 WeakPolarHBondContact O-CB 3.44Å; K488-S492 PolarHBondContact O-N 2.71Å; K488-S492 PolarHBondContact O-OG 3.23Å; S492-S494 PolarHBondContact O-N 2.7Å; S492-N495 CarbonylContact O-C 3.58Å; S492-N495 PolarHBondContact O-N 2.77Å
493	N	52.3	Low	49.4	Very low	139 Å²	139	107.6 Å²	107.6	74%	0.743	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-12.4	169.7	-73	-2.9	0	0	0	112.7	A489	A489-N493 VanDerWaalsContact O-CB 3.26Å; A489-N493 WeakPolarHBondContact O-CB 3.37Å; A489-N493 VanDerWaalsContact O-CG 3.3Å; A489-N493 PolarHBondContact O-N 2.65Å
494	S	45.2	Very low	47.5	Very low	80 Å²	80	112.7 Å²	112.7	56%	0.559	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-4	169.2	79.5	0	0	0	0	114.6	Y490 M491 S492	Y490-S494 PolarHBondContact O-N 3.21Å; M491-S494 WeakPolarHBondContact CA-OG 3.4Å; M491-S494 CarbonylContact O-C 3.5Å; M491-S494 WeakPolarHBondContact O-CA 3.29Å; M491-S494 WeakPolarHBondContact O-CB 3.26Å; M491-S494 PolarHBondContact O-N 3.36Å; M491-S494 VanDerWaalsContact O-N 3.09Å; M491-S494 PolarHBondContact O-OG 2.86Å; S492-S494 PolarHBondContact O-N 2.7Å
495	N	35.3	Very low	45.6	Very low	129 Å²	129	120.9 Å²	120.9	69%	0.69	63%	0.625	S	S	*	*			trans	-159.3	89.6	179.4	-96.7	-37.4	0	0	0	112	M491 S492 H497	M491-N495 PolarHBondContact O-N 2.86Å; M491-N495 VanDerWaalsContact O-N 3.12Å; S492-N495 CarbonylContact O-C 3.58Å; S492-N495 PolarHBondContact O-N 2.77Å; N495-H497 PolarHBondContact O-N 3.24Å
496	M	33.6	Very low	43.5	Very low	136 Å²	136	122.5 Å²	122.5	67%	0.67	64%	0.636	S	S	*	*			trans	-93.8	71.7	174.3	-87.5	-69.8	147.3	0	0	112.7
497	H	30.6	Very low	41.7	Very low	185 Å²	185	125.2 Å²	125.2	86%	0.856	65%	0.653	S	S	*	*			trans	-145.2	123.8	155.3	-132.1	58.6	0	0	0	112.7	N495	N495-H497 PolarHBondContact O-N 3.24Å
498	T	29.3	Very low	39.8	Very low	110 Å²	110	128.9 Å²	128.9	68%	0.675	68%	0.681	S	S	*	*			trans	-157.8	173.5	-173.7	64	0	0	0	0	107.1
499	P	30.6	Very low	38.3	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	69%	0.693	S	S	*	*			cis	-130.9	-179.5	-4.2	42.6	-27.9	0	0	0	113.5
500	L	29.4	Very low	36.5	Very low	160 Å²	160	133.6 Å²	133.6	84%	0.838	71%	0.712	S	S	*	*				165.7	136	115.4	-176.3	59.6	0	0	0	111.5
501	M	27	Very low	35.2	Very low	169 Å²	169	133.3 Å²	133.3	83%	0.833	72%	0.724	S	S	*	*			trans	-113.5	138.7	171	-64.1	174.6	68.9	0	0	110.9
502	S	31.4	Very low	34.1	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	73%	0.733	S	S	*	*			trans	-162.2	118.8	153.1	-93.1	0	0	0	0	110
503	N	29.8	Very low	33.4	Very low	111 Å²	111	136.4 Å²	136.4	59%	0.594	76%	0.757	S	S	*	*				96	98.4	66.1	-96.1	-67.3	0	0	0	111.2
504	K	32	Very low	32.6	Very low	187 Å²	187	133.2 Å²	133.2	81%	0.813	76%	0.757	S	S	*	*			trans	67.3	160.7	157.7	-58.7	135.7	-176.1	158.3	0	112.9
505	K	29.7	Very low	32	Very low	192 Å²	192	135.7 Å²	135.7	84%	0.835	77%	0.768	S	S	*	*			cis	-149.7	173.3	26.8	-164.1	173.2	175.7	-175.3	0	112
506	L	27.7	Very low	31.8	Very low	150 Å²	150	138.9 Å²	138.9	79%	0.785	77%	0.772	S	S	*	*			trans	-46.5	167.3	177	-61.7	152.7	0	0	0	116.4
507	L	32.7	Very low	31.9	Very low	153 Å²	153	140.3 Å²	140.3	80%	0.801	78%	0.777	S	S	*	*			trans	-24.4	145.5	159.4	-63.6	162.9	0	0	0	115.5	P509	L507-P509 WeakPolarHBondContact O-CD 3.15Å
508	P	30.8	Very low	31.8	Very low	113 Å²	113	137 Å²	137	73%	0.734	77%	0.77	S	S	*	*			trans	-76.5	125.3	172.9	31.4	-33.1	0	0	0	112.2
509	P	35.1	Very low	32.1	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	77%	0.77	S	S	*	*			trans	-98.4	94.2	160.8	33.7	-21.7	0	0	0	109.1	L507 T511	L507-P509 WeakPolarHBondContact O-CD 3.15Å; P509-T511 PolarHBondContact O-N 2.91Å
510	N	29.9	Very low	32	Very low	150 Å²	150	139 Å²	139	80%	0.802	78%	0.778	S	S	*	*			trans	-72.7	104.9	167.3	-80.3	-7	0	0	0	109.3
511	T	35	Very low	32.2	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	78%	0.778	S	S	*	*			trans	-173.6	122.4	138.5	27.7	0	0	0	0	112.6	P509	P509-T511 PolarHBondContact O-N 2.91Å
512	S	36.2	Very low	32.5	Very low	104 Å²	104	133 Å²	133	73%	0.727	78%	0.778	S	S	*	*			trans	57.4	128.6	140.7	66.2	0	0	0	0	123
513	S	38.4	Very low	32.3	Very low	126 Å²	126	133.2 Å²	133.2	88%	0.881	78%	0.779	S	S	*	*			trans	83	114.8	138.5	-58	0	0	0	0	121.5
514	G	34.1	Very low	32.3	Very low	71 Å²	71	132.7 Å²	132.7	73%	0.732	78%	0.784	S	S	*	*				130.1	98.8	116.9	0	0	0	0	0	119.8
515	V	34.4	Very low	32.2	Very low	132 Å²	132	132.6 Å²	132.6	80%	0.8	78%	0.783	S	S	*	*			trans	59.2	97.1	135.8	-175.9	0	0	0	0	119.6
516	Y	30.7	Very low	32.1	Very low	197 Å²	197	128.7 Å²	128.7	77%	0.773	78%	0.775	S	S	*	*				44.4	134.8	127	-64.1	-70.1	0	0	0	124.5
517	Q	34.6	Very low	32.3	Very low	165 Å²	165	127.5 Å²	127.5	77%	0.771	77%	0.774	S	S	*	*			trans	71.5	147.3	135.1	-75.3	175.4	31.1	0	0	120
518	T	29.7	Very low	32.2	Very low	116 Å²	116	125.8 Å²	125.8	71%	0.712	77%	0.766	S	S	*	*			cis	-159.9	168.9	-31.5	1.9	0	0	0	0	109.8
519	S	35.2	Very low	32.2	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	77%	0.769	S	S	*	*			trans	57.2	112.8	153	58.8	0	0	0	0	121.4
520	N	28	Very low	32.2	Very low	171 Å²	171	129 Å²	129	91%	0.914	77%	0.771	S	S	*	*				37.7	112.3	127	-53.6	-5.1	0	0	0	119.6
521	G	33.3	Very low	32.4	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	76%	0.764	S	S	*	*			trans	-153.9	119.7	168.5	0	0	0	0	0	113.1
522	S	33.1	Very low	32.6	Very low	120 Å²	120	124 Å²	124	84%	0.839	76%	0.761	S	S	*	*			trans	-74.8	125.6	-170.4	-172.9	0	0	0	0	115
523	C	27.4	Very low	32.5	Very low	111 Å²	111	126 Å²	126	75%	0.75	76%	0.762	S	S	*	*			trans	61.2	165.4	131.9	-156.8	0	0	0	0	121.6
524	S	31	Very low	32.1	Very low	99 Å²	99	124.7 Å²	124.7	69%	0.692	75%	0.745	S	S	*	*			trans	84.2	98.9	158.2	-66.5	0	0	0	0	121.5
525	K	28.6	Very low	32.2	Very low	185 Å²	185	131.2 Å²	131.2	80%	0.804	75%	0.747	S	S	*	*				85.2	106.3	104.8	-164.1	178	-177.4	178.7	0	119.7
526	V	28.5	Very low	32.1	Very low	110 Å²	110	131.1 Å²	131.1	67%	0.667	74%	0.742	S	S	*	*			trans	66.8	115.5	140.9	178.3	0	0	0	0	119
527	T	32.5	Very low	32.3	Very low	125 Å²	125	128.1 Å²	128.1	77%	0.767	74%	0.738	S	S	*	*				-170.2	120.9	120	19.8	0	0	0	0	107.6
528	N	29	Very low	32.1	Very low	118 Å²	118	126.2 Å²	126.2	63%	0.631	74%	0.738	S	S	*	*				63.6	119.8	87.5	-90.6	-43.3	0	0	0	115.6
529	K	30.5	Very low	32.6	Very low	182 Å²	182	125.9 Å²	125.9	79%	0.791	74%	0.738	S	S	*	*			trans	54	115.8	140.7	-53.3	171	-173.7	-179.9	0	116.1
530	S	36.1	Very low	32.3	Very low	119 Å²	119	127.2 Å²	127.2	83%	0.832	74%	0.742	S	S	*	*				-170.6	159.3	69.2	43.1	0	0	0	0	112.5
531	G	33.4	Very low	32.2	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	74%	0.738	S	S	*	*			trans	-89.8	-141.7	154.7	0	0	0	0	0	109.5
532	P	40.8	Very low	32	Very low	111 Å²	111	133 Å²	133	72%	0.721	74%	0.736	S	S	*	*			cis	-134.8	-147	-0.9	32.6	-8	0	0	0	110.7
533	I	33.6	Very low	32.3	Very low	146 Å²	146	135.1 Å²	135.1	75%	0.749	73%	0.733	S	S	*	*			trans	71.5	129.2	152.4	-75.5	168.7	0	0	0	115.3
534	D	30.6	Very low	32.5	Very low	98 Å²	98	135.3 Å²	135.3	52%	0.524	73%	0.732	S	S	.	*			cis	-166.5	170.5	-3.5	-139	-19.9	0	0	0	110.3
535	R	36.3	Very low	32.3	Very low	208 Å²	208	137.5 Å²	137.5	79%	0.785	74%	0.736	S	S	*	*			trans	62.1	147.5	147.7	-74	164.8	-139.7	-157.5	6.7	120
536	N	31.2	Very low	32.4	Very low	130 Å²	130	133.6 Å²	133.6	70%	0.695	74%	0.738	S	S	*	*			cis	-167	173.2	-20	-151	-9.8	0	0	0	109.1
537	I	35.7	Very low	32.5	Very low	134 Å²	134	132.1 Å²	132.1	69%	0.687	74%	0.737	S	S	*	*			trans	61.4	97.2	158.1	-58.9	154.3	0	0	0	114.6
538	T	30.7	Very low	32.4	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	74%	0.738	S	S	*	*				53.5	156.3	67.3	10.6	0	0	0	0	115
539	P	38.8	Very low	32.7	Very low	109 Å²	109	137.2 Å²	137.2	71%	0.708	75%	0.746	S	S	*	*				-130.5	-165.2	-116.9	39.6	-20.3	0	0	0	115.2
540	T	28.5	Very low	32.7	Very low	126 Å²	126	134.7 Å²	134.7	77%	0.773	75%	0.746	S	S	*	*			trans	93.1	136.5	158.5	-21.9	0	0	0	0	118
541	R	26.7	Very low	32.7	Very low	223 Å²	223	135 Å²	135	84%	0.842	75%	0.745	S	S	*	*			trans	85.6	152.7	144.9	-136.2	-179.2	-169	-168.4	3.1	119
542	L	29.8	Very low	32.5	Very low	150 Å²	150	138.7 Å²	138.7	79%	0.785	75%	0.75	S	S	*	*			trans	85.5	126.5	162.3	-53.7	177.3	0	0	0	119.5
543	H	37.7	Very low	32.1	Very low	165 Å²	165	141 Å²	141	76%	0.764	76%	0.755	S	S	*	*			trans	-59	147.6	152.1	-105.4	-99.8	0	0	0	110.1
544	P	33.1	Very low	32.2	Very low	115 Å²	115	138.6 Å²	138.6	75%	0.747	75%	0.747	S	S	*	*				-123.3	152.5	93.4	-0.6	22.6	0	0	0	111.8
545	L	27	Very low	32.2	Very low	146 Å²	146	138.2 Å²	138.2	76%	0.764	75%	0.745	S	S	*	*			cis	67.1	119	49.5	-76.4	172.5	0	0	0	115.3
546	A	29.8	Very low	32	Very low	102 Å²	102	130.8 Å²	130.8	84%	0.843	73%	0.732	S	S	*	*			trans	65.7	150.5	161.6	0	0	0	0	0	117.2
547	A	30.5	Very low	32.2	Very low	80 Å²	80	131 Å²	131	66%	0.661	73%	0.727	S	S	*	*			cis	-167.1	171.9	-7.2	0	0	0	0	0	110.3
548	K	30.9	Very low	32.1	Very low	181 Å²	181	129.1 Å²	129.1	79%	0.787	72%	0.724	S	S	*	*			trans	68	157.2	160	-70	168	179.2	-179.6	0	115.4
549	Q	34.4	Very low	32.3	Very low	168 Å²	168	129.2 Å²	129.2	79%	0.785	72%	0.724	S	S	*	*			cis	-153.6	150.1	1.5	-127.6	149.9	-25.6	0	0	111.1
550	T	31.9	Very low	31.9	Very low	130 Å²	130	130.3 Å²	130.3	80%	0.798	72%	0.724	S	S	*	*			trans	-79	150.9	165.7	50.6	0	0	0	0	111.2
551	P	35.8	Very low	31.9	Very low	124 Å²	124	131.2 Å²	131.2	81%	0.805	72%	0.723	S	S	*	*				-136.3	173.8	77.1	13.8	11.6	0	0	0	113.5
552	N	29	Very low	31.9	Very low	142 Å²	142	125 Å²	125	76%	0.759	71%	0.714	S	S	*	*			cis	107.2	130.1	17	-167.4	23.9	0	0	0	115.7
553	I	33	Very low	32.1	Very low	160 Å²	160	124.8 Å²	124.8	82%	0.821	71%	0.713	S	S	*	*			trans	-169.2	168.2	165.6	-116.2	168.1	0	0	0	112.2
554	T	33.9	Very low	31.9	Very low	95 Å²	95	122.6 Å²	122.6	58%	0.583	71%	0.711	S	S	*	*			trans	-143.6	160.1	-163.3	60.1	0	0	0	0	117.8
555	N	32.3	Very low	32.1	Very low	90 Å²	90	122 Å²	122	48%	0.481	71%	0.707	S	S	.	*			trans	77	138	177.4	-57.9	-69.5	0	0	0	117.9	V159 S160 L161	V159-N555 WeakPolarHBondContact CA-OD1 3.16Å; S160-N555 PolarHBondContact N-OD1 3.41Å; S160-N555 WeakPolarHBondContact O-CA 3.42Å; S160-N555 PolarHBondContact O-N 2.9Å; S160-N555 VanDerWaalsContact O-N 3.09Å; S160-N555 PolarHBondContact O-OD1 2.89Å; L161-N555 VanDerWaalsContact CG-C 3.49Å; L161-N555 VanDerWaalsContact CG-N 3.33Å
556	G	32.2	Very low	32.4	Very low	51 Å²	51	121.4 Å²	121.4	53%	0.526	71%	0.705	S	S	.	*			cis	170.2	175	-7	0	0	0	0	0	110.3	S160	S160-G556 WeakPolarHBondContact OG-CA 3.39Å
557	K	33.7	Very low	32.5	Very low	136 Å²	136	125.7 Å²	125.7	59%	0.591	71%	0.705	S	S	*	*			cis	-161.7	147	-10.6	-176.4	166.5	-176.3	160.1	0	109	P158 V159 S160	P158-K557 PolarHBondContact O-NZ 3.4Å; V159-K557 WeakPolarHBondContact O-CD 3.44Å; V159-K557 VanDerWaalsContact O-CE 3.32Å; V159-K557 WeakPolarHBondContact O-CE 2.95Å; V159-K557 PolarHBondContact O-NZ 3.26Å; S160-K557 WeakPolarHBondContact OG-CA 3.39Å; S160-K557 WeakPolarHBondContact OG-CB 3.3Å; S160-K557 VanDerWaalsContact OG-CG 3.32Å; S160-K557 WeakPolarHBondContact OG-CG 3.18Å
558	P	34.8	Very low	32.7	Very low	94 Å²	94	128 Å²	128	61%	0.61	72%	0.716	S	S	*	*			trans	-97.1	179	-176.6	37.9	-35.9	0	0	0	115.7
559	V	34.4	Very low	33	Very low	127 Å²	127	127.1 Å²	127.1	77%	0.77	72%	0.717	S	S	*	*			trans	81.8	136	172.9	-172.5	0	0	0	0	113.1
560	N	29.6	Very low	33.4	Very low	132 Å²	132	124.9 Å²	124.9	71%	0.706	72%	0.717	S	S	*	*			cis	-148.8	179.2	17.9	-138.6	-13	0	0	0	115
561	L	29.8	Very low	33.6	Very low	145 Å²	145	123.5 Å²	123.5	76%	0.759	71%	0.71	S	S	*	*			trans	-1.9	150.7	151.8	-66.9	161.1	0	0	0	119.8
562	S	27.3	Very low	33.3	Very low	93 Å²	93	125 Å²	125	65%	0.65	71%	0.71	S	S	*	*			cis	-166.7	175.9	16.7	-139	0	0	0	0	114.8
563	L	32	Very low	33.7	Very low	144 Å²	144	123.9 Å²	123.9	75%	0.754	71%	0.714	S	S	*	*			trans	70	95.9	154.2	-67.9	161.5	0	0	0	121.7
564	T	35	Very low	33.6	Very low	120 Å²	120	121.9 Å²	121.9	74%	0.736	71%	0.714	S	S	*	*				43.8	152.5	118	54.8	0	0	0	0	123.6
565	P	37.8	Very low	33.6	Very low	101 Å²	101	120.2 Å²	120.2	66%	0.656	72%	0.716	S	S	*	*			cis	-140.5	-175.3	-15.6	38.5	-18.6	0	0	0	116.5
566	N	32.3	Very low	33.6	Very low	135 Å²	135	127.6 Å²	127.6	72%	0.722	74%	0.737	S	S	*	*			trans	88.6	148.7	150.6	-69.4	-14.4	0	0	0	122.9
567	F	31.3	Very low	33.7	Very low	191 Å²	191	137 Å²	137	84%	0.838	76%	0.757	S	S	*	*			trans	61.2	90.2	165.1	-61.7	-63	0	0	0	120.9
568	S	35.7	Very low	33.7	Very low	128 Å²	128	134 Å²	134	90%	0.895	77%	0.765	S	S	*	*				-164.1	139.7	124.1	-85.2	0	0	0	0	113.6
569	M	37.5	Very low	33.8	Very low	163 Å²	163	139.4 Å²	139.4	80%	0.803	77%	0.773	S	S	*	*			trans	-115.4	148	159.8	-93	-77.5	169.8	0	0	106.8
570	P	41.3	Very low	34	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	77%	0.77	S	S	*	*				-135.7	171	91.7	15.1	7.9	0	0	0	114.7
571	P	37	Very low	34.3	Very low	101 Å²	101	136.8 Å²	136.8	66%	0.656	77%	0.765	S	S	*	*			trans	-112.9	-168.8	-160.9	42.6	-34.8	0	0	0	115.5
572	L	29.2	Very low	34.4	Very low	155 Å²	155	133.7 Å²	133.7	81%	0.812	77%	0.769	S	S	*	*			trans	76.3	103.7	159.9	-63.2	165.5	0	0	0	119.4
573	S	37.3	Very low	34.9	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	77%	0.77	S	S	*	*				-161.1	90.2	128.2	-168.4	0	0	0	0	111.8	G575	S573-G575 VanDerWaalsContact C-N 3.31Å; S573-G575 PolarHBondContact O-N 3.18Å
574	S	31	Very low	35.1	Very low	119 Å²	119	136.5 Å²	136.5	83%	0.832	78%	0.775	S	S	*	*			trans	-79	73.9	-177.6	-60.2	0	0	0	0	112.4	R576	S574-R576 PolarHBondContact O-N 3.48Å
575	G	33.5	Very low	35.3	Very low	60 Å²	60	135 Å²	135	62%	0.619	78%	0.775	S	S	*	*			trans	-67.8	81.1	-178.4	0	0	0	0	0	115.1	S573 R577	S573-G575 VanDerWaalsContact C-N 3.31Å; S573-G575 PolarHBondContact O-N 3.18Å; G575-R577 PolarHBondContact O-N 3.11Å
576	R	33.3	Very low	35.2	Very low	245 Å²	245	139.9 Å²	139.9	93%	0.925	79%	0.786	S	S	*	*			trans	10.2	97.1	161.2	-59	180	-170.9	-104.6	2	116.5	S574	S574-R576 PolarHBondContact O-N 3.48Å
577	R	34.4	Very low	35.2	Very low	248 Å²	248	142.6 Å²	142.6	94%	0.936	79%	0.791	S	S	*	*			trans	-107.5	118.6	156	-62.7	-173.4	-151.3	-135.5	3.3	109	G575	G575-R577 PolarHBondContact O-N 3.11Å
578	G	33.1	Very low	35.1	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79.3	137.6	-173.8	0	0	0	0	0	113.1
579	R	36.5	Very low	34.8	Very low	207 Å²	207	138.9 Å²	138.9	78%	0.781	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-62.6	127.9	170.5	-166.6	175	-175.7	173.3	2	110.1
580	P	39.1	Very low	34.4	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-63.5	156.1	175	-22.2	33.7	0	0	0	112.7
581	P	35.2	Very low	33.8	Very low	93 Å²	93	137.2 Å²	137.2	60%	0.604	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-86.9	143	169.7	35.2	-32.4	0	0	0	112.1	K360	K360-P581 HydrophobicContact CB-CG 4.44Å; K360-P581 HydrophobicContact CD-CG 4.34Å
582	G	32.2	Very low	33.7	Very low	81 Å²	81	138.7 Å²	138.7	84%	0.835	77%	0.766	S	S	*	*			trans	131.8	150.7	179.9	0	0	0	0	0	111.1
583	S	37.6	Very low	33.7	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	76%	0.764	S	S	*	*			cis	-128.7	151.2	14.3	44.7	0	0	0	0	113.7
584	K	36.6	Very low	33.4	Very low	200 Å²	200	140.1 Å²	140.1	87%	0.87	77%	0.765	S	S	*	*			trans	-130.3	135.1	143.5	-77.9	-162	172.7	-168.4	0	106.9
585	A	38.8	Very low	33.4	Very low	88 Å²	88	138.6 Å²	138.6	73%	0.727	75%	0.753	S	S	*	*			trans	-112	163.5	-166.9	0	0	0	0	0	113.1
586	K	37.3	Very low	33.4	Very low	203 Å²	203	142.4 Å²	142.4	88%	0.883	76%	0.755	S	S	*	*			trans	-70.3	144.2	-167.2	-59.2	172.9	178.3	178.6	0	114.7
587	K	31.9	Very low	33.4	Very low	193 Å²	193	138.7 Å²	138.7	84%	0.839	75%	0.745	S	S	*	*			trans	-130.3	109.6	132	-158.9	169.3	-177.6	-177.4	0	104.4
588	I	28.9	Very low	33.6	Very low	142 Å²	142	136.4 Å²	136.4	73%	0.728	74%	0.742	S	S	*	*				50.5	111.2	95.1	-54.4	167.2	0	0	0	108.9
589	S	30.1	Very low	33.5	Very low	98 Å²	98	138 Å²	138	69%	0.685	73%	0.732	S	S	*	*			cis	-151.3	166.7	37.7	-135.8	0	0	0	0	116.3
590	S	28.7	Very low	33.4	Very low	84 Å²	84	137 Å²	137	59%	0.587	73%	0.733	S	S	*	*			trans	-5.4	149.1	137.1	61.7	0	0	0	0	118.2
591	E	28.5	Very low	33.3	Very low	165 Å²	165	137 Å²	137	77%	0.771	73%	0.731	S	S	*	*			cis	-170.6	175.6	11.4	-127.8	160.7	-127	0	0	114.1
592	I	33.6	Very low	33.3	Very low	133 Å²	133	140.6 Å²	140.6	68%	0.682	74%	0.74	S	S	*	*			trans	72.9	100.3	153.9	-61.4	153.5	0	0	0	121.2
593	N	29.9	Very low	33.3	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	73%	0.729	S	S	*	*				41.7	118.3	126.7	-60.6	-54.3	0	0	0	125.8
594	L	32.3	Very low	33.3	Very low	161 Å²	161	143.2 Å²	143.2	84%	0.843	74%	0.736	S	S	*	*				78.9	129.9	111.9	-160.6	79.2	0	0	0	123.7
595	C	29.7	Very low	33.2	Very low	87 Å²	87	138.6 Å²	138.6	59%	0.588	73%	0.729	S	S	*	*			trans	118.4	114.1	133.2	-115.5	0	0	0	0	123.7
596	E	33	Very low	33.1	Very low	140 Å²	140	139.8 Å²	139.8	65%	0.654	73%	0.728	S	S	*	*			trans	73.3	136.2	131.7	-84.6	-165.7	142.4	0	0	127.6
597	K	35.1	Very low	33	Very low	167 Å²	167	134 Å²	134	73%	0.726	72%	0.717	S	S	*	*			trans	73	165.3	150.3	-67.5	158.7	-176.9	151.1	0	117
598	K	37	Very low	33.1	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.865	72%	0.719	S	S	*	*			cis	-147.5	178.2	13.7	-162.5	167.2	173.7	-73.9	0	112.5
599	I	32.1	Very low	33.4	Very low	107 Å²	107	132 Å²	132	55%	0.549	72%	0.718	S	S	.	*			trans	-114.6	144.1	-174.7	-96.9	177.7	0	0	0	114	A299	A299-I599 HydrophobicContact CB-CD1 4.32Å
600	K	34.2	Very low	33.6	Very low	187 Å²	187	134.5 Å²	134.5	81%	0.813	72%	0.724	S	S	*	*			trans	27	149.1	139.8	-160.6	172.5	179.5	-173.4	0	121
601	V	35.6	Very low	33.9	Very low	111 Å²	111	135.7 Å²	135.7	67%	0.673	73%	0.728	S	S	*	*			cis	-169.7	175.1	-26.7	136	0	0	0	0	106.9
602	E	35.5	Very low	34.3	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	73%	0.727	S	S	*	*			trans	142.9	144.8	142.6	-74.3	-158.1	145.7	0	0	112
603	N	33.9	Very low	34.5	Very low	115 Å²	115	133 Å²	133	62%	0.615	73%	0.729	S	S	*	*			cis	-163.1	173	-11.9	-100.2	-17.6	0	0	0	111.2
604	S	36.1	Very low	35.2	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	73%	0.733	S	S	*	*			trans	73.9	167.2	164	-55.8	0	0	0	0	118.7
605	S	35.9	Very low	35.5	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	73%	0.73	S	S	*	*			cis	-175.9	177.3	-26	-89.7	0	0	0	0	111.1
606	T	35	Very low	35.9	Very low	114 Å²	114	127.3 Å²	127.3	70%	0.699	74%	0.735	S	S	*	*			cis	-168.1	106.7	-42.4	-72.5	0	0	0	0	113
607	A	35.2	Very low	36.2	Very low	80 Å²	80	126.2 Å²	126.2	66%	0.661	74%	0.737	S	S	*	*			trans	60.3	170	142.1	0	0	0	0	0	126.5
608	Y	34.1	Very low	36.3	Very low	225 Å²	225	122.5 Å²	122.5	88%	0.882	73%	0.725	S	S	*	*			trans	86.4	150	164.7	-63	-75.5	0	0	0	120.9
609	G	35.9	Very low	36.3	Very low	69 Å²	69	116.5 Å²	116.5	71%	0.711	71%	0.709	S	S	*	*			cis	-144.3	-147.3	-2.2	0	0	0	0	0	110.8
610	N	34.7	Very low	36.4	Very low	151 Å²	151	118.1 Å²	118.1	81%	0.807	72%	0.718	S	S	*	*			cis	-170.8	167	-13.1	-138.6	0.2	0	0	0	107.1
611	T	34.6	Very low	36.5	Very low	108 Å²	108	114.6 Å²	114.6	66%	0.663	71%	0.713	S	S	*	*			cis	-128.9	-102.4	2.4	-47.5	0	0	0	0	112.2
612	T	36.6	Very low	36.4	Very low	122 Å²	122	113.7 Å²	113.7	75%	0.748	71%	0.71	S	S	*	*			cis	-157	179.5	-1	-41.5	0	0	0	0	109.9
613	T	39	Very low	36.4	Very low	120 Å²	120	113.1 Å²	113.1	74%	0.736	71%	0.713	S	S	*	*			trans	-149.1	-177.4	-152.9	54.8	0	0	0	0	115.1
614	P	42.8	Very low	36.5	Very low	129 Å²	129	110.7 Å²	110.7	84%	0.838	72%	0.715	S	S	*	*				-151.9	-174.4	-56.9	46.5	-28.9	0	0	0	119.6
615	G	39.8	Very low	36.4	Very low	77 Å²	77	112.4 Å²	112.4	79%	0.794	71%	0.714	S	S	*	*			trans	-171.9	161.6	151.5	0	0	0	0	0	110.3
616	G	37.4	Very low	36.4	Very low	66 Å²	66	114.1 Å²	114.1	68%	0.68	72%	0.715	S	S	*	*			cis	106.6	135.1	-3.9	0	0	0	0	0	114.5
617	V	40	Very low	36.5	Very low	117 Å²	117	114.3 Å²	114.3	71%	0.709	72%	0.717	S	S	*	*			cis	-159.6	179.7	-6.4	-62.4	0	0	0	0	107.3
618	D	36.5	Very low	36.8	Very low	88 Å²	88	116.2 Å²	116.2	47%	0.471	72%	0.722	S	S	.	*			cis	-150	-146.1	1.6	-165.9	29.3	0	0	0	107.8	I1053 S1054	D618-I1053 VanDerWaalsContact O-CG2 3.23Å; D618-I1053 WeakPolarHBondContact O-CG2 3.46Å; D618-S1054 PolarHBondContact O-OG 2.9Å
619	S	36.4	Very low	36.8	Very low	74 Å²	74	110.4 Å²	110.4	52%	0.517	72%	0.715	S	S	.	*			cis	-167.3	174.9	1.4	-153.7	0	0	0	0	112.9
620	N	35.9	Very low	36.5	Very low	140 Å²	140	114.5 Å²	114.5	75%	0.749	72%	0.719	S	S	*	*			trans	38.3	147.8	153.9	-81	-41.9	0	0	0	122.8
621	T	36.3	Very low	36.4	Very low	114 Å²	114	117 Å²	117	70%	0.699	72%	0.719	S	S	*	*			cis	164.4	139.5	-11.3	-95.6	0	0	0	0	106.2
622	C	33.2	Very low	36.4	Very low	92 Å²	92	118 Å²	118	62%	0.622	72%	0.719	S	S	*	*			cis	-169.9	-174.1	-8.1	60	0	0	0	0	110.8
623	N	35.5	Very low	36.2	Very low	155 Å²	155	116.2 Å²	116.2	83%	0.829	71%	0.711	S	S	*	*			trans	77.2	140.7	163.6	-57.5	-21.8	0	0	0	121.1
624	G	35.2	Very low	36	Very low	65 Å²	65	118 Å²	118	67%	0.67	72%	0.716	S	S	*	*			cis	167.8	166.7	-12.3	0	0	0	0	0	116.4
625	L	35.4	Very low	35.6	Very low	151 Å²	151	115.5 Å²	115.5	79%	0.791	71%	0.706	S	S	*	*			trans	63.2	139.2	149.8	-59.9	170.3	0	0	0	118.9
626	N	34.9	Very low	35.1	Very low	139 Å²	139	119.3 Å²	119.3	74%	0.743	71%	0.709	S	S	*	*			cis	-154.8	-175.2	29.5	-80.9	-59	0	0	0	110.3
627	T	36.2	Very low	34.9	Very low	119 Å²	119	121 Å²	121	73%	0.73	71%	0.71	S	S	*	*				-162.5	168.1	-71.6	26.8	0	0	0	0	109.1
628	P	41.9	Very low	34.6	Very low	119 Å²	119	121 Å²	121	77%	0.773	72%	0.715	S	S	*	*			trans	-121.1	179.8	-161	43.7	-33.8	0	0	0	117.1
629	S	35.2	Very low	34.5	Very low	104 Å²	104	120 Å²	120	73%	0.727	73%	0.725	S	S	*	*			trans	-158.9	141.7	154.7	-149.8	0	0	0	0	108.1
630	L	28.3	Very low	34.4	Very low	154 Å²	154	124.4 Å²	124.4	81%	0.806	74%	0.742	S	S	*	*			cis	70.2	119.8	31.5	-71.6	177.2	0	0	0	116.1
631	Y	33.4	Very low	34.3	Very low	203 Å²	203	123.9 Å²	123.9	80%	0.796	74%	0.744	S	S	*	*			trans	-175.4	131.3	141.4	-122.1	-128.4	0	0	0	112.6
632	I	35.3	Very low	34.3	Very low	131 Å²	131	124 Å²	124	67%	0.672	75%	0.746	S	S	*	*			trans	50.9	149	141.2	-63.5	-172.5	0	0	0	121.3
633	S	30.7	Very low	34.2	Very low	83 Å²	83	125.8 Å²	125.8	58%	0.58	76%	0.755	S	S	*	*			cis	-177.2	170.8	-34.4	-77.8	0	0	0	0	108.3
634	D	34.6	Very low	34.1	Very low	157 Å²	157	123.5 Å²	123.5	84%	0.84	75%	0.751	S	S	*	*			trans	68.1	158	154.4	-51.8	-40	0	0	0	120
635	A	34.6	Very low	33.7	Very low	77 Å²	77	125.4 Å²	125.4	64%	0.636	75%	0.753	S	S	*	*			cis	-168.3	155.9	-38	0	0	0	0	0	109.6
636	N	29.9	Very low	33.5	Very low	158 Å²	158	126.6 Å²	126.6	85%	0.845	75%	0.752	S	S	*	*			trans	31.9	134.8	145.7	-62.7	-17.4	0	0	0	120.2
637	S	32.6	Very low	33.1	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	75%	0.749	S	S	*	*			cis	174.4	164.4	38	38.5	0	0	0	0	112.3
638	S	35	Very low	32.9	Very low	118 Å²	118	124.6 Å²	124.6	83%	0.825	75%	0.749	S	S	*	*			trans	59.5	140.3	154.2	56.8	0	0	0	0	120.4
639	G	34	Very low	32.3	Very low	66 Å²	66	127 Å²	127	68%	0.68	75%	0.75	S	S	*	*			cis	168.7	176.8	-4.5	0	0	0	0	0	113.1
640	L	34.2	Very low	32.1	Very low	167 Å²	167	126.1 Å²	126.1	87%	0.874	75%	0.749	S	S	*	*			trans	72.4	128.4	174.6	-46.6	176.1	0	0	0	116
641	V	34	Very low	32.1	Very low	130 Å²	130	124.7 Å²	124.7	79%	0.788	75%	0.746	S	S	*	*			cis	80.8	136.4	22	-174.1	0	0	0	0	112.9
642	P	36	Very low	31.9	Very low	115 Å²	115	119.3 Å²	119.3	75%	0.747	74%	0.738	S	S	*	*			cis	-134.8	-171.3	11.1	29.4	-3.9	0	0	0	118.8
643	T	31.2	Very low	31.8	Very low	130 Å²	130	119.9 Å²	119.9	80%	0.798	74%	0.738	S	S	*	*			trans	-52	156.4	172.2	56	0	0	0	0	121.7
644	S	33.1	Very low	31.9	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	75%	0.747	S	S	*	*				165.6	134.5	129	51.3	0	0	0	0	110.3
645	C	27.5	Very low	32	Very low	105 Å²	105	119.3 Å²	119.3	71%	0.709	73%	0.732	S	S	*	*			cis	101.6	147	26.5	80.1	0	0	0	0	116
646	F	30.2	Very low	31.9	Very low	176 Å²	176	125 Å²	125	77%	0.772	74%	0.743	S	S	*	*			trans	93.8	97.5	172.6	-69.6	-77.1	0	0	0	123.8
647	T	27.8	Very low	31.9	Very low	112 Å²	112	121.9 Å²	121.9	69%	0.687	73%	0.734	S	S	*	*				60.9	155.7	122.1	52.9	0	0	0	0	126.2
648	S	30.7	Very low	32.1	Very low	105 Å²	105	123 Å²	123	73%	0.734	74%	0.741	S	S	*	*			trans	72.5	155.9	153.4	48	0	0	0	0	120.1
649	H	30.1	Very low	32.1	Very low	170 Å²	170	122.2 Å²	122.2	79%	0.787	73%	0.732	S	S	*	*			cis	178.3	149.7	-38.5	-125.2	-82.6	0	0	0	107.4
650	A	29.9	Very low	32.1	Very low	84 Å²	84	126.7 Å²	126.7	69%	0.694	74%	0.739	S	S	*	*			trans	66.2	162.8	158.9	0	0	0	0	0	116.8
651	T	29.6	Very low	32.3	Very low	124 Å²	124	123.6 Å²	123.6	76%	0.761	73%	0.728	S	S	*	*			cis	-160.3	155.3	-9.4	2.8	0	0	0	0	111
652	S	29.2	Very low	32.5	Very low	90 Å²	90	123.4 Å²	123.4	63%	0.629	73%	0.727	S	S	*	*			trans	53.9	172.6	154.6	61.1	0	0	0	0	117.8
653	E	32.8	Very low	32.5	Very low	143 Å²	143	125 Å²	125	67%	0.668	73%	0.729	S	S	*	*			cis	-133.4	135.2	17.7	-71.6	-68.8	138.8	0	0	108.5
654	L	33	Very low	33	Very low	146 Å²	146	124.3 Å²	124.3	76%	0.764	73%	0.726	S	S	*	*				60.7	162	94.5	-71.4	-162.2	0	0	0	116.3
655	P	35.9	Very low	33.3	Very low	82 Å²	82	124.9 Å²	124.9	53%	0.532	73%	0.731	S	S	.	*			cis	-140.1	-178.5	-18.8	27.6	-3.7	0	0	0	116.1
656	F	33.1	Very low	33.8	Very low	197 Å²	197	125 Å²	125	86%	0.864	73%	0.732	S	S	*	*			trans	69.5	160.8	154	-56.5	-47.7	0	0	0	121.3
657	S	30.1	Very low	34.1	Very low	92 Å²	92	121.7 Å²	121.7	64%	0.643	73%	0.732	S	S	*	*			cis	158.7	110.1	-39.7	172.4	0	0	0	0	109.7
658	S	37.3	Very low	34.3	Very low	123 Å²	123	125.3 Å²	125.3	86%	0.86	74%	0.738	S	S	*	*			trans	-169.2	151.9	153.5	50.9	0	0	0	0	112.5
659	T	34.3	Very low	34.5	Very low	103 Å²	103	127.6 Å²	127.6	63%	0.632	74%	0.74	S	S	*	*				178.2	130.9	-64.6	-87.7	0	0	0	0	110
660	I	34.3	Very low	34.7	Very low	159 Å²	159	124.6 Å²	124.6	82%	0.815	73%	0.734	S	S	*	*			trans	80.3	152.8	156.2	-91.2	166.9	0	0	0	118.2
661	P	39.3	Very low	34.8	Very low	102 Å²	102	126.7 Å²	126.7	66%	0.662	74%	0.738	S	S	*	*				-142.5	-112.9	-112.1	43.2	-20.9	0	0	0	115
662	V	36.4	Very low	34.9	Very low	126 Å²	126	128.6 Å²	128.6	76%	0.764	74%	0.742	S	S	*	*			trans	81.9	140.8	171.8	168.8	0	0	0	0	116.9
663	L	37.7	Very low	34.9	Very low	148 Å²	148	128.2 Å²	128.2	78%	0.775	74%	0.744	S	S	*	*			cis	-159.8	-167	-41.8	-135.6	74	0	0	0	107.6
664	P	41.4	Very low	34.9	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	75%	0.748	S	S	*	*			trans	-124.7	174.4	-133.9	41.1	-21.7	0	0	0	116.6
665	S	38.4	Very low	34.8	Very low	120 Å²	120	125.5 Å²	125.5	84%	0.839	75%	0.748	S	S	*	*			trans	-152.7	147.1	149.3	53.4	0	0	0	0	113.1
666	S	39	Very low	34.6	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	76%	0.756	S	S	*	*			trans	-46.7	158	178.7	46	0	0	0	0	116.2
667	S	36.9	Very low	34.7	Very low	108 Å²	108	124 Å²	124	76%	0.755	75%	0.753	S	S	*	*			cis	-152.9	146	41.7	-48.6	0	0	0	0	116
668	F	31.9	Very low	35	Very low	187 Å²	187	126 Å²	126	82%	0.82	76%	0.756	S	S	*	*			trans	-82.1	176	156.6	-73.5	-107.7	0	0	0	108.6
669	I	34.9	Very low	34.7	Very low	153 Å²	153	126.7 Å²	126.7	79%	0.785	76%	0.759	S	S	*	*				-164.7	122.1	55.1	-76.8	176.4	0	0	0	105.4
670	T	34.3	Very low	35	Very low	107 Å²	107	126 Å²	126	66%	0.656	76%	0.757	S	S	*	*				72.5	108.7	81	-50.4	0	0	0	0	116
671	V	30.3	Very low	35.1	Very low	128 Å²	128	125.5 Å²	125.5	78%	0.776	76%	0.755	S	S	*	*			trans	12.9	133.2	140.5	-175.3	0	0	0	0	119.4
672	I	32.8	Very low	35	Very low	164 Å²	164	128.8 Å²	128.8	84%	0.841	77%	0.766	S	S	*	*			trans	-161.9	153.3	134.1	-102.3	152.4	0	0	0	110.2
673	A	28.1	Very low	34.9	Very low	83 Å²	83	130.1 Å²	130.1	69%	0.686	77%	0.768	S	S	*	*			trans	-102.2	-157.3	177.5	0	0	0	0	0	111.6
674	S	32.4	Very low	34.9	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	77%	0.766	S	S	*	*			trans	89.1	99.2	-177.2	-37.4	0	0	0	0	113
675	T	31.9	Very low	34.7	Very low	125 Å²	125	126.1 Å²	126.1	77%	0.767	76%	0.763	S	S	*	*				78.3	116.2	75.1	60.6	0	0	0	0	115.9
676	S	31.5	Very low	34.4	Very low	98 Å²	98	126.7 Å²	126.7	69%	0.685	76%	0.761	S	S	*	*			trans	47.8	114.1	143.8	62.3	0	0	0	0	121.2
677	N	35.8	Very low	34.3	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	77%	0.767	S	S	*	*			trans	-150.5	116.9	131.1	-89.1	-49.6	0	0	0	107.4
678	N	35.5	Very low	34.2	Very low	132 Å²	132	131.9 Å²	131.9	71%	0.706	77%	0.77	S	S	*	*				66.7	98.2	79.3	-81.8	-34.4	0	0	0	114.5
679	C	32.4	Very low	34.4	Very low	138 Å²	138	127.9 Å²	127.9	93%	0.932	76%	0.762	S	S	*	*			trans	-151.6	87.8	152.1	-94	0	0	0	0	109.9
680	P	40.4	Very low	34.4	Very low	89 Å²	89	125.4 Å²	125.4	58%	0.578	76%	0.755	S	S	*	*			trans	-99.5	172.8	171.9	37.6	-32.4	0	0	0	112.8
681	N	36.6	Very low	34.4	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	76%	0.758	S	S	*	*			trans	74	153.3	175.5	-46.6	-49	0	0	0	113.3
682	I	36.6	Very low	34.5	Very low	171 Å²	171	130.4 Å²	130.4	88%	0.877	76%	0.759	S	S	*	*			cis	-125.2	167.6	33.3	-73.6	169.2	0	0	0	113.4
683	L	33.7	Very low	34.4	Very low	155 Å²	155	127.8 Å²	127.8	81%	0.812	76%	0.756	S	S	*	*			trans	-103.4	-145.5	-162	-157.1	76.7	0	0	0	112.6
684	P	38.6	Very low	34.7	Very low	114 Å²	114	128.4 Å²	128.4	74%	0.74	76%	0.761	S	S	*	*				-117.6	-172.7	-123.2	43.7	-27.6	0	0	0	115.9
685	G	35.7	Very low	34.7	Very low	66 Å²	66	128 Å²	128	68%	0.68	76%	0.763	S	S	*	*			trans	150.6	101.8	163.3	0	0	0	0	0	110.9
686	T	32.2	Very low	34.8	Very low	132 Å²	132	125.7 Å²	125.7	81%	0.81	75%	0.753	S	S	*	*				66.6	101.5	61.1	-50.3	0	0	0	0	113.5
687	I	36.8	Very low	35	Very low	168 Å²	168	124.4 Å²	124.4	86%	0.862	74%	0.744	S	S	*	*			trans	-147.2	125.4	140.1	-91.3	137.6	0	0	0	107
688	L	35.3	Very low	35	Very low	154 Å²	154	124.2 Å²	124.2	81%	0.806	74%	0.741	S	S	*	*			trans	-113.6	140.9	164.7	-165.8	84.7	0	0	0	105.7
689	P	36.1	Very low	35.2	Very low	103 Å²	103	123.1 Å²	123.1	67%	0.669	74%	0.741	S	S	*	*				-150.2	162.3	112.8	37.8	-21.4	0	0	0	111.6
690	T	34.8	Very low	35.4	Very low	101 Å²	101	123.9 Å²	123.9	62%	0.62	73%	0.734	S	S	*	*			cis	170.3	145	-10.4	37.6	0	0	0	0	106.8
691	H	34.8	Very low	35	Very low	158 Å²	158	125.7 Å²	125.7	73%	0.731	74%	0.739	S	S	*	*			trans	79.1	152.2	144.2	-78.7	-128.5	0	0	0	123.1
692	F	32.7	Very low	34.8	Very low	183 Å²	183	123.2 Å²	123.2	80%	0.803	73%	0.733	S	S	*	*			trans	63.4	106.2	177.5	-62.3	-76.4	0	0	0	115.4
693	S	31.6	Very low	34.7	Very low	109 Å²	109	119.3 Å²	119.3	76%	0.762	72%	0.721	S	S	*	*			cis	79.3	104	24.3	-37	0	0	0	0	116.2
694	A	33	Very low	34.7	Very low	96 Å²	96	118.7 Å²	118.7	79%	0.793	72%	0.718	S	S	*	*				159.3	140.5	110.2	0	0	0	0	0	114.2
695	A	33.1	Very low	34.5	Very low	97 Å²	97	120.1 Å²	120.1	80%	0.802	72%	0.716	S	S	*	*			trans	62.4	155.4	154.3	0	0	0	0	0	119
696	S	33.5	Very low	34.3	Very low	78 Å²	78	122 Å²	122	55%	0.545	72%	0.715	S	S	.	*			cis	-161.9	143	-11.6	38.6	0	0	0	0	112.3
697	S	36.5	Very low	34.3	Very low	71 Å²	71	121 Å²	121	50%	0.497	71%	0.709	S	S	.	*			trans	-4	157.1	138.3	47.8	0	0	0	0	120.3
698	I	35	Very low	34.2	Very low	146 Å²	146	120 Å²	120	75%	0.749	70%	0.704	S	S	*	*			cis	-160.7	167.5	18.4	-124.8	155.9	0	0	0	111.2
699	P	39.7	Very low	33.9	Very low	109 Å²	109	117.1 Å²	117.1	71%	0.708	70%	0.697	S	S	*	*			trans	-102.1	-143.2	-179.9	41.6	-32.5	0	0	0	113.1
700	I	36.2	Very low	33.8	Very low	153 Å²	153	115.7 Å²	115.7	79%	0.785	69%	0.689	S	S	*	*			trans	97.7	138.1	175	-60.2	166.3	0	0	0	113.9
701	D	32.6	Very low	34.2	Very low	128 Å²	128	112.9 Å²	112.9	68%	0.684	67%	0.673	S	S	*	*			cis	-175.3	160.7	-19.9	-169.1	-33	0	0	0	107.4
702	S	33.4	Very low	34.1	Very low	95 Å²	95	111.4 Å²	111.4	66%	0.664	66%	0.664	S	S	*	*			trans	71.3	152.9	150.8	-87.1	0	0	0	0	120.3
703	S	34.3	Very low	34.2	Very low	89 Å²	89	108.3 Å²	108.3	62%	0.622	66%	0.655	S	S	*	*			cis	-162.6	152.3	-1.5	-121.3	0	0	0	0	114
704	L	32.9	Very low	34.2	Very low	142 Å²	142	107.5 Å²	107.5	74%	0.743	65%	0.65	S	S	*	*			trans	75.5	146.7	138.7	-74.5	169	0	0	0	123.8
705	M	34.2	Very low	34.2	Very low	144 Å²	144	112.4 Å²	112.4	71%	0.709	65%	0.654	S	S	*	*			trans	73.8	101.3	156.5	-66.1	-71.7	136.6	0	0	117.6
706	T	32.4	Very low	34.5	Very low	105 Å²	105	112.7 Å²	112.7	64%	0.644	65%	0.647	S	S	*	*				68.9	138.4	84	63.5	0	0	0	0	114.7
707	T	31.6	Very low	34.4	Very low	113 Å²	113	116.4 Å²	116.4	69%	0.693	66%	0.66	S	S	*	*			cis	-170.3	167.1	0.8	14.7	0	0	0	0	110.8
708	I	33.6	Very low	34.2	Very low	147 Å²	147	116.8 Å²	116.8	75%	0.754	66%	0.663	S	S	*	*			trans	71.5	102	153	-64.7	152.4	0	0	0	118.6
709	S	29.7	Very low	34.2	Very low	93 Å²	93	118.4 Å²	118.4	65%	0.65	67%	0.667	S	S	*	*				40.8	117.9	122.5	-42.4	0	0	0	0	123.4
710	S	34.1	Very low	33.9	Very low	72 Å²	72	117.8 Å²	117.8	50%	0.503	67%	0.666	S	S	.	*				54	-178.2	106.9	-50	0	0	0	0	121.8
711	P	44.1	Very low	33.5	Very low	43 Å²	43	119.2 Å²	119.2	28%	0.279	67%	0.674	S	S	.	*			cis	-128.6	-168.7	-49.9	30.8	-11.2	0	0	0	113.5	N1094 M1095 I1096	P711-N1094 VanDerWaalsContact CD-OD1 3.24Å; P711-N1094 WeakPolarHBondContact CD-OD1 3.5Å; P711-N1094 PolarHBondContact O-OD1 3.21Å; P711-M1095 CarbonylContact O-C 3.33Å; P711-M1095 WeakPolarHBondContact O-CA 3.33Å; P711-M1095 WeakPolarHBondContact O-CB 3.12Å; P711-M1095 PolarHBondContact O-N 3.39Å; P711-I1096 HydrophobicContact CB-CB 4.07Å; P711-I1096 HydrophobicContact CB-CD1 3.71Å; P711-I1096 HydrophobicContact CB-CG1 4.05Å
712	F	32.8	Very low	33.7	Very low	127 Å²	127	118 Å²	118	56%	0.557	68%	0.675	S	S	*	*			trans	116.8	50.6	169.7	-64.1	-73.5	0	0	0	125.7	N1094 M1095 I1096	F712-N1094 HydrophobicContact CB-CB 4.09Å; F712-N1094 HydrophobicContact CD2-CB 3.66Å; F712-N1094 HydrophobicContact CG-CB 4.25Å; F712-M1095 VanDerWaalsContact C-C 3.41Å; F712-M1095 CarbonylContact C-O 2.67Å; F712-M1095 VanDerWaalsContact CA-O 3.32Å; F712-M1095 WeakPolarHBondContact CA-O 3.09Å; F712-M1095 PolarHBondContact N-O 2.75Å; F712-I1096 VanDerWaalsContact N-CB 3.27Å
713	L	33.6	Very low	33.7	Very low	118 Å²	118	121.2 Å²	121.2	62%	0.618	68%	0.684	S	S	*	*			trans	70.1	160.4	136.7	-59.8	169.9	0	0	0	122.8	M1095 I1096	L713-M1095 PolarHBondContact N-O 3.07Å; L713-I1096 HydrophobicContact CD2-CG2 4.28Å; L713-I1096 HydrophobicContact CG-CG2 4.43Å
714	S	32.9	Very low	34.1	Very low	92 Å²	92	122.3 Å²	122.3	64%	0.643	69%	0.689	S	S	*	*			trans	88.2	107.2	134.8	48.4	0	0	0	0	122.6
715	F	32.5	Very low	34.3	Very low	199 Å²	199	120.6 Å²	120.6	87%	0.873	69%	0.687	S	S	*	*				72.4	166.8	125.1	-78.4	-49.4	0	0	0	120.2
716	P	39.4	Very low	34.2	Very low	102 Å²	102	120.3 Å²	120.3	66%	0.662	69%	0.687	S	S	*	*			cis	-138.5	-173	-26.9	38.1	-20.1	0	0	0	114.3
717	L	31.2	Very low	34	Very low	156 Å²	156	124.1 Å²	124.1	82%	0.817	70%	0.695	S	S	*	*			trans	55.9	119.6	141.3	-141.1	76	0	0	0	120
718	S	32.6	Very low	34	Very low	80 Å²	80	122.9 Å²	122.9	56%	0.559	69%	0.691	S	S	*	*				153.5	139.3	107.1	-72.1	0	0	0	0	113.9
719	Q	34.5	Very low	33.7	Very low	179 Å²	179	122.8 Å²	122.8	84%	0.836	69%	0.692	S	S	*	*			trans	63.9	153.2	153.4	-62.5	159.9	65.1	0	0	116.6
720	S	32.7	Very low	34	Very low	97 Å²	97	124.1 Å²	124.1	68%	0.678	70%	0.697	S	S	*	*			cis	-161.4	148.2	-24.7	49.9	0	0	0	0	108
721	L	29.3	Very low	34.1	Very low	182 Å²	182	125.3 Å²	125.3	95%	0.953	71%	0.705	S	S	*	*			trans	-137.1	94.8	169.3	-86.1	178.3	0	0	0	111.1
722	S	35.1	Very low	33.6	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	73%	0.728	S	S	*	*			trans	-99.2	90	174.2	57	0	0	0	0	111.5
723	L	34	Very low	33.7	Very low	164 Å²	164	131.3 Å²	131.3	86%	0.859	74%	0.739	S	S	*	*			trans	65.6	150.9	160.7	-73.9	81	0	0	0	119
724	P	42.7	Very low	33.8	Very low	111 Å²	111	129.7 Å²	129.7	72%	0.721	74%	0.738	S	S	*	*			trans	-87.1	174.5	172.7	43.7	-40.4	0	0	0	109.9
725	P	37.7	Very low	34	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	74%	0.742	S	S	*	*				-154.8	-170.6	76.9	31.6	-5.1	0	0	0	116.3
726	L	31.5	Very low	33.9	Very low	138 Å²	138	129 Å²	129	72%	0.723	73%	0.731	S	S	*	*			trans	86.1	113	152.9	-52.2	-172.3	0	0	0	122
727	F	28.9	Very low	33.6	Very low	184 Å²	184	131.5 Å²	131.5	81%	0.807	73%	0.732	S	S	*	*				71.6	122	128.4	-75.9	-55.3	0	0	0	123.9
728	S	31	Very low	33.7	Very low	87 Å²	87	129.4 Å²	129.4	61%	0.608	73%	0.726	S	S	*	*			trans	89.4	108	131.4	-64.1	0	0	0	0	120.7
729	N	27.5	Very low	33.6	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	73%	0.734	S	S	*	*				45.6	133.6	123.4	-51.7	-7.8	0	0	0	118.7
730	T	35.2	Very low	33.5	Very low	122 Å²	122	127.2 Å²	127.2	75%	0.748	73%	0.73	S	S	*	*				-174.8	145.4	71.3	27.2	0	0	0	0	112.6
731	S	37.6	Very low	33.5	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	74%	0.735	S	S	*	*			trans	57	158.3	146.7	60.9	0	0	0	0	120.5
732	N	32.7	Very low	33.5	Very low	144 Å²	144	128.8 Å²	128.8	77%	0.77	73%	0.726	S	S	*	*			cis	-169.6	155.3	-22.4	-91.2	-24.9	0	0	0	103.4
733	L	34.8	Very low	33.4	Very low	151 Å²	151	130.4 Å²	130.4	79%	0.791	73%	0.731	S	S	*	*				-167.7	150.3	52.5	-101.1	105.9	0	0	0	109.9
734	S	36.8	Very low	33.3	Very low	85 Å²	85	130.6 Å²	130.6	59%	0.594	73%	0.73	S	S	*	*			trans	10.5	157.4	136.5	70.8	0	0	0	0	122.3
735	H	35.8	Very low	32.9	Very low	156 Å²	156	130.2 Å²	130.2	72%	0.722	73%	0.727	S	S	*	*			cis	-146	155.3	7.6	-101.8	-72.1	0	0	0	106.7
736	D	31.7	Very low	32.8	Very low	119 Å²	119	132.6 Å²	132.6	64%	0.636	73%	0.733	S	S	*	*			cis	108	159.5	32.1	-159.1	3.4	0	0	0	112.4
737	F	33.2	Very low	32.9	Very low	155 Å²	155	135.3 Å²	135.3	68%	0.68	74%	0.739	S	S	*	*			trans	78.4	92.7	171.4	-68.8	-76.9	0	0	0	123.4
738	T	32.2	Very low	33.5	Very low	113 Å²	113	131 Å²	131	69%	0.693	73%	0.73	S	S	*	*				58.4	122.8	120.4	58.9	0	0	0	0	124.7
739	S	30.9	Very low	33.9	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	74%	0.736	S	S	*	*				73.8	115.3	124.1	-58.1	0	0	0	0	123.7
740	S	32.5	Very low	34.4	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	74%	0.737	S	S	*	*				81	127	127.1	-61	0	0	0	0	122.7
741	Q	32.1	Very low	34.5	Very low	170 Å²	170	134 Å²	134	79%	0.794	74%	0.739	S	S	*	*			trans	85.1	114.1	147.2	-74	-171.6	97	0	0	122.2
742	L	29.4	Very low	34.5	Very low	143 Å²	143	136.3 Å²	136.3	75%	0.749	74%	0.743	S	S	*	*			trans	79.4	138.2	134	-61.6	170.5	0	0	0	122
743	T	32.6	Very low	34.7	Very low	136 Å²	136	135.8 Å²	135.8	83%	0.834	75%	0.745	S	S	*	*			trans	88.9	134.8	154.5	-10.2	0	0	0	0	119.6
744	M	33.2	Very low	34.9	Very low	168 Å²	168	134.1 Å²	134.1	83%	0.828	74%	0.743	S	S	*	*			trans	-111.7	-175	170.1	-65.1	-103.7	80	0	0	108.1
745	P	34.3	Very low	34.8	Very low	102 Å²	102	137.4 Å²	137.4	66%	0.662	75%	0.754	S	S	*	*			cis	-144.2	-169.6	9	31	-3.7	0	0	0	117.3
746	L	35.3	Very low	34.9	Very low	157 Å²	157	134.6 Å²	134.6	82%	0.822	75%	0.752	S	S	*	*			trans	89.1	107.2	155.1	-50.9	-179.6	0	0	0	122.7
747	K	33.9	Very low	35.4	Very low	195 Å²	195	137.3 Å²	137.3	85%	0.848	76%	0.758	S	S	*	*				23.7	163.9	122.3	-92.6	-161.2	167	-170.3	0	122.7
748	P	41.6	Very low	35.9	Very low	94 Å²	94	137.8 Å²	137.8	61%	0.61	77%	0.765	S	S	*	*			cis	-140.2	-171.2	-33.5	32.2	-8.3	0	0	0	115
749	D	38	Very low	36.4	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	76%	0.755	S	S	*	*			trans	138.6	130.4	133.5	-72.3	-21	0	0	0	120.1
750	N	37.7	Very low	36.6	Very low	152 Å²	152	137 Å²	137	81%	0.813	75%	0.754	S	S	*	*			trans	58.1	151.5	145.9	-72	-10.4	0	0	0	123
751	V	38.9	Very low	37	Very low	128 Å²	128	141.2 Å²	141.2	78%	0.776	76%	0.764	S	S	*	*			cis	-157.7	170	-8.8	113	0	0	0	0	112.7
752	L	36.1	Very low	37.1	Very low	147 Å²	147	138.1 Å²	138.1	77%	0.77	75%	0.753	S	S	*	*			trans	-71.9	165.2	-173.7	-64	146.6	0	0	0	116.7
753	T	38.2	Very low	37.5	Very low	132 Å²	132	136.5 Å²	136.5	81%	0.81	75%	0.752	S	S	*	*				167.7	173.7	93.8	38.1	0	0	0	0	109.9
754	P	38.6	Very low	37.5	Very low	116 Å²	116	136.7 Å²	136.7	75%	0.753	75%	0.748	S	S	*	*			cis	-134.3	157.5	6.6	40.8	-23.6	0	0	0	118.3
755	D	34.1	Very low	37.8	Very low	155 Å²	155	134.2 Å²	134.2	83%	0.829	74%	0.743	S	S	*	*			trans	-83.8	170	153.9	-65.6	-79.3	0	0	0	112
756	S	38.9	Very low	38.3	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	75%	0.752	S	S	*	*				165.2	162.3	120.4	49.8	0	0	0	0	114.3
757	F	41.7	Very low	38.5	Very low	175 Å²	175	135.1 Å²	135.1	77%	0.768	74%	0.741	S	S	*	*	S	Bend	trans	67.1	117.5	175	-68.7	-87.9	0	0	0	115.8
758	M	43.7	Very low	38.9	Very low	166 Å²	166	133 Å²	133	82%	0.818	73%	0.732	S	S	*	*			cis	-142	129	4.7	-74.2	179.9	76.3	0	0	107.7
759	S	41.8	Very low	38.7	Very low	68 Å²	68	137.5 Å²	137.5	48%	0.476	75%	0.745	S	S	.	*			cis	67.8	125.9	27.9	111.7	0	0	0	0	112.5
760	D	37.1	Very low	38.8	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	75%	0.75	S	S	*	*			cis	-142.2	123.8	7.4	-68.4	-78.8	0	0	0	111.4
761	M	40.4	Very low	38.7	Very low	196 Å²	196	142 Å²	142	97%	0.966	76%	0.756	S	S	*	*			trans	-107.6	79.3	157.7	-98.3	-73.2	162.7	0	0	107.1	C763	M761-C763 PolarHBondContact O-N 2.94Å
762	N	33.8	Very low	38.8	Very low	104 Å²	104	144 Å²	144	56%	0.556	76%	0.755	S	S	*	*			trans	-63.5	123.2	-167.1	-173.1	37.8	0	0	0	112.1	D764	N762-D764 PolarHBondContact O-N 2.94Å
763	C	37.9	Very low	39.5	Very low	110 Å²	110	144.3 Å²	144.3	74%	0.743	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	37.8	-178	-156.6	0	0	0	0	112.7	M761	M761-C763 PolarHBondContact O-N 2.94Å
764	D	33.1	Very low	40.7	Very low	140 Å²	140	141.3 Å²	141.3	75%	0.749	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.7	14.5	-174	-109.1	-34.1	0	0	0	113.6	N762	N762-D764 PolarHBondContact O-N 2.94Å
765	T	38.6	Very low	42.3	Very low	116 Å²	116	140.2 Å²	140.2	71%	0.712	74%	0.74	S	S	*	*			trans	-109.2	43.5	171.6	-38.9	0	0	0	0	111.9	D767	T765-D767 VanDerWaalsContact C-N 3.31Å; T765-D767 PolarHBondContact O-N 2.85Å
766	I	44.9	Very low	44.7	Very low	169 Å²	169	137.1 Å²	137.1	87%	0.867	72%	0.722	S	S	*	*			trans	-91.5	70.7	162.5	-51.4	179.6	0	0	0	107.7
767	D	40.3	Very low	47	Very low	109 Å²	109	132.5 Å²	132.5	58%	0.583	69%	0.69	S	S	*	*			trans	-129.8	108.4	174.7	-160.9	35.1	0	0	0	112.7	T765	T765-D767 VanDerWaalsContact C-N 3.31Å; T765-D767 PolarHBondContact O-N 2.85Å
768	K	41.1	Very low	49	Very low	151 Å²	151	129.3 Å²	129.3	66%	0.657	67%	0.674	S	S	*	*	S	Bend	trans	68.1	118.9	165	-63.9	161.5	-174.5	76.1	0	118.3
769	Q	38.5	Very low	50.8	Low	188 Å²	188	124.3 Å²	124.3	88%	0.879	65%	0.654	S	S	*	*	S	Bend	trans	76.3	122.4	153.4	-59	162.8	-8.8	0	0	116.5
770	E	39.6	Very low	52.9	Low	180 Å²	180	124.5 Å²	124.5	84%	0.841	65%	0.654	S	S	*	*			cis	-97.1	137.1	1.9	-66.4	-168.1	144.1	0	0	113.8
771	E	36	Very low	54.9	Low	201 Å²	201	120.1 Å²	120.1	94%	0.939	64%	0.641	S	S	*	*			trans	-80.6	113.8	178.9	-178.4	175.9	-152	0	0	110.7
772	K	41.3	Very low	56.8	Low	171 Å²	171	111.6 Å²	111.6	74%	0.743	60%	0.604	S	S	*	*			trans	-147.6	86	-174.7	-158.1	169.6	-163.4	161.6	0	113
773	D	50.6	Low	59	Low	153 Å²	153	110.9 Å²	110.9	82%	0.818	60%	0.604	S	S	*	*			trans	33	92.7	170.3	-69.3	-35.3	0	0	0	115.6	L775	D773-L775 PolarHBondContact O-N 3.03Å
774	G	62.3	Low	61	Low	69 Å²	69	108.7 Å²	108.7	71%	0.711	59%	0.589	S	S	*	*			trans	-41.5	119.3	-176.6	0	0	0	0	0	113.4	I776	G774-I776 PolarHBondContact O-N 3.38Å; G774-I776 VanDerWaalsContact O-N 3.13Å
775	L	73.6	Confident	63.1	Low	94 Å²	94	105.2 Å²	105.2	49%	0.492	57%	0.573	S	S	.	*			trans	-60.7	116.8	-167.7	-76.9	68	0	0	0	110.6	D773 P784 F790 N799	D773-L775 PolarHBondContact O-N 3.03Å; L775-P784 WeakPolarHBondContact O-CD 3.24Å; L775-F790 HydrophobicContact CB-CD2 4.44Å; L775-F790 HydrophobicContact CB-CE2 3.81Å; L775-F790 VanDerWaalsContact O-CE2 3.25Å; L775-F790 WeakPolarHBondContact O-CE2 3.3Å; L775-F790 WeakPolarHBondContact O-CZ 3.41Å; L775-N799 WeakPolarHBondContact CB-ND2 3.28Å
776	I	84	Confident	64.3	Low	90 Å²	90	105.9 Å²	105.9	46%	0.462	58%	0.581	S	S	.	*			trans	-108.3	147.1	174.6	55.9	169.5	0	0	0	111.8	G774 Y778 G781 G782	G774-I776 PolarHBondContact O-N 3.38Å; G774-I776 VanDerWaalsContact O-N 3.13Å; I776-Y778 PolarHBondContact O-N 2.96Å; I776-G781 WeakPolarHBondContact CG2-O 3.4Å; I776-G782 CarbonylContact C-O 3.17Å; I776-G782 WeakPolarHBondContact CA-O 3.22Å
777	C	87	Confident	65.5	Low	0 Å²	0	103.5 Å²	103.5	0%	0	57%	0.566	C	S	.	*			trans	-62.7	126.2	170	167.3	0	0	0	0	110.8	C779 G781 G782 F790 N799 H801	C777-C779 PolarHBondContact O-N 3.49Å; C777-C779 PolarHBondContact SG-N 2.9Å; C777-G781 VanDerWaalsContact O-CA 3.27Å; C777-G781 WeakPolarHBondContact O-CA 3.18Å; C777-G781 PolarHBondContact O-N 3.19Å; C777-G782 PolarHBondContact N-O 2.91Å; C777-F790 HydrophobicContact CB-CE1 3.79Å; C777-F790 HydrophobicContact CB-CZ 4.38Å; C777-N799 WeakPolarHBondContact CA-O 3.42Å; C777-H801 VanDerWaalsContact CB-ND1 3.25Å; C777-H801 WeakPolarHBondContact CB-ND1 3.13Å; C777-H801 PolarHBondContact SG-N 3.46Å
778	Y	84.3	Confident	67.4	Low	108 Å²	108	99.7 Å²	99.7	42%	0.424	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33	176	169.5	-142.6	0	0	0	113.6	R332 I776 L798 N799	R332-Y778 VanDerWaalsContact NH2-CD2 3.34Å; I776-Y778 PolarHBondContact O-N 2.96Å; Y778-L798 HydrophobicContact CD1-CD1 3.98Å; Y778-L798 HydrophobicContact CD1-CD2 3.8Å; Y778-L798 HydrophobicContact CD1-CG 4.43Å; Y778-L798 HydrophobicContact CD2-CD2 4.41Å; Y778-L798 HydrophobicContact CE1-CD1 4.09Å; Y778-L798 HydrophobicContact CE1-CD2 4.4Å; Y778-L798 HydrophobicContact CG-CD2 3.8Å; Y778-N799 PolarHBondContact N-O 2.84Å
779	C	81.6	Confident	69.5	Low	60 Å²	60	94.8 Å²	94.8	41%	0.405	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-26.4	-171.7	-57.8	0	0	0	0	114.3	C777 C804	C777-C779 PolarHBondContact O-N 3.49Å; C777-C779 PolarHBondContact SG-N 2.9Å; C779-C804 HydrophobicContact CB-CB 3.7Å
780	C	84.7	Confident	72.1	Confident	72 Å²	72	86.8 Å²	86.8	49%	0.486	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-16.1	-178	70.2	0	0	0	0	115.3	G782 H801	C780-G782 VanDerWaalsContact C-N 3.34Å; C780-G782 PolarHBondContact SG-N 3.4Å; C780-G782 VanDerWaalsContact SG-N 3.42Å; C780-H801 PolarHBondContact SG-ND1 3.17Å
781	G	79.4	Confident	74.6	Confident	41 Å²	41	78.3 Å²	78.3	42%	0.423	46%	0.455	S	S	.	.			trans	81.6	1.8	-176.3	0	0	0	0	0	115.7	I776 C777	I776-G781 WeakPolarHBondContact CG2-O 3.4Å; C777-G781 VanDerWaalsContact O-CA 3.27Å; C777-G781 WeakPolarHBondContact O-CA 3.18Å; C777-G781 PolarHBondContact O-N 3.19Å
782	G	80.2	Confident	77.3	Confident	18 Å²	18	72.3 Å²	72.3	19%	0.186	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-80.2	156	-179.6	0	0	0	0	0	114.5	I776 C777 C780	I776-G782 CarbonylContact C-O 3.17Å; I776-G782 WeakPolarHBondContact CA-O 3.22Å; C777-G782 PolarHBondContact N-O 2.91Å; C780-G782 VanDerWaalsContact C-N 3.34Å; C780-G782 PolarHBondContact SG-N 3.4Å; C780-G782 VanDerWaalsContact SG-N 3.42Å
783	P	80.9	Confident	79.8	Confident	88 Å²	88	64.1 Å²	64.1	57%	0.571	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-71.3	166.3	172.2	34.6	-37.5	0	0	0	111.3	H801	P783-H801 PolarHBondContact O-CE1 3.11Å; P783-H801 PolarHBondContact O-NE2 3.24Å
784	P	79.5	Confident	81.7	Confident	65 Å²	65	63.9 Å²	63.9	42%	0.422	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-70	145.2	172.1	30.4	-31.7	0	0	0	110.1	L775 F790	L775-P784 WeakPolarHBondContact O-CD 3.24Å; P784-F790 HydrophobicContact CB-CD1 4.25Å; P784-F790 HydrophobicContact CB-CD2 3.89Å; P784-F790 HydrophobicContact CB-CE1 4.03Å; P784-F790 HydrophobicContact CB-CE2 3.66Å; P784-F790 HydrophobicContact CB-CG 4.19Å; P784-F790 HydrophobicContact CB-CZ 3.75Å; P784-F790 VanDerWaalsContact CD-CZ 3.42Å; P784-F790 HydrophobicContact CG-CD2 4.28Å; P784-F790 HydrophobicContact CG-CE2 3.74Å; P784-F790 HydrophobicContact CG-CZ 4.05Å
785	T	77.1	Confident	83	Confident	67 Å²	67	64.4 Å²	64.4	41%	0.411	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-100.7	161.1	166.1	62.9	0	0	0	0	110.1	E787 E788 A789	T785-E787 PolarHBondContact O-N 2.9Å; T785-E788 CarbonylContact O-C 3.6Å; T785-E788 PolarHBondContact O-N 3.05Å; T785-E788 WeakPolarHBondContact OG1-CA 3.49Å; T785-E788 WeakPolarHBondContact OG1-CB 3.42Å; T785-E788 PolarHBondContact OG1-N 2.9Å; T785-A789 PolarHBondContact O-N 3.37Å
786	C	63.5	Low	83.7	Confident	130 Å²	130	62.7 Å²	62.7	88%	0.878	37%	0.369	S	S	*	.	S	Bend	trans	-62.7	-33.4	176.1	-59.7	0	0	0	0	112
787	E	70.6	Confident	83.9	Confident	119 Å²	119	60.5 Å²	60.5	56%	0.556	37%	0.369	S	S	*	.	S	Bend	trans	-74.9	-42.3	176.4	-63.1	154.6	-162.7	0	0	112	T785 G1182 S1183	T785-E787 PolarHBondContact O-N 2.9Å; E787-G1182 VanDerWaalsContact OE2-C 3.27Å; E787-G1182 WeakPolarHBondContact OE2-CA 3.37Å; E787-S1183 PolarHBondContact OE2-N 3.46Å
788	E	80.1	Confident	83.9	Confident	29 Å²	29	61.1 Å²	61.1	14%	0.136	37%	0.372	C	S	.	.	S	Bend	trans	-113.8	58	-174.2	-149.8	-163	158.1	0	0	112.8	T785 F790 H801 P802 T803	T785-E788 CarbonylContact O-C 3.6Å; T785-E788 PolarHBondContact O-N 3.05Å; T785-E788 WeakPolarHBondContact OG1-CA 3.49Å; T785-E788 WeakPolarHBondContact OG1-CB 3.42Å; T785-E788 PolarHBondContact OG1-N 2.9Å; E788-F790 PolarHBondContact O-N 3.48Å; E788-H801 WeakPolarHBondContact OE1-CA 3.38Å; E788-H801 WeakPolarHBondContact OE1-CB 3.5Å; E788-H801 IonicContact OE1-CG 3.73Å; E788-H801 IonicContact OE2-CD2 3.5Å; E788-H801 IonicContact OE2-CG 2.7Å; E788-P802 HydrophobicContact CG-CG 3.9Å; E788-P802 WeakPolarHBondContact OE1-CD 3.39Å; E788-P802 VanDerWaalsContact OE1-CG 3.23Å; E788-P802 WeakPolarHBondContact OE1-CG 3.34Å; E788-T803 VanDerWaalsContact CD-CG2 3.45Å; E788-T803 VanDerWaalsContact CD-OG1 3.23Å; E788-T803 HydrophobicContact CG-CG2 4.45Å; E788-T803 WeakPolarHBondContact OE1-CB 3.42Å; E788-T803 WeakPolarHBondContact OE1-CG2 3.44Å; E788-T803 PolarHBondContact OE1-N 3.43Å; E788-T803 PolarHBondContact OE1-OG1 2.77Å; E788-T803 WeakPolarHBondContact OE2-CG2 3.15Å; E788-T803 PolarHBondContact OE2-OG1 3.25Å
789	A	85.8	Confident	84.2	Confident	47 Å²	47	56.8 Å²	56.8	39%	0.388	36%	0.357	S	S	.	.			trans	-51.5	130.6	172.6	0	0	0	0	0	111.3	T785 R816	T785-A789 PolarHBondContact O-N 3.37Å; A789-R816 PolarHBondContact O-NH1 2.66Å; A789-R816 VanDerWaalsContact O-NH1 3.15Å; A789-R816 PolarHBondContact O-NH2 3.2Å
790	F	92.4	Very high	84.6	Confident	20 Å²	20	54.1 Å²	54.1	9%	0.088	34%	0.339	C	S	.	.			trans	-54.2	147.3	-172.2	-65.5	-42.5	0	0	0	114.3	L775 C777 P784 E788 V792 N799 A800 H801 R816	L775-F790 HydrophobicContact CB-CD2 4.44Å; L775-F790 HydrophobicContact CB-CE2 3.81Å; L775-F790 VanDerWaalsContact O-CE2 3.25Å; L775-F790 WeakPolarHBondContact O-CE2 3.3Å; L775-F790 WeakPolarHBondContact O-CZ 3.41Å; C777-F790 HydrophobicContact CB-CE1 3.79Å; C777-F790 HydrophobicContact CB-CZ 4.38Å; P784-F790 HydrophobicContact CB-CD1 4.25Å; P784-F790 HydrophobicContact CB-CD2 3.89Å; P784-F790 HydrophobicContact CB-CE1 4.03Å; P784-F790 HydrophobicContact CB-CE2 3.66Å; P784-F790 HydrophobicContact CB-CG 4.19Å; P784-F790 HydrophobicContact CB-CZ 3.75Å; P784-F790 VanDerWaalsContact CD-CZ 3.42Å; P784-F790 HydrophobicContact CG-CD2 4.28Å; P784-F790 HydrophobicContact CG-CE2 3.74Å; P784-F790 HydrophobicContact CG-CZ 4.05Å; E788-F790 PolarHBondContact O-N 3.48Å; F790-V792 HydrophobicContact CB-CG2 3.86Å; F790-N799 HydrophobicContact CB-CB 4.29Å; F790-N799 HydrophobicContact CD1-CB 4.38Å; F790-N799 HydrophobicContact CD2-CB 3.61Å; F790-N799 HydrophobicContact CE2-CB 3.87Å; F790-N799 HydrophobicContact CG-CB 3.87Å; F790-N799 HydrophobicContact CZ-CB 4.35Å; F790-A800 WeakPolarHBondContact CA-O 3.35Å; F790-H801 AromaticContact CE1-CD2 3.9Å; F790-H801 AromaticContact CE1-CE1 3.76Å; F790-H801 AromaticContact CE1-NE2 3.6Å; F790-R816 PolarHBondContact O-NH1 3.09Å; F790-R816 VanDerWaalsContact O-NH1 3.15Å
791	L	91.3	Very high	84.9	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	111.9	148.9	-70.7	177.7	0	0	0	107.2	A800 P802 L805 Y807 T812 A815 R816 W820	L791-A800 PolarHBondContact N-O 3.01Å; L791-A800 PolarHBondContact O-N 3.12Å; L791-P802 HydrophobicContact CD1-CB 3.89Å; L791-P802 HydrophobicContact CD1-CG 4.42Å; L791-P802 HydrophobicContact CG-CB 4.3Å; L791-P802 HydrophobicContact CG-CG 4.29Å; L791-L805 HydrophobicContact CD1-CD1 4.06Å; L791-Y807 HydrophobicContact CD1-CD2 3.58Å; L791-Y807 HydrophobicContact CD1-CE2 3.66Å; L791-T812 HydrophobicContact CD2-CG2 4.42Å; L791-T812 HydrophobicContact CG-CG2 4.5Å; L791-A815 HydrophobicContact CD1-CB 4.38Å; L791-A815 HydrophobicContact CD2-CB 4.35Å; L791-R816 HydrophobicContact CD2-CG 3.84Å; L791-W820 HydrophobicContact CB-CD2 3.78Å; L791-W820 HydrophobicContact CB-CE3 3.64Å; L791-W820 HydrophobicContact CB-CG 4.33Å; L791-W820 HydrophobicContact CB-CH2 4.3Å; L791-W820 HydrophobicContact CB-CZ2 4.44Å; L791-W820 HydrophobicContact CB-CZ3 3.9Å; L791-W820 HydrophobicContact CD1-CD2 4.41Å; L791-W820 HydrophobicContact CD2-CB 4.42Å; L791-W820 HydrophobicContact CD2-CG 4.23Å; L791-W820 HydrophobicContact CG-CD2 4.48Å; L791-W820 WeakPolarHBondContact O-CZ3 3.25Å
792	V	93.1	Very high	85.5	Confident	74 Å²	74	49.5 Å²	49.5	45%	0.448	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.4	179.9	-176.9	0	0	0	0	108.4	F790 K794 N799	F790-V792 HydrophobicContact CB-CG2 3.86Å; V792-K794 PolarHBondContact O-N 2.76Å; V792-K794 VanDerWaalsContact O-N 3.15Å; V792-N799 WeakPolarHBondContact CG2-OD1 3.42Å
793	C	93.5	Very high	86	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.309	C	S	.	.			trans	-69.1	114.3	-177.6	179.8	0	0	0	0	110.5	D795 C796 G797 L798 W820 C822	C793-D795 PolarHBondContact O-N 3.17Å; C793-C796 PolarHBondContact O-N 3.35Å; C793-C796 PolarHBondContact SG-SG 3.34Å; C793-G797 PolarHBondContact O-N 2.89Å; C793-L798 HydrophobicContact CB-CB 3.99Å; C793-L798 PolarHBondContact N-O 3.45Å; C793-W820 WeakPolarHBondContact CA-O 3.45Å; C793-W820 HydrophobicContact CB-CE3 3.94Å; C793-W820 HydrophobicContact CB-CZ3 3.69Å; C793-C822 HydrophobicContact CB-CB 3.95Å; C793-C822 PolarHBondContact SG-N 3.22Å
794	K	91.2	Very high	86.3	Confident	148 Å²	148	49.4 Å²	49.4	64%	0.643	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	-45.5	-179.3	174.6	-177.2	165.4	-172.9	0	113.2	V792 P819 W820	V792-K794 PolarHBondContact O-N 2.76Å; V792-K794 VanDerWaalsContact O-N 3.15Å; K794-P819 HydrophobicContact CB-CB 4.46Å; K794-P819 HydrophobicContact CD-CB 3.71Å; K794-W820 PolarHBondContact N-O 3.08Å
795	D	88.8	Confident	86.7	Confident	80 Å²	80	48.6 Å²	48.6	43%	0.428	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-8.9	-167.3	-41.4	-69.1	0	0	0	114.6	C793 Q821 C825	C793-D795 PolarHBondContact O-N 3.17Å; D795-Q821 WeakPolarHBondContact OD2-CG 3.36Å; D795-Q821 PolarHBondContact OD2-NE2 3.32Å; D795-C825 HydrophobicContact CB-CB 4.15Å
796	C	88.8	Confident	87.2	Confident	57 Å²	57	48.3 Å²	48.3	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	2.7	-177	67.9	0	0	0	0	116.3	C793 L798 C825	C793-C796 PolarHBondContact O-N 3.35Å; C793-C796 PolarHBondContact SG-SG 3.34Å; C796-L798 PolarHBondContact O-N 2.93Å; C796-L798 VanDerWaalsContact O-N 3.13Å; C796-L798 WeakPolarHBondContact SG-CG 3.39Å; C796-C825 PolarHBondContact SG-SG 3.49Å
797	G	88.6	Confident	88.5	Confident	44 Å²	44	43.9 Å²	43.9	45%	0.454	25%	0.248	S	C	.	.			trans	64.5	14.7	180	0	0	0	0	0	114.4	C793 N799	C793-G797 PolarHBondContact O-N 2.89Å; G797-N799 PolarHBondContact O-N 3.36Å
798	L	86.5	Confident	89.3	Confident	13 Å²	13	41.5 Å²	41.5	7%	0.068	23%	0.234	C	C	.	.			trans	-67.2	105	172.5	-79.2	-179.9	0	0	0	109.6	Y778 C793 C796	Y778-L798 HydrophobicContact CD1-CD1 3.98Å; Y778-L798 HydrophobicContact CD1-CD2 3.8Å; Y778-L798 HydrophobicContact CD1-CG 4.43Å; Y778-L798 HydrophobicContact CD2-CD2 4.41Å; Y778-L798 HydrophobicContact CE1-CD1 4.09Å; Y778-L798 HydrophobicContact CE1-CD2 4.4Å; Y778-L798 HydrophobicContact CG-CD2 3.8Å; C793-L798 HydrophobicContact CB-CB 3.99Å; C793-L798 PolarHBondContact N-O 3.45Å; C796-L798 PolarHBondContact O-N 2.93Å; C796-L798 VanDerWaalsContact O-N 3.13Å; C796-L798 WeakPolarHBondContact SG-CG 3.39Å
799	N	90.3	Very high	89.7	Confident	18 Å²	18	43.9 Å²	43.9	10%	0.096	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	135.3	169.3	-50.7	-50.3	0	0	0	109.4	L775 C777 Y778 F790 V792 G797	L775-N799 WeakPolarHBondContact CB-ND2 3.28Å; C777-N799 WeakPolarHBondContact CA-O 3.42Å; Y778-N799 PolarHBondContact N-O 2.84Å; F790-N799 HydrophobicContact CB-CB 4.29Å; F790-N799 HydrophobicContact CD1-CB 4.38Å; F790-N799 HydrophobicContact CD2-CB 3.61Å; F790-N799 HydrophobicContact CE2-CB 3.87Å; F790-N799 HydrophobicContact CG-CB 3.87Å; F790-N799 HydrophobicContact CZ-CB 4.35Å; V792-N799 WeakPolarHBondContact CG2-OD1 3.42Å; G797-N799 PolarHBondContact O-N 3.36Å
800	A	90.5	Very high	89.9	Confident	3 Å²	3	44.8 Å²	44.8	3%	0.025	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	142.4	164.3	0	0	0	0	0	112	F790 L791 P802 L805	F790-A800 WeakPolarHBondContact CA-O 3.35Å; L791-A800 PolarHBondContact N-O 3.01Å; L791-A800 PolarHBondContact O-N 3.12Å; A800-P802 VanDerWaalsContact O-CD 3.3Å; A800-P802 WeakPolarHBondContact O-CD 3.49Å; A800-L805 HydrophobicContact CB-CD1 3.83Å; A800-L805 HydrophobicContact CB-CD2 3.93Å; A800-L805 HydrophobicContact CB-CG 3.76Å
801	H	91.7	Very high	89.9	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.06	25%	0.246	C	C	.	.			trans	-57.8	118.4	156.3	-70.7	121.6	0	0	0	108.6	C777 C780 P783 E788 F790 T803 C804 L805	C777-H801 VanDerWaalsContact CB-ND1 3.25Å; C777-H801 WeakPolarHBondContact CB-ND1 3.13Å; C777-H801 PolarHBondContact SG-N 3.46Å; C780-H801 PolarHBondContact SG-ND1 3.17Å; P783-H801 PolarHBondContact O-CE1 3.11Å; P783-H801 PolarHBondContact O-NE2 3.24Å; E788-H801 WeakPolarHBondContact OE1-CA 3.38Å; E788-H801 WeakPolarHBondContact OE1-CB 3.5Å; E788-H801 IonicContact OE1-CG 3.73Å; E788-H801 IonicContact OE2-CD2 3.5Å; E788-H801 IonicContact OE2-CG 2.7Å; F790-H801 AromaticContact CE1-CD2 3.9Å; F790-H801 AromaticContact CE1-CE1 3.76Å; F790-H801 AromaticContact CE1-NE2 3.6Å; H801-T803 PolarHBondContact O-N 2.94Å; H801-C804 HydrophobicContact CB-CB 3.84Å; H801-C804 WeakPolarHBondContact O-CA 3.25Å; H801-C804 WeakPolarHBondContact O-CB 3.32Å; H801-C804 PolarHBondContact O-N 3.37Å; H801-L805 PolarHBondContact O-N 3.13Å
802	P	91.5	Very high	90	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.026	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-44.5	-41.4	168.7	7.3	-21.2	0	0	0	114	E788 L791 A800 C804 L805 D806 Y807 T812	E788-P802 HydrophobicContact CG-CG 3.9Å; E788-P802 WeakPolarHBondContact OE1-CD 3.39Å; E788-P802 VanDerWaalsContact OE1-CG 3.23Å; E788-P802 WeakPolarHBondContact OE1-CG 3.34Å; L791-P802 HydrophobicContact CD1-CB 3.89Å; L791-P802 HydrophobicContact CD1-CG 4.42Å; L791-P802 HydrophobicContact CG-CB 4.3Å; L791-P802 HydrophobicContact CG-CG 4.29Å; A800-P802 VanDerWaalsContact O-CD 3.3Å; A800-P802 WeakPolarHBondContact O-CD 3.49Å; P802-C804 PolarHBondContact O-N 3.29Å; P802-L805 CarbonylContact O-C 3.46Å; P802-L805 WeakPolarHBondContact O-CA 3.35Å; P802-L805 WeakPolarHBondContact O-CB 3.34Å; P802-L805 PolarHBondContact O-N 2.94Å; P802-D806 PolarHBondContact O-N 2.96Å; P802-D806 VanDerWaalsContact O-N 3.16Å; P802-Y807 PolarHBondContact O-N 2.84Å; P802-T812 HydrophobicContact CB-CG2 3.67Å; P802-T812 WeakPolarHBondContact CB-OG1 3.36Å; P802-T812 HydrophobicContact CG-CG2 3.53Å
803	T	89.9	Confident	89.9	Confident	62 Å²	62	46.4 Å²	46.4	38%	0.38	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-60.2	-30.1	176	63.2	0	0	0	0	113.4	E788 H801 D806 K1175	E788-T803 VanDerWaalsContact CD-CG2 3.45Å; E788-T803 VanDerWaalsContact CD-OG1 3.23Å; E788-T803 HydrophobicContact CG-CG2 4.45Å; E788-T803 WeakPolarHBondContact OE1-CB 3.42Å; E788-T803 WeakPolarHBondContact OE1-CG2 3.44Å; E788-T803 PolarHBondContact OE1-N 3.43Å; E788-T803 PolarHBondContact OE1-OG1 2.77Å; E788-T803 WeakPolarHBondContact OE2-CG2 3.15Å; E788-T803 PolarHBondContact OE2-OG1 3.25Å; H801-T803 PolarHBondContact O-N 2.94Å; T803-D806 PolarHBondContact O-N 3.39Å; T803-K1175 PolarHBondContact O-NZ 2.63Å
804	C	88.7	Confident	89.8	Confident	42 Å²	42	47.2 Å²	47.2	28%	0.284	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-86.1	-13.2	176.9	-64.8	0	0	0	0	113.4	C779 H801 P802 D806	C779-C804 HydrophobicContact CB-CB 3.7Å; H801-C804 HydrophobicContact CB-CB 3.84Å; H801-C804 WeakPolarHBondContact O-CA 3.25Å; H801-C804 WeakPolarHBondContact O-CB 3.32Å; H801-C804 PolarHBondContact O-N 3.37Å; P802-C804 PolarHBondContact O-N 3.29Å; C804-D806 VanDerWaalsContact C-N 3.29Å
805	L	87.8	Confident	89.9	Confident	47 Å²	47	40.3 Å²	40.3	25%	0.246	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-87.3	-0.5	161.5	-59.5	171.1	0	0	0	112.1	L791 A800 H801 P802 Y807 W820	L791-L805 HydrophobicContact CD1-CD1 4.06Å; A800-L805 HydrophobicContact CB-CD1 3.83Å; A800-L805 HydrophobicContact CB-CD2 3.93Å; A800-L805 HydrophobicContact CB-CG 3.76Å; H801-L805 PolarHBondContact O-N 3.13Å; P802-L805 CarbonylContact O-C 3.46Å; P802-L805 WeakPolarHBondContact O-CA 3.35Å; P802-L805 WeakPolarHBondContact O-CB 3.34Å; P802-L805 PolarHBondContact O-N 2.94Å; L805-Y807 VanDerWaalsContact C-N 3.28Å; L805-Y807 HydrophobicContact CB-CD1 3.51Å; L805-Y807 HydrophobicContact CB-CE1 3.49Å; L805-Y807 VanDerWaalsContact CB-CE1 3.49Å; L805-Y807 HydrophobicContact CB-CG 4.19Å; L805-Y807 HydrophobicContact CD1-CE1 4.12Å; L805-Y807 HydrophobicContact CD1-CE2 4.28Å; L805-Y807 HydrophobicContact CG-CE1 4.41Å; L805-Y807 WeakPolarHBondContact O-CD1 3.14Å; L805-W820 HydrophobicContact CD1-CH2 3.62Å; L805-W820 HydrophobicContact CD1-CZ2 3.41Å; L805-W820 VanDerWaalsContact CD1-CZ2 3.41Å
806	D	87.4	Confident	90.1	Very high	62 Å²	62	41.9 Å²	41.9	33%	0.332	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	26.1	-170.5	-75.1	-70.3	0	0	0	114.3	P802 T803 C804 R1153 K1175	P802-D806 PolarHBondContact O-N 2.96Å; P802-D806 VanDerWaalsContact O-N 3.16Å; T803-D806 PolarHBondContact O-N 3.39Å; C804-D806 VanDerWaalsContact C-N 3.29Å; D806-R1153 VanDerWaalsContact CG-NH2 3.34Å; D806-R1153 IonicContact OD1-CZ 3.27Å; D806-R1153 IonicContact OD1-NH1 2.86Å; D806-R1153 IonicContact OD1-NH2 2.74Å; D806-R1153 PolarHBondContact OD1-NH2 3.48Å; D806-R1153 IonicContact OD2-NH2 2.73Å; D806-K1175 IonicContact OD1-NZ 2.66Å; D806-K1175 PolarHBondContact OD1-NZ 3.16Å
807	Y	90.1	Very high	90.1	Very high	37 Å²	37	45.9 Å²	45.9	15%	0.145	24%	0.238	C	C	.	.			trans	-80.7	140.6	172.8	-65.6	20.9	0	0	0	110	L791 P802 L805 L811 A815 W820 D847	L791-Y807 HydrophobicContact CD1-CD2 3.58Å; L791-Y807 HydrophobicContact CD1-CE2 3.66Å; P802-Y807 PolarHBondContact O-N 2.84Å; L805-Y807 VanDerWaalsContact C-N 3.28Å; L805-Y807 HydrophobicContact CB-CD1 3.51Å; L805-Y807 HydrophobicContact CB-CE1 3.49Å; L805-Y807 VanDerWaalsContact CB-CE1 3.49Å; L805-Y807 HydrophobicContact CB-CG 4.19Å; L805-Y807 HydrophobicContact CD1-CE1 4.12Å; L805-Y807 HydrophobicContact CD1-CE2 4.28Å; L805-Y807 HydrophobicContact CG-CE1 4.41Å; L805-Y807 WeakPolarHBondContact O-CD1 3.14Å; Y807-L811 HydrophobicContact CD1-CD2 4.06Å; Y807-L811 HydrophobicContact CD2-CD2 4.14Å; Y807-L811 HydrophobicContact CD2-CG 3.96Å; Y807-L811 HydrophobicContact CG-CD2 3.8Å; Y807-L811 HydrophobicContact CG-CG 4.07Å; Y807-A815 HydrophobicContact CD2-CB 4.34Å; Y807-A815 HydrophobicContact CE2-CB 4.14Å; Y807-W820 AromaticContact CE2-NE1 3.76Å; Y807-D847 HydrophobicContact CE2-CB 4.09Å; Y807-D847 VanDerWaalsContact CE2-OD2 3.28Å; Y807-D847 WeakPolarHBondContact CE2-OD2 3Å; Y807-D847 VanDerWaalsContact CZ-OD2 3.27Å; Y807-D847 PolarHBondContact OH-OD1 2.93Å; Y807-D847 VanDerWaalsContact OH-OD1 3.11Å; Y807-D847 PolarHBondContact OH-OD2 3.39Å
808	W	87.5	Confident	90	Very high	69 Å²	69	45.9 Å²	45.9	26%	0.261	23%	0.231	S	C	.	.			trans	-89.6	169	170.6	59.1	90.1	0	0	0	111.2	E810 L811 T812 D844 Y879	W808-E810 PolarHBondContact O-N 3.36Å; W808-L811 HydrophobicContact CD2-CB 3.83Å; W808-L811 HydrophobicContact CD2-CD2 4.38Å; W808-L811 HydrophobicContact CE3-CB 4.44Å; W808-L811 HydrophobicContact CE3-CD2 4.16Å; W808-L811 HydrophobicContact CG-CB 4.1Å; W808-L811 HydrophobicContact CH2-CD2 3.9Å; W808-L811 HydrophobicContact CZ2-CB 3.89Å; W808-L811 HydrophobicContact CZ2-CD2 4.11Å; W808-L811 HydrophobicContact CZ2-CG 4.48Å; W808-L811 HydrophobicContact CZ3-CD2 3.93Å; W808-L811 PolarHBondContact O-N 2.95Å; W808-T812 WeakPolarHBondContact O-CB 3.42Å; W808-T812 PolarHBondContact O-N 3.34Å; W808-T812 PolarHBondContact O-OG1 3.29Å; W808-D844 WeakPolarHBondContact CH2-O 3.38Å; W808-D844 VanDerWaalsContact CZ2-O 3.24Å; W808-D844 WeakPolarHBondContact CZ2-O 3.48Å; W808-Y879 WeakPolarHBondContact CZ2-OH 3.36Å
809	P	88.8	Confident	90.3	Very high	78 Å²	78	49.7 Å²	49.7	51%	0.506	26%	0.257	S	S	.	.	H	α-helix	trans	-54	-53.1	-174.8	-30.5	37.5	0	0	0	114.3	L811 T812 E813	P809-L811 PolarHBondContact O-N 3.23Å; P809-T812 CarbonylContact O-C 3.57Å; P809-T812 WeakPolarHBondContact O-CA 2.97Å; P809-T812 WeakPolarHBondContact O-CB 3.31Å; P809-T812 PolarHBondContact O-N 2.87Å; P809-E813 WeakPolarHBondContact O-CG 3.43Å; P809-E813 PolarHBondContact O-N 3.45Å
810	E	89.7	Confident	90.5	Very high	66 Å²	66	49.6 Å²	49.6	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-40.8	178.2	-171.3	-141.3	150.7	0	0	113.3	W808 T812 E813 R814 Y879	W808-E810 PolarHBondContact O-N 3.36Å; E810-T812 VanDerWaalsContact C-N 3.29Å; E810-T812 PolarHBondContact O-N 3.03Å; E810-E813 PolarHBondContact O-N 2.91Å; E810-R814 WeakPolarHBondContact O-CB 3Å; E810-R814 VanDerWaalsContact O-CG 3.27Å; E810-R814 WeakPolarHBondContact O-CG 3.43Å; E810-R814 PolarHBondContact O-N 3.24Å; E810-R814 WeakPolarHBondContact OE1-CD 3.46Å; E810-R814 IonicContact OE1-CZ 3.71Å; E810-R814 IonicContact OE1-NE 3.97Å; E810-R814 IonicContact OE1-NH1 2.69Å; E810-R814 PolarHBondContact OE1-NH1 3.02Å; E810-Y879 WeakPolarHBondContact OE1-CD2 3.47Å; E810-Y879 VanDerWaalsContact OE1-CE2 3.23Å; E810-Y879 WeakPolarHBondContact OE1-CE2 3.31Å; E810-Y879 WeakPolarHBondContact OE2-CE2 3.2Å
811	L	92	Very high	90.6	Very high	9 Å²	9	51 Å²	51	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-34.3	173.4	178.1	59.8	0	0	0	111.3	Y807 W808 P809 A815 D844 D847	Y807-L811 HydrophobicContact CD1-CD2 4.06Å; Y807-L811 HydrophobicContact CD2-CD2 4.14Å; Y807-L811 HydrophobicContact CD2-CG 3.96Å; Y807-L811 HydrophobicContact CG-CD2 3.8Å; Y807-L811 HydrophobicContact CG-CG 4.07Å; W808-L811 HydrophobicContact CD2-CB 3.83Å; W808-L811 HydrophobicContact CD2-CD2 4.38Å; W808-L811 HydrophobicContact CE3-CB 4.44Å; W808-L811 HydrophobicContact CE3-CD2 4.16Å; W808-L811 HydrophobicContact CG-CB 4.1Å; W808-L811 HydrophobicContact CH2-CD2 3.9Å; W808-L811 HydrophobicContact CZ2-CB 3.89Å; W808-L811 HydrophobicContact CZ2-CD2 4.11Å; W808-L811 HydrophobicContact CZ2-CG 4.48Å; W808-L811 HydrophobicContact CZ3-CD2 3.93Å; W808-L811 PolarHBondContact O-N 2.95Å; P809-L811 PolarHBondContact O-N 3.23Å; L811-A815 WeakPolarHBondContact O-CB 3.29Å; L811-A815 PolarHBondContact O-N 3.22Å; L811-D844 WeakPolarHBondContact CD1-O 3.35Å; L811-D847 HydrophobicContact CD1-CB 3.99Å
812	T	92.8	Very high	90.6	Very high	12 Å²	12	50.7 Å²	50.7	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-45.2	175.6	-58.1	0	0	0	0	110.9	L791 P802 W808 P809 E810 A815 R816	L791-T812 HydrophobicContact CD2-CG2 4.42Å; L791-T812 HydrophobicContact CG-CG2 4.5Å; P802-T812 HydrophobicContact CB-CG2 3.67Å; P802-T812 WeakPolarHBondContact CB-OG1 3.36Å; P802-T812 HydrophobicContact CG-CG2 3.53Å; W808-T812 WeakPolarHBondContact O-CB 3.42Å; W808-T812 PolarHBondContact O-N 3.34Å; W808-T812 PolarHBondContact O-OG1 3.29Å; P809-T812 CarbonylContact O-C 3.57Å; P809-T812 WeakPolarHBondContact O-CA 2.97Å; P809-T812 WeakPolarHBondContact O-CB 3.31Å; P809-T812 PolarHBondContact O-N 2.87Å; E810-T812 VanDerWaalsContact C-N 3.29Å; E810-T812 PolarHBondContact O-N 3.03Å; T812-A815 WeakPolarHBondContact O-CB 3.37Å; T812-A815 PolarHBondContact O-N 2.97Å; T812-R816 WeakPolarHBondContact O-CG 3.37Å; T812-R816 PolarHBondContact O-N 2.99Å
813	E	91.3	Very high	90.4	Very high	110 Å²	110	54.9 Å²	54.9	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-48.2	173.7	-70	160.5	-144.6	0	0	111.3	P809 E810 A815 R816 Q817	P809-E813 WeakPolarHBondContact O-CG 3.43Å; P809-E813 PolarHBondContact O-N 3.45Å; E810-E813 PolarHBondContact O-N 2.91Å; E813-A815 VanDerWaalsContact C-N 3.29Å; E813-A815 PolarHBondContact O-N 3.01Å; E813-R816 CarbonylContact O-C 3.47Å; E813-R816 WeakPolarHBondContact O-CA 3.21Å; E813-R816 WeakPolarHBondContact O-CB 3.43Å; E813-R816 PolarHBondContact O-N 3.17Å; E813-Q817 WeakPolarHBondContact O-CG 3.45Å; E813-Q817 PolarHBondContact O-N 3.24Å
814	R	92.6	Very high	90.1	Very high	18 Å²	18	54.4 Å²	54.4	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-24.7	179.3	-66.2	167.5	83.7	-171.8	17.7	113.2	E810 A845 C846 K848 C874 E877	E810-R814 WeakPolarHBondContact O-CB 3Å; E810-R814 VanDerWaalsContact O-CG 3.27Å; E810-R814 WeakPolarHBondContact O-CG 3.43Å; E810-R814 PolarHBondContact O-N 3.24Å; E810-R814 WeakPolarHBondContact OE1-CD 3.46Å; E810-R814 IonicContact OE1-CZ 3.71Å; E810-R814 IonicContact OE1-NE 3.97Å; E810-R814 IonicContact OE1-NH1 2.69Å; E810-R814 PolarHBondContact OE1-NH1 3.02Å; R814-A845 WeakPolarHBondContact CD-O 3.34Å; R814-A845 VanDerWaalsContact CZ-O 3.25Å; R814-A845 PolarHBondContact NE-O 2.93Å; R814-A845 PolarHBondContact NH1-O 3.38Å; R814-C846 HydrophobicContact CB-CB 4.17Å; R814-K848 PolarHBondContact O-NZ 2.73Å; R814-C874 PolarHBondContact NH2-SG 2.8Å; R814-C874 VanDerWaalsContact NH2-SG 3.39Å; R814-E877 IonicContact CZ-OE2 3.26Å; R814-E877 IonicContact NE-OE2 2.7Å; R814-E877 IonicContact NH2-OE2 3.19Å; R814-E877 PolarHBondContact NH2-OE2 3.21Å
815	A	93.2	Very high	90.2	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-71.3	-38.6	166.4	0	0	0	0	0	111.8	L791 Y807 L811 T812 E813 D847	L791-A815 HydrophobicContact CD1-CB 4.38Å; L791-A815 HydrophobicContact CD2-CB 4.35Å; Y807-A815 HydrophobicContact CD2-CB 4.34Å; Y807-A815 HydrophobicContact CE2-CB 4.14Å; L811-A815 WeakPolarHBondContact O-CB 3.29Å; L811-A815 PolarHBondContact O-N 3.22Å; T812-A815 WeakPolarHBondContact O-CB 3.37Å; T812-A815 PolarHBondContact O-N 2.97Å; E813-A815 VanDerWaalsContact C-N 3.29Å; E813-A815 PolarHBondContact O-N 3.01Å; A815-D847 HydrophobicContact CB-CB 4.24Å
816	R	92.5	Very high	90.3	Very high	113 Å²	113	52.1 Å²	52.1	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-72.1	-25.6	174.2	-69.7	-178.2	-153.5	-76.6	2.7	113.8	A789 F790 L791 T812 E813 S818	A789-R816 PolarHBondContact O-NH1 2.66Å; A789-R816 VanDerWaalsContact O-NH1 3.15Å; A789-R816 PolarHBondContact O-NH2 3.2Å; F790-R816 PolarHBondContact O-NH1 3.09Å; F790-R816 VanDerWaalsContact O-NH1 3.15Å; L791-R816 HydrophobicContact CD2-CG 3.84Å; T812-R816 WeakPolarHBondContact O-CG 3.37Å; T812-R816 PolarHBondContact O-N 2.99Å; E813-R816 CarbonylContact O-C 3.47Å; E813-R816 WeakPolarHBondContact O-CA 3.21Å; E813-R816 WeakPolarHBondContact O-CB 3.43Å; E813-R816 PolarHBondContact O-N 3.17Å; R816-S818 PolarHBondContact O-N 3.35Å
817	Q	89.6	Confident	90.5	Very high	141 Å²	141	50.4 Å²	50.4	66%	0.659	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-7.3	174	-74.4	168.5	8.1	0	0	114	E813	E813-Q817 WeakPolarHBondContact O-CG 3.45Å; E813-Q817 PolarHBondContact O-N 3.24Å
818	S	86.6	Confident	90.7	Very high	44 Å²	44	48.7 Å²	48.7	31%	0.308	26%	0.256	S	S	.	.	S	Bend	trans	-139.6	158.2	168.8	48	0	0	0	0	109.8	R816 W820 K848	R816-S818 PolarHBondContact O-N 3.35Å; S818-W820 PolarHBondContact O-N 2.65Å; S818-K848 PolarHBondContact OG-NZ 3.18Å
819	P	92.1	Very high	90.9	Very high	94 Å²	94	48.5 Å²	48.5	61%	0.61	26%	0.263	S	S	*	.			trans	-59.1	110.8	175.2	-23.7	34.7	0	0	0	110.9	K794	K794-P819 HydrophobicContact CB-CB 4.46Å; K794-P819 HydrophobicContact CD-CB 3.71Å
820	W	94.2	Very high	90.8	Very high	16 Å²	16	47.6 Å²	47.6	6%	0.061	26%	0.256	C	S	.	.			trans	-68.9	143.3	-166.6	-179	70.8	0	0	0	113.2	L791 C793 K794 L805 Y807 S818 C822 D847	L791-W820 HydrophobicContact CB-CD2 3.78Å; L791-W820 HydrophobicContact CB-CE3 3.64Å; L791-W820 HydrophobicContact CB-CG 4.33Å; L791-W820 HydrophobicContact CB-CH2 4.3Å; L791-W820 HydrophobicContact CB-CZ2 4.44Å; L791-W820 HydrophobicContact CB-CZ3 3.9Å; L791-W820 HydrophobicContact CD1-CD2 4.41Å; L791-W820 HydrophobicContact CD2-CB 4.42Å; L791-W820 HydrophobicContact CD2-CG 4.23Å; L791-W820 HydrophobicContact CG-CD2 4.48Å; L791-W820 WeakPolarHBondContact O-CZ3 3.25Å; C793-W820 WeakPolarHBondContact CA-O 3.45Å; C793-W820 HydrophobicContact CB-CE3 3.94Å; C793-W820 HydrophobicContact CB-CZ3 3.69Å; K794-W820 PolarHBondContact N-O 3.08Å; L805-W820 HydrophobicContact CD1-CH2 3.62Å; L805-W820 HydrophobicContact CD1-CZ2 3.41Å; L805-W820 VanDerWaalsContact CD1-CZ2 3.41Å; Y807-W820 AromaticContact CE2-NE1 3.76Å; S818-W820 PolarHBondContact O-N 2.65Å; W820-C822 HydrophobicContact CH2-CB 3.48Å; W820-C822 VanDerWaalsContact CH2-CB 3.48Å; W820-C822 HydrophobicContact CZ2-CB 3.99Å; W820-C822 HydrophobicContact CZ3-CB 3.99Å; W820-D847 PolarHBondContact NE1-OD2 3.33Å
821	Q	93.7	Very high	90.8	Very high	33 Å²	33	46.6 Å²	46.6	15%	0.154	26%	0.255	C	S	.	.			trans	-125.6	128.8	175.2	-54.6	-171.6	-59.7	0	0	110.2	D795 C825 K826 T827	D795-Q821 WeakPolarHBondContact OD2-CG 3.36Å; D795-Q821 PolarHBondContact OD2-NE2 3.32Å; Q821-C825 HydrophobicContact CB-CB 4.43Å; Q821-C825 PolarHBondContact NE2-O 2.93Å; Q821-K826 HydrophobicContact CB-CD 4.42Å; Q821-K826 WeakPolarHBondContact O-CE 3.25Å; Q821-K826 PolarHBondContact O-NZ 3.42Å; Q821-T827 PolarHBondContact OE1-OG1 2.93Å
822	C	90.9	Very high	90.7	Very high	6 Å²	6	51.8 Å²	51.8	4%	0.041	28%	0.283	C	S	.	.			trans	-66.9	170.1	173.8	73.6	0	0	0	0	112.6	C793 W820 D824 C825 K826	C793-C822 HydrophobicContact CB-CB 3.95Å; C793-C822 PolarHBondContact SG-N 3.22Å; W820-C822 HydrophobicContact CH2-CB 3.48Å; W820-C822 VanDerWaalsContact CH2-CB 3.48Å; W820-C822 HydrophobicContact CZ2-CB 3.99Å; W820-C822 HydrophobicContact CZ3-CB 3.99Å; C822-D824 PolarHBondContact O-N 3.34Å; C822-C825 PolarHBondContact O-N 2.94Å; C822-K826 PolarHBondContact O-N 2.92Å
823	S	86.1	Confident	90.2	Very high	91 Å²	91	55.4 Å²	55.4	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-32.9	176.1	55.6	0	0	0	0	114.5
824	D	84.7	Confident	89.6	Confident	53 Å²	53	53.5 Å²	53.5	28%	0.283	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-13.6	-175	-61.7	10.3	0	0	0	112.9	R317 C822	R317-D824 WeakPolarHBondContact CD-OD2 3.42Å; R317-D824 IonicContact CZ-OD2 3.96Å; R317-D824 IonicContact NE-OD2 3.01Å; R317-D824 PolarHBondContact NE-OD2 3.41Å; C822-D824 PolarHBondContact O-N 3.34Å
825	C	90.1	Very high	88.4	Confident	26 Å²	26	61.2 Å²	61.2	18%	0.176	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-4.9	-176.7	-65.4	0	0	0	0	113.6	D795 C796 Q821 C822 T827	D795-C825 HydrophobicContact CB-CB 4.15Å; C796-C825 PolarHBondContact SG-SG 3.49Å; Q821-C825 HydrophobicContact CB-CB 4.43Å; Q821-C825 PolarHBondContact NE2-O 2.93Å; C822-C825 PolarHBondContact O-N 2.94Å; C825-T827 PolarHBondContact O-N 3.26Å
826	K	90.9	Very high	86.9	Confident	14 Å²	14	65.8 Å²	65.8	6%	0.061	36%	0.355	C	S	.	.			trans	-56.7	129.3	-176.2	-164.7	80.8	72.8	-169.8	0	112	Q821 C822 L840 I842 D847	Q821-K826 HydrophobicContact CB-CD 4.42Å; Q821-K826 WeakPolarHBondContact O-CE 3.25Å; Q821-K826 PolarHBondContact O-NZ 3.42Å; C822-K826 PolarHBondContact O-N 2.92Å; K826-L840 HydrophobicContact CB-CD2 3.8Å; K826-L840 HydrophobicContact CG-CD2 3.48Å; K826-L840 VanDerWaalsContact CG-CD2 3.48Å; K826-L840 WeakPolarHBondContact O-CD2 3.43Å; K826-I842 HydrophobicContact CG-CD1 4.36Å; K826-I842 HydrophobicContact CG-CG1 4.33Å; K826-D847 VanDerWaalsContact CE-O 3.29Å; K826-D847 WeakPolarHBondContact CE-O 3.34Å; K826-D847 WeakPolarHBondContact CE-OD1 3.19Å; K826-D847 PolarHBondContact NZ-O 2.92Å; K826-D847 IonicContact NZ-OD1 2.71Å; K826-D847 PolarHBondContact NZ-OD1 2.77Å; K826-D847 IonicContact NZ-OD2 3.88Å; K826-D847 PolarHBondContact NZ-OD2 3.01Å
827	T	92.2	Very high	85.3	Confident	27 Å²	27	71 Å²	71	17%	0.166	38%	0.375	C	S	.	.			trans	-114.6	168.7	170.2	68.8	0	0	0	0	111.8	Q821 C825 T829 N832 G849	Q821-T827 PolarHBondContact OE1-OG1 2.93Å; C825-T827 PolarHBondContact O-N 3.26Å; T827-T829 PolarHBondContact O-N 2.73Å; T827-N832 VanDerWaalsContact CB-O 3.26Å; T827-N832 WeakPolarHBondContact CB-O 3.26Å; T827-N832 WeakPolarHBondContact CG2-O 3.09Å; T827-N832 PolarHBondContact OG1-O 2.97Å; T827-G849 WeakPolarHBondContact O-CA 3.3Å
828	C	92.6	Very high	84.1	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-77.2	117.9	174.2	173.1	0	0	0	0	111.3	V830 C831 N832 N833 L840 G849 H851	C828-V830 PolarHBondContact O-N 2.86Å; C828-C831 PolarHBondContact O-N 2.89Å; C828-N832 VanDerWaalsContact O-CA 3.24Å; C828-N832 WeakPolarHBondContact O-CA 3.23Å; C828-N832 PolarHBondContact O-N 2.94Å; C828-N833 WeakPolarHBondContact CB-O 3.49Å; C828-N833 PolarHBondContact N-O 3.35Å; C828-L840 HydrophobicContact CB-CD1 3.62Å; C828-G849 CarbonylContact C-O 3.17Å; C828-G849 WeakPolarHBondContact CA-O 3.46Å; C828-H851 WeakPolarHBondContact CB-CE1 3.43Å; C828-H851 VanDerWaalsContact CB-ND1 3.28Å; C828-H851 WeakPolarHBondContact CB-ND1 3.24Å; C828-H851 PolarHBondContact SG-N 3.32Å
829	T	91.4	Very high	83.7	Confident	66 Å²	66	66.2 Å²	66.2	41%	0.405	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-24.2	179.7	-44.5	0	0	0	0	114.6	T827 K848 G849	T827-T829 PolarHBondContact O-N 2.73Å; T829-K848 HydrophobicContact CG2-CD 4.16Å; T829-K848 WeakPolarHBondContact OG1-CB 3.23Å; T829-G849 PolarHBondContact N-O 2.92Å; T829-G849 PolarHBondContact OG1-O 3.4Å
830	V	88.4	Confident	83.5	Confident	59 Å²	59	63.6 Å²	63.6	36%	0.358	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-19	-175.9	174.8	0	0	0	0	113.3	C828 F850 C854	C828-V830 PolarHBondContact O-N 2.86Å; V830-F850 HydrophobicContact CG2-CD1 4.08Å; V830-F850 HydrophobicContact CG2-CE1 4.19Å; V830-C854 HydrophobicContact CB-CB 3.92Å; V830-C854 HydrophobicContact CG1-CB 3.94Å; V830-C854 WeakPolarHBondContact CG1-O 3.34Å
831	C	89.8	Confident	83.2	Confident	44 Å²	44	63.5 Å²	63.5	30%	0.297	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.8	6.7	178.2	64.5	0	0	0	0	114.8	C828 N833 H851	C828-C831 PolarHBondContact O-N 2.89Å; C831-N833 PolarHBondContact O-N 2.9Å; C831-N833 PolarHBondContact O-OD1 3.35Å; C831-H851 VanDerWaalsContact SG-CE1 3.55Å; C831-H851 PolarHBondContact SG-ND1 3.46Å; C831-H851 VanDerWaalsContact SG-ND1 3.38Å
832	N	88.1	Confident	83.1	Confident	118 Å²	118	64.9 Å²	64.9	63%	0.631	34%	0.341	S	S	*	.			trans	52.8	12.2	-179.9	-62.5	-26.4	0	0	0	117	T827 C828	T827-N832 VanDerWaalsContact CB-O 3.26Å; T827-N832 WeakPolarHBondContact CB-O 3.26Å; T827-N832 WeakPolarHBondContact CG2-O 3.09Å; T827-N832 PolarHBondContact OG1-O 2.97Å; C828-N832 VanDerWaalsContact O-CA 3.24Å; C828-N832 WeakPolarHBondContact O-CA 3.23Å; C828-N832 PolarHBondContact O-N 2.94Å
833	N	83.6	Confident	83.2	Confident	89 Å²	89	64.6 Å²	64.6	48%	0.476	34%	0.339	S	S	.	.			trans	-102.2	143.9	179.6	-62.7	-22.9	0	0	0	111.5	C828 C831 H851	C828-N833 WeakPolarHBondContact CB-O 3.49Å; C828-N833 PolarHBondContact N-O 3.35Å; C831-N833 PolarHBondContact O-N 2.9Å; C831-N833 PolarHBondContact O-OD1 3.35Å; N833-H851 PolarHBondContact O-CE1 2.9Å; N833-H851 PolarHBondContact O-NE2 3.37Å
834	S	77.8	Confident	83.4	Confident	70 Å²	70	63.3 Å²	63.3	49%	0.49	33%	0.325	S	S	.	.	S	Bend	trans	-88.3	-23.2	165.1	46.6	0	0	0	0	112.5
835	E	68.2	Low	83.7	Confident	179 Å²	179	60.8 Å²	60.8	84%	0.836	31%	0.311	S	S	*	.			trans	-106.7	82.2	-174.1	-64.6	-176.9	-174.8	0	0	111.2
836	Y	60.9	Low	83.8	Confident	99 Å²	99	59.8 Å²	59.8	39%	0.388	30%	0.304	S	S	.	.	S	Bend	trans	-125.5	175	172.4	-168.8	-109.4	0	0	0	111.6	S838 H851 E853	Y836-S838 VanDerWaalsContact C-N 3.27Å; Y836-S838 PolarHBondContact O-N 3.33Å; Y836-H851 WeakPolarHBondContact CB-CE1 3.34Å; Y836-H851 WeakPolarHBondContact CB-ND1 3.04Å; Y836-H851 HydrophobicContact CD1-CB 4.02Å; Y836-H851 AromaticContact CD1-CG 3.82Å; Y836-H851 AromaticContact CD1-ND1 3.68Å; Y836-H851 AromaticContact CG-CE1 3.98Å; Y836-H851 AromaticContact CG-ND1 3.72Å; Y836-E853 HydrophobicContact CE1-CB 4.15Å; Y836-E853 WeakPolarHBondContact CE1-OE1 3.5Å; Y836-E853 PolarHBondContact OH-OE2 2.86Å
837	R	59.8	Low	84	Confident	221 Å²	221	59.8 Å²	59.8	83%	0.834	31%	0.305	S	S	*	.	S	Bend	trans	-62.7	-28.3	-173.1	-74.8	-177.6	170.6	151.5	-1.4	114.6
838	S	63.9	Low	84	Confident	15 Å²	15	60.7 Å²	60.7	11%	0.105	31%	0.307	C	S	.	.	S	Bend	trans	-105.6	137.3	175.9	24.7	0	0	0	0	110.5	Y836 L840 H851 E853	Y836-S838 VanDerWaalsContact C-N 3.27Å; Y836-S838 PolarHBondContact O-N 3.33Å; S838-L840 PolarHBondContact O-N 3.49Å; S838-H851 PolarHBondContact O-CD2 2.85Å; S838-H851 VanDerWaalsContact O-CD2 3.23Å; S838-E853 WeakPolarHBondContact CB-OE1 3.34Å; S838-E853 PolarHBondContact OG-OE1 3.12Å
839	D	78.4	Confident	84	Confident	70 Å²	70	60.7 Å²	60.7	37%	0.374	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-49.3	138.8	169.1	-101.7	-26.3	0	0	0	109.9	K318 I841 R865	K318-D839 IonicContact NZ-OD1 2.76Å; K318-D839 PolarHBondContact NZ-OD1 3.33Å; K318-D839 IonicContact NZ-OD2 3.81Å; D839-I841 PolarHBondContact O-N 2.97Å; D839-R865 VanDerWaalsContact CB-NH2 3.29Å; D839-R865 IonicContact OD2-CZ 3.34Å; D839-R865 VanDerWaalsContact OD2-CZ 3.27Å; D839-R865 IonicContact OD2-NH1 3.47Å; D839-R865 PolarHBondContact OD2-NH1 2.88Å; D839-R865 IonicContact OD2-NH2 3.06Å; D839-R865 PolarHBondContact OD2-NH2 3.16Å
840	L	88	Confident	84	Confident	39 Å²	39	58.2 Å²	58.2	20%	0.204	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.6	173.9	-162.7	74.4	0	0	0	110.7	K826 C828 S838	K826-L840 HydrophobicContact CB-CD2 3.8Å; K826-L840 HydrophobicContact CG-CD2 3.48Å; K826-L840 VanDerWaalsContact CG-CD2 3.48Å; K826-L840 WeakPolarHBondContact O-CD2 3.43Å; C828-L840 HydrophobicContact CB-CD1 3.62Å; S838-L840 PolarHBondContact O-N 3.49Å
841	I	87.5	Confident	84.1	Confident	15 Å²	15	55.4 Å²	55.4	8%	0.077	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	142.4	164.3	-169.2	166.8	0	0	0	109.2	D839 G849 F850 L859 I863 W869	D839-I841 PolarHBondContact O-N 2.97Å; I841-G849 CarbonylContact O-C 3.48Å; I841-G849 WeakPolarHBondContact O-CA 3.5Å; I841-F850 HydrophobicContact CG2-CB 4.29Å; I841-F850 WeakPolarHBondContact CG2-O 3.43Å; I841-F850 PolarHBondContact N-O 3.22Å; I841-F850 PolarHBondContact O-N 2.74Å; I841-L859 HydrophobicContact CG2-CD1 4.28Å; I841-I863 HydrophobicContact CD1-CB 4.1Å; I841-I863 HydrophobicContact CD1-CD1 3.73Å; I841-I863 HydrophobicContact CD1-CG2 3.61Å; I841-W869 HydrophobicContact CB-CE3 4.47Å; I841-W869 HydrophobicContact CB-CZ3 4.46Å; I841-W869 HydrophobicContact CD1-CB 3.93Å; I841-W869 HydrophobicContact CD1-CD2 3.54Å; I841-W869 HydrophobicContact CD1-CE3 3.69Å; I841-W869 HydrophobicContact CD1-CG 3.64Å; I841-W869 HydrophobicContact CD1-CZ3 4.4Å; I841-W869 HydrophobicContact CG1-CD2 4.05Å; I841-W869 HydrophobicContact CG1-CE3 3.62Å; I841-W869 HydrophobicContact CG1-CZ3 4.08Å; I841-W869 HydrophobicContact CG2-CE3 4.13Å; I841-W869 HydrophobicContact CG2-CH2 3.89Å; I841-W869 HydrophobicContact CG2-CZ2 4.4Å; I841-W869 HydrophobicContact CG2-CZ3 3.75Å
842	I	91.2	Very high	83.9	Confident	61 Å²	61	55 Å²	55	31%	0.313	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134	179.9	-59.1	174.8	0	0	0	107.5	K826 D847	K826-I842 HydrophobicContact CG-CD1 4.36Å; K826-I842 HydrophobicContact CG-CG1 4.33Å; I842-D847 WeakPolarHBondContact CG2-OD1 3.19Å
843	C	92.4	Very high	83.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.253	C	S	.	.			trans	-76.6	117.7	174	176.6	0	0	0	0	110.2	A845 C846 D847 K848 F850 W869 C871	C843-A845 PolarHBondContact O-N 3.31Å; C843-A845 VanDerWaalsContact O-N 3.12Å; C843-A845 PolarHBondContact SG-N 2.89Å; C843-A845 VanDerWaalsContact SG-N 3.43Å; C843-C846 PolarHBondContact O-N 3.03Å; C843-D847 VanDerWaalsContact O-CA 3.29Å; C843-D847 WeakPolarHBondContact O-CA 3.45Å; C843-D847 PolarHBondContact O-N 3.37Å; C843-K848 PolarHBondContact N-O 3.13Å; C843-F850 HydrophobicContact CB-CD2 4.46Å; C843-F850 HydrophobicContact CB-CE2 4.05Å; C843-W869 HydrophobicContact CB-CE3 4.32Å; C843-W869 HydrophobicContact CB-CZ3 3.89Å; C843-C871 HydrophobicContact CB-CB 4.03Å; C843-C871 PolarHBondContact SG-N 3.31Å
844	D	91.2	Very high	84.2	Confident	64 Å²	64	49.3 Å²	49.3	34%	0.342	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.4	178.3	-67.3	-67.8	0	0	0	113.3	W808 L811 P868 W869	W808-D844 WeakPolarHBondContact CH2-O 3.38Å; W808-D844 VanDerWaalsContact CZ2-O 3.24Å; W808-D844 WeakPolarHBondContact CZ2-O 3.48Å; L811-D844 WeakPolarHBondContact CD1-O 3.35Å; D844-P868 WeakPolarHBondContact OD2-CA 3.29Å; D844-W869 PolarHBondContact N-O 2.93Å; D844-W869 PolarHBondContact OD2-N 3.42Å
845	A	91.3	Very high	84.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-25.1	-178.8	0	0	0	0	0	114.6	R814 C843 V870 C874 Y879	R814-A845 WeakPolarHBondContact CD-O 3.34Å; R814-A845 VanDerWaalsContact CZ-O 3.25Å; R814-A845 PolarHBondContact NE-O 2.93Å; R814-A845 PolarHBondContact NH1-O 3.38Å; C843-A845 PolarHBondContact O-N 3.31Å; C843-A845 VanDerWaalsContact O-N 3.12Å; C843-A845 PolarHBondContact SG-N 2.89Å; C843-A845 VanDerWaalsContact SG-N 3.43Å; A845-V870 HydrophobicContact CB-CB 4.49Å; A845-V870 HydrophobicContact CB-CG1 3.81Å; A845-V870 HydrophobicContact CB-CG2 4.02Å; A845-C874 HydrophobicContact CB-CB 3.84Å; A845-Y879 HydrophobicContact CB-CD1 3.44Å; A845-Y879 VanDerWaalsContact CB-CD1 3.44Å; A845-Y879 HydrophobicContact CB-CD2 4.32Å; A845-Y879 HydrophobicContact CB-CE1 3.51Å; A845-Y879 HydrophobicContact CB-CE2 4.4Å; A845-Y879 HydrophobicContact CB-CG 3.86Å
846	C	92.9	Very high	85.6	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.034	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142	6	-175.5	67.3	0	0	0	0	114.7	R814 C843 K848 C874	R814-C846 HydrophobicContact CB-CB 4.17Å; C843-C846 PolarHBondContact O-N 3.03Å; C846-K848 HydrophobicContact CB-CG 4.31Å; C846-K848 WeakPolarHBondContact O-CG 3.43Å; C846-K848 PolarHBondContact O-N 2.94Å; C846-K848 VanDerWaalsContact O-N 3.08Å; C846-K848 VanDerWaalsContact SG-CG 3.58Å; C846-C874 PolarHBondContact SG-SG 3.34Å
847	D	94.1	Very high	86.8	Confident	14 Å²	14	46.4 Å²	46.4	8%	0.075	22%	0.22	C	C	.	.			trans	56.1	22.9	179.3	-167.6	31.1	0	0	0	114.8	Y807 L811 A815 W820 K826 I842 C843	Y807-D847 HydrophobicContact CE2-CB 4.09Å; Y807-D847 VanDerWaalsContact CE2-OD2 3.28Å; Y807-D847 WeakPolarHBondContact CE2-OD2 3Å; Y807-D847 VanDerWaalsContact CZ-OD2 3.27Å; Y807-D847 PolarHBondContact OH-OD1 2.93Å; Y807-D847 VanDerWaalsContact OH-OD1 3.11Å; Y807-D847 PolarHBondContact OH-OD2 3.39Å; L811-D847 HydrophobicContact CD1-CB 3.99Å; A815-D847 HydrophobicContact CB-CB 4.24Å; W820-D847 PolarHBondContact NE1-OD2 3.33Å; K826-D847 VanDerWaalsContact CE-O 3.29Å; K826-D847 WeakPolarHBondContact CE-O 3.34Å; K826-D847 WeakPolarHBondContact CE-OD1 3.19Å; K826-D847 PolarHBondContact NZ-O 2.92Å; K826-D847 IonicContact NZ-OD1 2.71Å; K826-D847 PolarHBondContact NZ-OD1 2.77Å; K826-D847 IonicContact NZ-OD2 3.88Å; K826-D847 PolarHBondContact NZ-OD2 3.01Å; I842-D847 WeakPolarHBondContact CG2-OD1 3.19Å; C843-D847 VanDerWaalsContact O-CA 3.29Å; C843-D847 WeakPolarHBondContact O-CA 3.45Å; C843-D847 PolarHBondContact O-N 3.37Å
848	K	92.6	Very high	88	Confident	46 Å²	46	42.4 Å²	42.4	20%	0.2	21%	0.209	C	C	.	.			trans	-88.1	132.8	178.9	-63.8	-165.9	-155.3	-40.4	0	110.6	R814 S818 T829 C843 C846 F850	R814-K848 PolarHBondContact O-NZ 2.73Å; S818-K848 PolarHBondContact OG-NZ 3.18Å; T829-K848 HydrophobicContact CG2-CD 4.16Å; T829-K848 WeakPolarHBondContact OG1-CB 3.23Å; C843-K848 PolarHBondContact N-O 3.13Å; C846-K848 HydrophobicContact CB-CG 4.31Å; C846-K848 WeakPolarHBondContact O-CG 3.43Å; C846-K848 PolarHBondContact O-N 2.94Å; C846-K848 VanDerWaalsContact O-N 3.08Å; C846-K848 VanDerWaalsContact SG-CG 3.58Å; K848-F850 HydrophobicContact CB-CE2 3.64Å; K848-F850 HydrophobicContact CB-CZ 3.94Å; K848-F850 VanDerWaalsContact O-CD2 3.32Å; K848-F850 WeakPolarHBondContact O-CD2 3.34Å; K848-F850 WeakPolarHBondContact O-CE2 3.42Å
849	G	92.3	Very high	88.9	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	143.9	174.2	0	0	0	0	0	111.5	T827 C828 T829 I841	T827-G849 WeakPolarHBondContact O-CA 3.3Å; C828-G849 CarbonylContact C-O 3.17Å; C828-G849 WeakPolarHBondContact CA-O 3.46Å; T829-G849 PolarHBondContact N-O 2.92Å; T829-G849 PolarHBondContact OG1-O 3.4Å; I841-G849 CarbonylContact O-C 3.48Å; I841-G849 WeakPolarHBondContact O-CA 3.5Å
850	F	92	Very high	88.5	Confident	14 Å²	14	48 Å²	48	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	143.9	173	-60.7	-88.5	0	0	0	109.9	V830 I841 C843 K848 H855 W869 C871	V830-F850 HydrophobicContact CG2-CD1 4.08Å; V830-F850 HydrophobicContact CG2-CE1 4.19Å; I841-F850 HydrophobicContact CG2-CB 4.29Å; I841-F850 WeakPolarHBondContact CG2-O 3.43Å; I841-F850 PolarHBondContact N-O 3.22Å; I841-F850 PolarHBondContact O-N 2.74Å; C843-F850 HydrophobicContact CB-CD2 4.46Å; C843-F850 HydrophobicContact CB-CE2 4.05Å; K848-F850 HydrophobicContact CB-CE2 3.64Å; K848-F850 HydrophobicContact CB-CZ 3.94Å; K848-F850 VanDerWaalsContact O-CD2 3.32Å; K848-F850 WeakPolarHBondContact O-CD2 3.34Å; K848-F850 WeakPolarHBondContact O-CE2 3.42Å; F850-H855 HydrophobicContact CB-CB 4.37Å; F850-W869 HydrophobicContact CB-CH2 4.25Å; F850-W869 AromaticContact CD2-CH2 3.78Å; F850-W869 HydrophobicContact CD2-CH2 3.78Å; F850-W869 AromaticContact CD2-CZ3 3.93Å; F850-W869 HydrophobicContact CD2-CZ3 3.93Å; F850-W869 HydrophobicContact CG-CH2 4.21Å; F850-C871 HydrophobicContact CD2-CB 3.91Å; F850-C871 HydrophobicContact CE2-CB 3.42Å; F850-C871 VanDerWaalsContact CE2-CB 3.42Å; F850-C871 HydrophobicContact CZ-CB 3.79Å
851	H	90	Very high	87.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.6	161.7	-56.6	128.3	0	0	0	109.5	C828 C831 N833 Y836 S838 E853 C854 H855	C828-H851 WeakPolarHBondContact CB-CE1 3.43Å; C828-H851 VanDerWaalsContact CB-ND1 3.28Å; C828-H851 WeakPolarHBondContact CB-ND1 3.24Å; C828-H851 PolarHBondContact SG-N 3.32Å; C831-H851 VanDerWaalsContact SG-CE1 3.55Å; C831-H851 PolarHBondContact SG-ND1 3.46Å; C831-H851 VanDerWaalsContact SG-ND1 3.38Å; N833-H851 PolarHBondContact O-CE1 2.9Å; N833-H851 PolarHBondContact O-NE2 3.37Å; Y836-H851 WeakPolarHBondContact CB-CE1 3.34Å; Y836-H851 WeakPolarHBondContact CB-ND1 3.04Å; Y836-H851 HydrophobicContact CD1-CB 4.02Å; Y836-H851 AromaticContact CD1-CG 3.82Å; Y836-H851 AromaticContact CD1-ND1 3.68Å; Y836-H851 AromaticContact CG-CE1 3.98Å; Y836-H851 AromaticContact CG-ND1 3.72Å; S838-H851 PolarHBondContact O-CD2 2.85Å; S838-H851 VanDerWaalsContact O-CD2 3.23Å; H851-E853 PolarHBondContact O-N 2.74Å; H851-E853 VanDerWaalsContact O-N 3.12Å; H851-C854 HydrophobicContact CB-CB 4.03Å; H851-C854 PolarHBondContact O-N 2.97Å; H851-H855 PolarHBondContact O-N 3.46Å
852	I	86.7	Confident	86.2	Confident	34 Å²	34	59.4 Å²	59.4	17%	0.174	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-37.9	178.2	-60.8	176.2	0	0	0	111.3	L859	I852-L859 HydrophobicContact CG2-CB 3.91Å; I852-L859 WeakPolarHBondContact CG2-O 3.41Å; I852-L859 PolarHBondContact O-N 2.92Å
853	E	85.9	Confident	85.3	Confident	70 Å²	70	58.8 Å²	58.8	33%	0.327	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-26.7	177.7	-65.7	163.4	-99.9	0	0	114.9	Y836 S838 H851	Y836-E853 HydrophobicContact CE1-CB 4.15Å; Y836-E853 WeakPolarHBondContact CE1-OE1 3.5Å; Y836-E853 PolarHBondContact OH-OE2 2.86Å; S838-E853 WeakPolarHBondContact CB-OE1 3.34Å; S838-E853 PolarHBondContact OG-OE1 3.12Å; H851-E853 PolarHBondContact O-N 2.74Å; H851-E853 VanDerWaalsContact O-N 3.12Å
854	C	90.4	Very high	84.2	Confident	18 Å²	18	62.7 Å²	62.7	12%	0.122	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-20.9	-175.7	-60.3	0	0	0	0	112.8	V830 H851	V830-C854 HydrophobicContact CB-CB 3.92Å; V830-C854 HydrophobicContact CG1-CB 3.94Å; V830-C854 WeakPolarHBondContact CG1-O 3.34Å; H851-C854 HydrophobicContact CB-CB 4.03Å; H851-C854 PolarHBondContact O-N 2.97Å
855	H	89.3	Confident	83.4	Confident	7 Å²	7	67.1 Å²	67.1	3%	0.032	33%	0.326	C	S	.	.	S	Bend	trans	-61.1	149.8	171	-171.3	-93.6	0	0	0	111.5	F850 H851 P857 K858 L859 W869 C871 A872	F850-H855 HydrophobicContact CB-CB 4.37Å; H851-H855 PolarHBondContact O-N 3.46Å; H855-P857 CarbonylContact C-O 3.44Å; H855-P857 PolarHBondContact ND1-O 3.4Å; H855-P857 CarbonylContact O-C 3.48Å; H855-K858 WeakPolarHBondContact O-CA 3.09Å; H855-K858 PolarHBondContact O-N 3Å; H855-L859 HydrophobicContact CB-CD1 3.65Å; H855-L859 HydrophobicContact CB-CG 3.85Å; H855-L859 WeakPolarHBondContact ND1-CD2 3.31Å; H855-L859 WeakPolarHBondContact ND1-CG 3.47Å; H855-W869 AromaticContact CD2-CH2 3.56Å; H855-W869 AromaticContact CD2-CZ2 3.56Å; H855-W869 AromaticContact CE1-CZ2 3.99Å; H855-W869 AromaticContact NE2-CH2 3.81Å; H855-W869 AromaticContact NE2-CZ2 3.49Å; H855-W869 WeakPolarHBondContact NE2-CZ2 3.43Å; H855-C871 VanDerWaalsContact NE2-CA 3.3Å; H855-C871 WeakPolarHBondContact NE2-CA 3.44Å; H855-C871 WeakPolarHBondContact NE2-CB 3.4Å; H855-A872 PolarHBondContact CE1-N 3.13Å; H855-A872 PolarHBondContact NE2-N 2.99Å
856	R	87.4	Confident	82.5	Confident	179 Å²	179	70.6 Å²	70.6	68%	0.675	35%	0.35	S	S	*	.	S	Bend	trans	-130.4	124.9	178.7	-64.4	-173.4	-178.1	85.9	-1.8	108.9	A872	R856-A872 WeakPolarHBondContact O-CB 3.17Å
857	P	85.8	Confident	81.8	Confident	101 Å²	101	75 Å²	75	66%	0.656	37%	0.373	S	S	*	.	S	Bend	cis	-57.2	153.6	-10.2	27.5	-35.8	0	0	0	111.7	H855 L859	H855-P857 CarbonylContact C-O 3.44Å; H855-P857 PolarHBondContact ND1-O 3.4Å; H855-P857 CarbonylContact O-C 3.48Å; P857-L859 PolarHBondContact O-N 3.37Å
858	K	85	Confident	81.3	Confident	138 Å²	138	76.9 Å²	76.9	60%	0.6	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-59.6	134.9	179	178.6	173.6	174.1	176.8	0	109.3	H855	H855-K858 WeakPolarHBondContact O-CA 3.09Å; H855-K858 PolarHBondContact O-N 3Å
859	L	82.6	Confident	81.1	Confident	25 Å²	25	75.9 Å²	75.9	13%	0.131	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-79.3	132.1	-176.5	-62.5	167.4	0	0	0	110	I841 I852 H855 P857 I863 W869	I841-L859 HydrophobicContact CG2-CD1 4.28Å; I852-L859 HydrophobicContact CG2-CB 3.91Å; I852-L859 WeakPolarHBondContact CG2-O 3.41Å; I852-L859 PolarHBondContact O-N 2.92Å; H855-L859 HydrophobicContact CB-CD1 3.65Å; H855-L859 HydrophobicContact CB-CG 3.85Å; H855-L859 WeakPolarHBondContact ND1-CD2 3.31Å; H855-L859 WeakPolarHBondContact ND1-CG 3.47Å; P857-L859 PolarHBondContact O-N 3.37Å; L859-I863 HydrophobicContact CB-CD1 3.89Å; L859-I863 HydrophobicContact CD1-CD1 3.47Å; L859-I863 VanDerWaalsContact CD1-CD1 3.47Å; L859-I863 HydrophobicContact CD2-CD1 4Å; L859-I863 HydrophobicContact CG-CD1 3.95Å; L859-W869 HydrophobicContact CD1-CH2 4.16Å; L859-W869 HydrophobicContact CD1-CZ2 3.43Å; L859-W869 VanDerWaalsContact CD1-CZ2 3.43Å; L859-W869 HydrophobicContact CD2-CZ2 4.09Å; L859-W869 HydrophobicContact CG-CZ2 4.37Å
860	E	71	Confident	81	Confident	177 Å²	177	76.3 Å²	76.3	83%	0.827	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-74.4	148.4	173.3	-63.1	-170.1	169.1	0	0	110.7	S862	E860-S862 VanDerWaalsContact C-N 3.32Å; E860-S862 PolarHBondContact O-N 3.23Å
861	E	63.1	Low	81.1	Confident	181 Å²	181	75.8 Å²	75.8	85%	0.846	38%	0.38	S	S	*	.	S	Bend	trans	-83.3	62.4	-155.4	-162.8	177.2	-168	0	0	114.2
862	S	62.6	Low	81.1	Confident	112 Å²	112	76.2 Å²	76.2	78%	0.783	38%	0.384	S	S	*	.			trans	-165.2	45.7	165	48	0	0	0	0	115.1	E860 D864	E860-S862 VanDerWaalsContact C-N 3.32Å; E860-S862 PolarHBondContact O-N 3.23Å; S862-D864 PolarHBondContact O-N 3.24Å; S862-D864 VanDerWaalsContact O-N 3.13Å
863	I	72.2	Confident	81.3	Confident	49 Å²	49	77.7 Å²	77.7	25%	0.251	40%	0.397	S	S	.	.			trans	-65.2	118	171.7	-55.1	171.7	0	0	0	110	I841 L859 R865 W869	I841-I863 HydrophobicContact CD1-CB 4.1Å; I841-I863 HydrophobicContact CD1-CD1 3.73Å; I841-I863 HydrophobicContact CD1-CG2 3.61Å; L859-I863 HydrophobicContact CB-CD1 3.89Å; L859-I863 HydrophobicContact CD1-CD1 3.47Å; L859-I863 VanDerWaalsContact CD1-CD1 3.47Å; L859-I863 HydrophobicContact CD2-CD1 4Å; L859-I863 HydrophobicContact CG-CD1 3.95Å; I863-R865 PolarHBondContact O-N 3.31Å; I863-R865 VanDerWaalsContact O-N 3.08Å; I863-W869 HydrophobicContact CD1-CG 4.48Å; I863-W869 HydrophobicContact CG2-CB 4.16Å; I863-W869 HydrophobicContact CG2-CG 4.12Å
864	D	69.4	Low	81.7	Confident	82 Å²	82	74.4 Å²	74.4	44%	0.439	38%	0.382	S	S	.	.			trans	-70	101.7	172.4	-174.5	-7.8	0	0	0	109.9	S862 S866 L867	S862-D864 PolarHBondContact O-N 3.24Å; S862-D864 VanDerWaalsContact O-N 3.13Å; D864-S866 VanDerWaalsContact CG-OG 3.27Å; D864-S866 PolarHBondContact O-N 3.05Å; D864-S866 WeakPolarHBondContact OD1-CA 3.48Å; D864-S866 VanDerWaalsContact OD1-CB 3.29Å; D864-S866 WeakPolarHBondContact OD1-CB 3.32Å; D864-S866 PolarHBondContact OD1-N 2.74Å; D864-S866 PolarHBondContact OD1-OG 2.82Å; D864-S866 PolarHBondContact OD2-OG 3.46Å; D864-L867 HydrophobicContact CB-CD1 4.3Å; D864-L867 HydrophobicContact CB-CG 4.34Å; D864-L867 PolarHBondContact O-N 3.08Å
865	R	74.3	Confident	81.7	Confident	157 Å²	157	78 Å²	78	59%	0.592	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	12	175.9	-47.3	-174	-158.7	162.7	8.4	113.9	D839 I863	D839-R865 VanDerWaalsContact CB-NH2 3.29Å; D839-R865 IonicContact OD2-CZ 3.34Å; D839-R865 VanDerWaalsContact OD2-CZ 3.27Å; D839-R865 IonicContact OD2-NH1 3.47Å; D839-R865 PolarHBondContact OD2-NH1 2.88Å; D839-R865 IonicContact OD2-NH2 3.06Å; D839-R865 PolarHBondContact OD2-NH2 3.16Å; I863-R865 PolarHBondContact O-N 3.31Å; I863-R865 VanDerWaalsContact O-N 3.08Å
866	S	73.9	Confident	81.7	Confident	73 Å²	73	84 Å²	84	51%	0.51	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-7	166.5	77	0	0	0	0	113.8	D864	D864-S866 VanDerWaalsContact CG-OG 3.27Å; D864-S866 PolarHBondContact O-N 3.05Å; D864-S866 WeakPolarHBondContact OD1-CA 3.48Å; D864-S866 VanDerWaalsContact OD1-CB 3.29Å; D864-S866 WeakPolarHBondContact OD1-CB 3.32Å; D864-S866 PolarHBondContact OD1-N 2.74Å; D864-S866 PolarHBondContact OD1-OG 2.82Å; D864-S866 PolarHBondContact OD2-OG 3.46Å
867	L	76.7	Confident	81.8	Confident	98 Å²	98	81.3 Å²	81.3	51%	0.513	43%	0.425	S	S	.	.	S	Bend	trans	-97.5	150.4	162.2	-66	177.1	0	0	0	109.6	D864	D864-L867 HydrophobicContact CB-CD1 4.3Å; D864-L867 HydrophobicContact CB-CG 4.34Å; D864-L867 PolarHBondContact O-N 3.08Å
868	P	84	Confident	81.7	Confident	52 Å²	52	78.6 Å²	78.6	34%	0.338	42%	0.415	S	S	.	.			trans	-67.5	135.9	174.2	28	-33.8	0	0	0	110.7	D844 V881	D844-P868 WeakPolarHBondContact OD2-CA 3.29Å; P868-V881 HydrophobicContact CB-CG1 4Å; P868-V881 HydrophobicContact CB-CG2 4.31Å; P868-V881 HydrophobicContact CG-CB 4.33Å; P868-V881 HydrophobicContact CG-CG1 3.59Å; P868-V881 HydrophobicContact CG-CG2 4.45Å
869	W	88.3	Confident	81.6	Confident	26 Å²	26	74.2 Å²	74.2	10%	0.098	40%	0.395	C	S	.	.			trans	-123.8	138.2	179.9	175.4	82.9	0	0	0	111.8	I841 C843 D844 F850 H855 L859 I863 C871	I841-W869 HydrophobicContact CB-CE3 4.47Å; I841-W869 HydrophobicContact CB-CZ3 4.46Å; I841-W869 HydrophobicContact CD1-CB 3.93Å; I841-W869 HydrophobicContact CD1-CD2 3.54Å; I841-W869 HydrophobicContact CD1-CE3 3.69Å; I841-W869 HydrophobicContact CD1-CG 3.64Å; I841-W869 HydrophobicContact CD1-CZ3 4.4Å; I841-W869 HydrophobicContact CG1-CD2 4.05Å; I841-W869 HydrophobicContact CG1-CE3 3.62Å; I841-W869 HydrophobicContact CG1-CZ3 4.08Å; I841-W869 HydrophobicContact CG2-CE3 4.13Å; I841-W869 HydrophobicContact CG2-CH2 3.89Å; I841-W869 HydrophobicContact CG2-CZ2 4.4Å; I841-W869 HydrophobicContact CG2-CZ3 3.75Å; C843-W869 HydrophobicContact CB-CE3 4.32Å; C843-W869 HydrophobicContact CB-CZ3 3.89Å; D844-W869 PolarHBondContact N-O 2.93Å; D844-W869 PolarHBondContact OD2-N 3.42Å; F850-W869 HydrophobicContact CB-CH2 4.25Å; F850-W869 AromaticContact CD2-CH2 3.78Å; F850-W869 HydrophobicContact CD2-CH2 3.78Å; F850-W869 AromaticContact CD2-CZ3 3.93Å; F850-W869 HydrophobicContact CD2-CZ3 3.93Å; F850-W869 HydrophobicContact CG-CH2 4.21Å; H855-W869 AromaticContact CD2-CH2 3.56Å; H855-W869 AromaticContact CD2-CZ2 3.56Å; H855-W869 AromaticContact CE1-CZ2 3.99Å; H855-W869 AromaticContact NE2-CH2 3.81Å; H855-W869 AromaticContact NE2-CZ2 3.49Å; H855-W869 WeakPolarHBondContact NE2-CZ2 3.43Å; L859-W869 HydrophobicContact CD1-CH2 4.16Å; L859-W869 HydrophobicContact CD1-CZ2 3.43Å; L859-W869 VanDerWaalsContact CD1-CZ2 3.43Å; L859-W869 HydrophobicContact CD2-CZ2 4.09Å; L859-W869 HydrophobicContact CG-CZ2 4.37Å; I863-W869 HydrophobicContact CD1-CG 4.48Å; I863-W869 HydrophobicContact CG2-CB 4.16Å; I863-W869 HydrophobicContact CG2-CG 4.12Å; W869-C871 HydrophobicContact CH2-CB 3.51Å; W869-C871 HydrophobicContact CZ2-CB 4.06Å; W869-C871 HydrophobicContact CZ3-CB 4.03Å
870	V	91.1	Very high	81	Confident	10 Å²	10	81.1 Å²	81.1	6%	0.061	42%	0.419	C	S	.	.			trans	-124.2	130.7	-176	176.6	0	0	0	0	108.5	A845 C874 Q875 Y879 V881	A845-V870 HydrophobicContact CB-CB 4.49Å; A845-V870 HydrophobicContact CB-CG1 3.81Å; A845-V870 HydrophobicContact CB-CG2 4.02Å; V870-C874 HydrophobicContact CG1-CB 3.4Å; V870-C874 VanDerWaalsContact CG1-CB 3.4Å; V870-Q875 HydrophobicContact CB-CG 4.33Å; V870-Q875 HydrophobicContact CG1-CG 3.94Å; V870-Q875 PolarHBondContact O-NE2 3.42Å; V870-Y879 HydrophobicContact CG1-CD1 3.96Å; V870-Y879 HydrophobicContact CG2-CD1 3.88Å; V870-Y879 HydrophobicContact CG2-CE1 3.97Å; V870-V881 HydrophobicContact CG2-CG2 3.34Å
871	C	92.9	Very high	80.6	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.014	39%	0.391	C	S	.	.			trans	-70.6	158.4	177.8	69.6	0	0	0	0	111.9	C843 F850 H855 W869 S873 C874 Q875	C843-C871 HydrophobicContact CB-CB 4.03Å; C843-C871 PolarHBondContact SG-N 3.31Å; F850-C871 HydrophobicContact CD2-CB 3.91Å; F850-C871 HydrophobicContact CE2-CB 3.42Å; F850-C871 VanDerWaalsContact CE2-CB 3.42Å; F850-C871 HydrophobicContact CZ-CB 3.79Å; H855-C871 VanDerWaalsContact NE2-CA 3.3Å; H855-C871 WeakPolarHBondContact NE2-CA 3.44Å; H855-C871 WeakPolarHBondContact NE2-CB 3.4Å; W869-C871 HydrophobicContact CH2-CB 3.51Å; W869-C871 HydrophobicContact CZ2-CB 4.06Å; W869-C871 HydrophobicContact CZ3-CB 4.03Å; C871-S873 VanDerWaalsContact C-N 3.34Å; C871-S873 PolarHBondContact O-N 2.67Å; C871-C874 PolarHBondContact O-N 2.76Å; C871-C874 VanDerWaalsContact SG-SG 3.66Å; C871-Q875 PolarHBondContact O-N 2.86Å
872	A	90.7	Very high	80.2	Confident	9 Å²	9	68.1 Å²	68.1	7%	0.074	37%	0.369	C	S	.	.	H	α-helix	trans	-54.3	-47	-175.8	0	0	0	0	0	112.4	H855 R856 C874 Q875 D876	H855-A872 PolarHBondContact CE1-N 3.13Å; H855-A872 PolarHBondContact NE2-N 2.99Å; R856-A872 WeakPolarHBondContact O-CB 3.17Å; A872-C874 PolarHBondContact O-N 3.39Å; A872-C874 VanDerWaalsContact O-N 3.11Å; A872-Q875 CarbonylContact O-C 3.59Å; A872-Q875 WeakPolarHBondContact O-CA 3.39Å; A872-Q875 WeakPolarHBondContact O-CB 3.45Å; A872-Q875 PolarHBondContact O-N 3.3Å; A872-D876 WeakPolarHBondContact O-CB 3.46Å; A872-D876 PolarHBondContact O-N 2.87Å; A872-D876 VanDerWaalsContact O-OD2 3.11Å
873	S	91.7	Very high	79.3	Confident	65 Å²	65	69 Å²	69	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-50.2	-42.9	176.7	-50.9	0	0	0	0	112.3	C871 D876 E877	C871-S873 VanDerWaalsContact C-N 3.34Å; C871-S873 PolarHBondContact O-N 2.67Å; S873-D876 PolarHBondContact O-N 2.8Å; S873-E877 WeakPolarHBondContact O-CB 3.28Å; S873-E877 VanDerWaalsContact O-CD 3.23Å; S873-E877 WeakPolarHBondContact O-CG 3.45Å; S873-E877 PolarHBondContact O-N 3.09Å
874	C	93.6	Very high	77.4	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.014	36%	0.361	C	S	.	.	H	α-helix	trans	-75.4	-32.1	177	-63.6	0	0	0	0	113.1	R814 A845 C846 V870 C871 A872 D876 E877 Y879	R814-C874 PolarHBondContact NH2-SG 2.8Å; R814-C874 VanDerWaalsContact NH2-SG 3.39Å; A845-C874 HydrophobicContact CB-CB 3.84Å; C846-C874 PolarHBondContact SG-SG 3.34Å; V870-C874 HydrophobicContact CG1-CB 3.4Å; V870-C874 VanDerWaalsContact CG1-CB 3.4Å; C871-C874 PolarHBondContact O-N 2.76Å; C871-C874 VanDerWaalsContact SG-SG 3.66Å; A872-C874 PolarHBondContact O-N 3.39Å; A872-C874 VanDerWaalsContact O-N 3.11Å; C874-D876 VanDerWaalsContact C-N 3.33Å; C874-E877 PolarHBondContact SG-OE2 3.05Å; C874-Y879 WeakPolarHBondContact O-CA 3.29Å; C874-Y879 WeakPolarHBondContact O-CB 3.47Å; C874-Y879 PolarHBondContact O-N 3.1Å
875	Q	89.4	Confident	75.6	Confident	93 Å²	93	68.8 Å²	68.8	44%	0.435	37%	0.371	S	S	.	.	H	α-helix	trans	-65.9	-36.8	170.2	-60	-178.7	30.2	0	0	111.8	V870 C871 A872 G878 R880	V870-Q875 HydrophobicContact CB-CG 4.33Å; V870-Q875 HydrophobicContact CG1-CG 3.94Å; V870-Q875 PolarHBondContact O-NE2 3.42Å; C871-Q875 PolarHBondContact O-N 2.86Å; A872-Q875 CarbonylContact O-C 3.59Å; A872-Q875 WeakPolarHBondContact O-CA 3.39Å; A872-Q875 WeakPolarHBondContact O-CB 3.45Å; A872-Q875 PolarHBondContact O-N 3.3Å; Q875-G878 PolarHBondContact O-N 3.3Å; Q875-G878 VanDerWaalsContact O-N 3.16Å; Q875-R880 PolarHBondContact O-NH1 2.87Å; Q875-R880 PolarHBondContact O-NH2 3.22Å
876	D	89.2	Confident	73.6	Confident	134 Å²	134	68.7 Å²	68.7	72%	0.717	38%	0.382	S	S	*	.	H	α-helix	trans	-72.6	-37.9	177.9	-60	-33.5	0	0	0	110.9	A872 S873 C874 G878	A872-D876 WeakPolarHBondContact O-CB 3.46Å; A872-D876 PolarHBondContact O-N 2.87Å; A872-D876 VanDerWaalsContact O-OD2 3.11Å; S873-D876 PolarHBondContact O-N 2.8Å; C874-D876 VanDerWaalsContact C-N 3.33Å; D876-G878 PolarHBondContact O-N 2.77Å
877	E	89.5	Confident	71.5	Confident	122 Å²	122	70.7 Å²	70.7	57%	0.57	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	0.9	166.3	-71.9	155.8	-154.5	0	0	113.5	R814 S873 C874 Y879	R814-E877 IonicContact CZ-OE2 3.26Å; R814-E877 IonicContact NE-OE2 2.7Å; R814-E877 IonicContact NH2-OE2 3.19Å; R814-E877 PolarHBondContact NH2-OE2 3.21Å; S873-E877 WeakPolarHBondContact O-CB 3.28Å; S873-E877 VanDerWaalsContact O-CD 3.23Å; S873-E877 WeakPolarHBondContact O-CG 3.45Å; S873-E877 PolarHBondContact O-N 3.09Å; C874-E877 PolarHBondContact SG-OE2 3.05Å; E877-Y879 VanDerWaalsContact C-N 3.34Å; E877-Y879 PolarHBondContact O-N 3.11Å
878	G	84	Confident	69.3	Low	43 Å²	43	71.7 Å²	71.7	44%	0.443	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-0.5	178.5	0	0	0	0	0	114.9	Q875 D876 R880	Q875-G878 PolarHBondContact O-N 3.3Å; Q875-G878 VanDerWaalsContact O-N 3.16Å; D876-G878 PolarHBondContact O-N 2.77Å; G878-R880 VanDerWaalsContact C-NH1 3.29Å; G878-R880 PolarHBondContact O-N 3.18Å; G878-R880 PolarHBondContact O-NH1 2.71Å
879	Y	83.4	Confident	66.8	Low	47 Å²	47	72.1 Å²	72.1	18%	0.184	42%	0.422	C	S	.	.			trans	-64.2	128.6	179.4	-165.6	-92.4	0	0	0	111.3	W808 E810 A845 V870 C874 E877 V881	W808-Y879 WeakPolarHBondContact CZ2-OH 3.36Å; E810-Y879 WeakPolarHBondContact OE1-CD2 3.47Å; E810-Y879 VanDerWaalsContact OE1-CE2 3.23Å; E810-Y879 WeakPolarHBondContact OE1-CE2 3.31Å; E810-Y879 WeakPolarHBondContact OE2-CE2 3.2Å; A845-Y879 HydrophobicContact CB-CD1 3.44Å; A845-Y879 VanDerWaalsContact CB-CD1 3.44Å; A845-Y879 HydrophobicContact CB-CD2 4.32Å; A845-Y879 HydrophobicContact CB-CE1 3.51Å; A845-Y879 HydrophobicContact CB-CE2 4.4Å; A845-Y879 HydrophobicContact CB-CG 3.86Å; V870-Y879 HydrophobicContact CG1-CD1 3.96Å; V870-Y879 HydrophobicContact CG2-CD1 3.88Å; V870-Y879 HydrophobicContact CG2-CE1 3.97Å; C874-Y879 WeakPolarHBondContact O-CA 3.29Å; C874-Y879 WeakPolarHBondContact O-CB 3.47Å; C874-Y879 PolarHBondContact O-N 3.1Å; E877-Y879 VanDerWaalsContact C-N 3.34Å; E877-Y879 PolarHBondContact O-N 3.11Å; Y879-V881 HydrophobicContact CE1-CG2 4.22Å
880	R	69.2	Low	64.2	Low	169 Å²	169	78 Å²	78	64%	0.638	46%	0.456	S	S	*	.			trans	-125.8	132.3	176.9	-57.9	-65.6	170.2	-96.8	2.6	107.9	Q875 G878	Q875-R880 PolarHBondContact O-NH1 2.87Å; Q875-R880 PolarHBondContact O-NH2 3.22Å; G878-R880 VanDerWaalsContact C-NH1 3.29Å; G878-R880 PolarHBondContact O-N 3.18Å; G878-R880 PolarHBondContact O-NH1 2.71Å
881	V	63.6	Low	61.4	Low	39 Å²	39	81.3 Å²	81.3	24%	0.236	47%	0.473	C	S	.	.			trans	-80.6	128	166.9	-162.8	0	0	0	0	108.4	P868 V870 Y879 I883 M1154	P868-V881 HydrophobicContact CB-CG1 4Å; P868-V881 HydrophobicContact CB-CG2 4.31Å; P868-V881 HydrophobicContact CG-CB 4.33Å; P868-V881 HydrophobicContact CG-CG1 3.59Å; P868-V881 HydrophobicContact CG-CG2 4.45Å; V870-V881 HydrophobicContact CG2-CG2 3.34Å; Y879-V881 HydrophobicContact CE1-CG2 4.22Å; V881-I883 VanDerWaalsContact C-N 3.33Å; V881-I883 PolarHBondContact O-N 3.28Å; V881-M1154 HydrophobicContact CG1-CE 4.26Å
882	A	54.3	Low	58.5	Low	46 Å²	46	89.7 Å²	89.7	38%	0.38	52%	0.518	S	S	.	.			trans	-64.5	94.5	164.9	0	0	0	0	0	109	G884 M1154	A882-G884 PolarHBondContact O-N 3.14Å; A882-G884 VanDerWaalsContact O-N 3.14Å; A882-M1154 HydrophobicContact CB-CG 4.19Å
883	I	43	Very low	55.8	Low	130 Å²	130	95 Å²	95	67%	0.667	54%	0.541	S	S	*	.			trans	-78.4	97.9	171.6	-60.1	179.3	0	0	0	107.4	V881 T885	V881-I883 VanDerWaalsContact C-N 3.33Å; V881-I883 PolarHBondContact O-N 3.28Å; I883-T885 PolarHBondContact O-N 2.84Å
884	G	34.1	Very low	53	Low	20 Å²	20	100 Å²	100	21%	0.206	56%	0.563	C	S	.	*			trans	-60	119.3	179.6	0	0	0	0	0	115.3	A882 L886 T1158	A882-G884 PolarHBondContact O-N 3.14Å; A882-G884 VanDerWaalsContact O-N 3.14Å; G884-L886 PolarHBondContact O-N 3.38Å; G884-T1158 VanDerWaalsContact CA-CB 3.45Å
885	T	31	Very low	50	Low	107 Å²	107	109.7 Å²	109.7	66%	0.656	60%	0.6	S	S	*	*				51.3	30.9	127	-20.4	0	0	0	0	117.6	I883 T1158	I883-T885 PolarHBondContact O-N 2.84Å; T885-T1158 PolarHBondContact OG1-O 3.41Å
886	L	32.4	Very low	47.3	Very low	155 Å²	155	111.3 Å²	111.3	81%	0.812	62%	0.622	S	S	*	*			trans	-80.1	129.5	153.4	-81.3	173.6	0	0	0	108.3	G884	G884-L886 PolarHBondContact O-N 3.38Å
887	P	29.2	Very low	44.5	Very low	116 Å²	116	110.5 Å²	110.5	75%	0.753	63%	0.627	S	S	*	*			trans	-73.1	145	-165.1	28.7	-36	0	0	0	112.6	G889	P887-G889 PolarHBondContact O-N 3.15Å
888	S	31.4	Very low	41.9	Very low	119 Å²	119	109.7 Å²	109.7	83%	0.832	63%	0.632	S	S	*	*			trans	-59.7	103.3	167.5	-53.4	0	0	0	0	110.8
889	G	31.2	Very low	39.4	Very low	60 Å²	60	115.2 Å²	115.2	62%	0.619	65%	0.652	S	S	*	*			trans	-140.1	120.8	170.5	0	0	0	0	0	109.2	P887	P887-G889 PolarHBondContact O-N 3.15Å
890	N	33.4	Very low	37	Very low	151 Å²	151	121.6 Å²	121.6	81%	0.807	68%	0.68	S	S	*	*			cis	-108.9	132.5	9.6	-74.5	-46.3	0	0	0	111.5
891	N	32.7	Very low	35.1	Very low	79 Å²	79	119.1 Å²	119.1	42%	0.422	68%	0.684	S	S	.	*				60.1	93.1	70.1	-64.8	-52.9	0	0	0	112.9	Q893	N891-Q893 HydrophobicContact CB-CG 4.29Å; N891-Q893 WeakPolarHBondContact OD1-CG 3.48Å; N891-Q893 PolarHBondContact OD1-NE2 3.01Å
892	N	32.4	Very low	33.6	Very low	178 Å²	178	124.3 Å²	124.3	95%	0.952	70%	0.704	S	S	*	*				-109.4	109.3	121.6	-95	-23.5	0	0	0	106.3
893	Q	33.3	Very low	32.4	Very low	121 Å²	121	129.2 Å²	129.2	57%	0.565	72%	0.718	S	S	*	*			trans	-91.9	144.4	176.7	-62.6	-178	0.9	0	0	109.8	N891	N891-Q893 HydrophobicContact CB-CG 4.29Å; N891-Q893 WeakPolarHBondContact OD1-CG 3.48Å; N891-Q893 PolarHBondContact OD1-NE2 3.01Å
894	N	33	Very low	31.9	Very low	170 Å²	170	127.3 Å²	127.3	91%	0.909	72%	0.717	S	S	*	*			trans	-148.1	90.3	147.9	-100.6	-30.1	0	0	0	108.4
895	Y	29.4	Very low	31.9	Very low	204 Å²	204	132.7 Å²	132.7	80%	0.8	74%	0.741	S	S	*	*			trans	-74.5	126.3	170	-85.6	-89.7	0	0	0	109.7
896	S	33.9	Very low	32.2	Very low	127 Å²	127	133.2 Å²	133.2	89%	0.888	74%	0.74	S	S	*	*			trans	-156.9	109.9	152.1	-83.4	0	0	0	0	110.7
897	S	29.5	Very low	32.5	Very low	118 Å²	118	132.9 Å²	132.9	83%	0.825	74%	0.739	S	S	*	*			trans	-153.8	163.9	170.5	-135.2	0	0	0	0	106.3
898	P	35.3	Very low	33.1	Very low	104 Å²	104	133.4 Å²	133.4	68%	0.675	73%	0.734	S	S	*	*			cis	-126.2	173.8	1.6	41.4	-28.4	0	0	0	113.4
899	N	32.3	Very low	33.4	Very low	160 Å²	160	134.9 Å²	134.9	86%	0.856	73%	0.73	S	S	*	*				-167.1	156.1	128.9	-111.8	-39.6	0	0	0	114
900	K	31.5	Very low	33.7	Very low	181 Å²	181	139.8 Å²	139.8	79%	0.787	73%	0.734	S	S	*	*			trans	-71.5	159.7	159.7	-60.7	174.3	178.5	175	0	107.8
901	T	29.7	Very low	33.8	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	73%	0.732	S	S	*	*			cis	-168.1	161.1	34.3	-26.6	0	0	0	0	109.8
902	K	32.7	Very low	34	Very low	148 Å²	148	139.8 Å²	139.8	64%	0.643	74%	0.744	S	S	*	*			trans	71.2	148.1	154.8	-73.8	173.1	148.2	-74.1	0	119.1
903	E	28.8	Very low	33.9	Very low	148 Å²	148	138 Å²	138	69%	0.692	73%	0.734	S	S	*	*			trans	32.6	131.4	140	-66.8	124.7	-133.8	0	0	119.1
904	S	33.7	Very low	33.8	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	74%	0.74	S	S	*	*			cis	-178.6	158	7.1	50.4	0	0	0	0	109.9
905	N	33	Very low	33.6	Very low	133 Å²	133	138.1 Å²	138.1	71%	0.711	73%	0.727	S	S	*	*			trans	65.5	156.4	159.7	-68.3	41.9	0	0	0	116.2
906	D	37.1	Very low	33.7	Very low	118 Å²	118	135.5 Å²	135.5	63%	0.631	73%	0.725	S	S	*	*			cis	-153.2	163	-20.2	-90	-27.1	0	0	0	106.9
907	D	39.2	Very low	33.4	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	72%	0.72	S	S	*	*			trans	62.7	154.9	151.6	-77	-19.4	0	0	0	120.8
908	L	41.1	Very low	33.2	Very low	127 Å²	127	135.6 Å²	135.6	67%	0.665	72%	0.715	S	S	*	*			cis	-170.2	131.9	-19.1	173.4	65.5	0	0	0	109.9
909	M	39.3	Very low	33	Very low	150 Å²	150	134.8 Å²	134.8	74%	0.739	71%	0.711	S	S	*	*			trans	62.9	163.3	166.7	-63.2	-101.2	168.7	0	0	115.8
910	K	37.5	Very low	32.7	Very low	164 Å²	164	137.2 Å²	137.2	71%	0.713	71%	0.71	S	S	*	*			cis	-147.4	150.5	2.4	-145.6	157.1	-173.6	173.4	0	112.4
911	T	35.3	Very low	32.8	Very low	125 Å²	125	136 Å²	136	77%	0.767	71%	0.707	S	S	*	*			trans	-102.5	-165.9	168.7	52.7	0	0	0	0	110
912	P	36.8	Very low	32.8	Very low	104 Å²	104	139 Å²	139	68%	0.675	71%	0.706	S	S	*	*				-124.2	-169.6	-68.5	32.9	-15.3	0	0	0	112
913	L	29.5	Very low	32.6	Very low	140 Å²	140	138.1 Å²	138.1	73%	0.733	71%	0.708	S	S	*	*			trans	140	122.4	133.1	-71.7	-173.4	0	0	0	116.5
914	K	31.2	Very low	32.7	Very low	157 Å²	157	138.2 Å²	138.2	68%	0.683	71%	0.706	S	S	*	*				57.5	135.1	128.6	-74.1	-179.5	155.1	-135.6	0	124.5
915	E	28.7	Very low	32.4	Very low	137 Å²	137	138.3 Å²	138.3	64%	0.64	70%	0.702	S	S	*	*				88.6	144.8	129.7	-80.2	165.5	-150.3	0	0	122.4
916	I	32.6	Very low	32.3	Very low	150 Å²	150	139.7 Å²	139.7	77%	0.769	71%	0.705	S	S	*	*			trans	61.2	95.8	166.4	-55.8	146	0	0	0	114.2
917	N	25.8	Very low	31.9	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	71%	0.705	S	S	*	*				73.6	122.4	52.9	-159.1	24.2	0	0	0	114.2
918	S	27	Very low	31.5	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	70%	0.704	S	S	*	*			trans	56.8	164.5	-174	81.7	0	0	0	0	115.2
919	S	29.8	Very low	30.8	Very low	86 Å²	86	140.7 Å²	140.7	60%	0.601	70%	0.704	S	S	*	*			cis	-155.6	163.8	11.1	-10.5	0	0	0	0	111.5
920	Y	27.5	Very low	30.3	Very low	212 Å²	212	140.7 Å²	140.7	83%	0.831	70%	0.703	S	S	*	*			trans	15.1	153.1	144.6	-54.1	-65.9	0	0	0	121.2
921	E	33	Very low	29.9	Very low	156 Å²	156	139.2 Å²	139.2	73%	0.729	70%	0.701	S	S	*	*			cis	170.7	169.9	-9.7	-178.1	179.4	-139.7	0	0	105.2
922	Y	29.2	Very low	29.6	Very low	179 Å²	179	140.1 Å²	140.1	70%	0.702	70%	0.701	S	S	*	*			trans	70.3	164.9	158.1	-128.9	-155	0	0	0	112.6
923	I	29.6	Very low	29.2	Very low	130 Å²	130	144.8 Å²	144.8	67%	0.667	71%	0.714	S	S	*	*			cis	-130	135.4	13.6	-65	-171.8	0	0	0	105.9
924	K	29.4	Very low	29.2	Very low	150 Å²	150	143.9 Å²	143.9	65%	0.652	72%	0.72	S	S	*	*				43.5	134.3	102.1	-128.2	-172	173.7	-169.8	0	112.7
925	T	28.5	Very low	29.1	Very low	92 Å²	92	139.7 Å²	139.7	56%	0.564	72%	0.721	S	S	*	*				-170.7	145.6	58.7	41.7	0	0	0	0	111.9
926	E	29.8	Very low	29.1	Very low	163 Å²	163	139.3 Å²	139.3	76%	0.762	73%	0.728	S	S	*	*			trans	66.1	159.9	136.3	-66.2	170.8	-140.4	0	0	118.8
927	S	28.4	Very low	29.1	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	73%	0.729	S	S	*	*			cis	-166.6	160.9	-19	-101.7	0	0	0	0	110.2
928	K	31.2	Very low	29.5	Very low	179 Å²	179	141.3 Å²	141.3	78%	0.778	73%	0.729	S	S	*	*			trans	71.9	126.9	165.7	-69.5	169.3	-177.5	-179.5	0	116
929	Q	27.5	Very low	29.9	Very low	143 Å²	143	141.9 Å²	141.9	67%	0.668	72%	0.724	S	S	*	*				71.9	110.5	68.4	-82.5	-170.9	-68.2	0	0	111.6
930	E	27.4	Very low	30.1	Very low	151 Å²	151	144.3 Å²	144.3	71%	0.706	73%	0.729	S	S	*	*				86.3	144.3	101.1	-88.1	175	-132.7	0	0	111.8
931	I	30.2	Very low	30.5	Very low	132 Å²	132	140.3 Å²	140.3	68%	0.677	72%	0.721	S	S	*	*			cis	-138.9	158.8	8.7	-61.2	-173.5	0	0	0	110.2
932	N	28.6	Very low	30.8	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	72%	0.722	S	S	*	*			trans	-15.1	148.3	161.4	-33.7	-29.6	0	0	0	119.7
933	E	27.7	Very low	31.1	Very low	202 Å²	202	137.7 Å²	137.7	94%	0.944	72%	0.724	S	S	*	*			trans	-119.7	104.5	144.5	-89.4	-151.9	122.6	0	0	111.7
934	S	29.7	Very low	31.4	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	72%	0.723	S	S	*	*	S	Bend	trans	-161.8	71.5	150.3	68.9	0	0	0	0	110.7
935	G	30.1	Very low	31.5	Very low	69 Å²	69	137.7 Å²	137.7	71%	0.711	73%	0.731	S	S	*	*	S	Bend	trans	147.3	96.1	165.6	0	0	0	0	0	117.8
936	V	29.4	Very low	31.6	Very low	128 Å²	128	138 Å²	138	78%	0.776	74%	0.736	S	S	*	*			trans	76.7	134	140.5	-172.6	0	0	0	0	119.2
937	E	31.7	Very low	31.7	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.804	74%	0.738	S	S	*	*			trans	73.5	91.4	160.3	-79.2	158.6	-157.3	0	0	121.6
938	E	34.5	Very low	32.3	Very low	166 Å²	166	136 Å²	136	78%	0.776	74%	0.738	S	S	*	*				81.1	120.3	122.8	-74.4	-146.8	137.1	0	0	123.7
939	N	34.9	Very low	32.2	Very low	114 Å²	114	135.4 Å²	135.4	61%	0.61	74%	0.738	S	S	*	*			trans	93	108.4	130.7	-75.5	-35.4	0	0	0	122.6
940	I	34.7	Very low	32.1	Very low	136 Å²	136	133 Å²	133	70%	0.697	74%	0.737	S	S	*	*				99.7	100.8	122.5	-72.5	171.6	0	0	0	120.4
941	I	34.9	Very low	32.2	Very low	129 Å²	129	131.6 Å²	131.6	66%	0.662	74%	0.739	S	S	*	*			trans	88.8	105.5	132.4	-71.2	-176.8	0	0	0	122.1
942	K	38.8	Very low	32.2	Very low	173 Å²	173	131.5 Å²	131.5	75%	0.752	74%	0.744	S	S	*	*				65.7	121.6	128.3	-61.3	-175.6	-169.3	176.3	0	121.2
943	S	37.3	Very low	32.4	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	74%	0.738	S	S	*	*				84.7	152.5	80.2	-51	0	0	0	0	113
944	V	35.9	Very low	32.7	Very low	108 Å²	108	127 Å²	127	66%	0.655	74%	0.735	S	S	*	*			cis	-170.7	151.5	0.5	111.8	0	0	0	0	110.6
945	E	31.4	Very low	32.8	Very low	173 Å²	173	128.6 Å²	128.6	81%	0.808	73%	0.729	S	S	*	*			trans	54.1	176.7	154.8	-71.3	164.1	-170.8	0	0	120.2
946	S	30.4	Very low	33	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	73%	0.727	S	S	*	*			cis	-162.9	148.4	-45.3	64.7	0	0	0	0	113
947	S	31.3	Very low	33.1	Very low	113 Å²	113	130.7 Å²	130.7	79%	0.79	72%	0.723	S	S	*	*			trans	63.9	-166.3	142.6	-137.2	0	0	0	0	118.1
948	P	41.6	Very low	33.2	Very low	99 Å²	99	127.8 Å²	127.8	64%	0.643	72%	0.717	S	S	*	*				-134.5	-157.8	-102.6	44.2	-25.2	0	0	0	116.2
949	H	27.9	Very low	33.1	Very low	165 Å²	165	125.5 Å²	125.5	76%	0.764	72%	0.715	S	S	*	*			trans	82.5	98.9	160.4	-75.2	-57.9	0	0	0	122.6
950	S	26.1	Very low	33.2	Very low	94 Å²	94	125.5 Å²	125.5	66%	0.657	72%	0.719	S	S	*	*				83	147.2	107.1	82.9	0	0	0	0	124.8
951	T	29.2	Very low	33.2	Very low	121 Å²	121	123.5 Å²	123.5	74%	0.742	72%	0.717	S	S	*	*			trans	83.5	140	143.5	-25	0	0	0	0	121.8
952	V	30.3	Very low	33.2	Very low	130 Å²	130	123.9 Å²	123.9	79%	0.788	72%	0.721	S	S	*	*			trans	67.7	131.8	167.4	-159.5	0	0	0	0	116.7
953	G	32.7	Very low	32.9	Very low	63 Å²	63	121.2 Å²	121.2	65%	0.649	72%	0.719	S	S	*	*			cis	156.5	179.7	-7.6	0	0	0	0	0	113
954	Q	35	Very low	32.7	Very low	187 Å²	187	123.6 Å²	123.6	87%	0.874	72%	0.722	S	S	*	*			trans	72.6	147.8	165.8	-69.1	-176.7	17.4	0	0	117.1
955	H	31.1	Very low	32.4	Very low	157 Å²	157	123.2 Å²	123.2	73%	0.727	72%	0.723	S	S	*	*			cis	-171.7	167.6	-4.3	170.1	-139	0	0	0	111.4
956	L	34.8	Very low	32.5	Very low	127 Å²	127	122.1 Å²	122.1	67%	0.665	72%	0.722	S	S	*	*			trans	65.5	113.7	-172.5	-84.7	58.5	0	0	0	114.8
957	T	31.4	Very low	32.6	Very low	113 Å²	113	125.9 Å²	125.9	69%	0.693	73%	0.729	S	S	*	*				78.9	146.8	53.3	75.8	0	0	0	0	113.9
958	T	33.9	Very low	32.7	Very low	112 Å²	112	128.6 Å²	128.6	69%	0.687	74%	0.735	S	S	*	*			cis	-161	138.5	26.3	-13.5	0	0	0	0	112.5
959	T	31.7	Very low	32.1	Very low	117 Å²	117	133.2 Å²	133.2	72%	0.718	75%	0.745	S	S	*	*			trans	63.4	136.3	131.5	-58.8	0	0	0	0	120.2
960	T	36.3	Very low	32.5	Very low	115 Å²	115	130.7 Å²	130.7	71%	0.706	74%	0.743	S	S	*	*			cis	-150.3	138.6	9.1	9.2	0	0	0	0	108
961	S	36.1	Very low	32.7	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	74%	0.742	S	S	*	*				69.1	147.1	78	-47.9	0	0	0	0	115.8
962	N	33	Very low	32.5	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	75%	0.745	S	S	*	*			cis	-160.2	145	-18.6	-99.7	-18.3	0	0	0	107.3
963	T	33.6	Very low	32.6	Very low	116 Å²	116	132.1 Å²	132.1	71%	0.712	74%	0.744	S	S	*	*				91.7	143.3	51.2	-42.7	0	0	0	0	114.1
964	I	33.2	Very low	32.4	Very low	157 Å²	157	136.2 Å²	136.2	81%	0.805	75%	0.751	S	S	*	*			trans	103.9	136.1	162.3	-54.2	-174.3	0	0	0	117.7
965	C	29.5	Very low	32.1	Very low	100 Å²	100	131.9 Å²	131.9	68%	0.676	74%	0.741	S	S	*	*			trans	-112.8	170.4	-177.1	-32.8	0	0	0	0	111.2
966	N	33.1	Very low	32	Very low	149 Å²	149	130.3 Å²	130.3	80%	0.797	74%	0.743	S	S	*	*				174	159.7	121.7	-85.7	-24.8	0	0	0	112.1
967	E	31.8	Very low	32	Very low	178 Å²	178	128 Å²	128	83%	0.832	75%	0.749	S	S	*	*			trans	-87.5	158.6	177.6	-55.5	178.5	151.9	0	0	112.3
968	N	34.5	Very low	32.1	Very low	169 Å²	169	131 Å²	131	90%	0.904	76%	0.755	S	S	*	*			trans	-169.4	145.2	138.4	-97.1	-32.4	0	0	0	112.1
969	F	28.2	Very low	32.2	Very low	197 Å²	197	130.2 Å²	130.2	86%	0.864	75%	0.754	S	S	*	*			trans	-85.4	179.1	168.2	-86.9	-89.4	0	0	0	110.9
970	P	36.7	Very low	32.4	Very low	112 Å²	112	129 Å²	129	73%	0.727	75%	0.751	S	S	*	*			cis	-132.1	-164.3	-16.2	30.1	-7.2	0	0	0	113.4
971	A	29.8	Very low	32.3	Very low	77 Å²	77	129.3 Å²	129.3	64%	0.636	75%	0.752	S	S	*	*			trans	84.4	110.7	141.6	0	0	0	0	0	121.7
972	D	26.8	Very low	32.2	Very low	150 Å²	150	130.5 Å²	130.5	80%	0.802	76%	0.755	S	S	*	*			trans	71.7	167	130.8	-56.2	-25	0	0	0	123
973	I	31.7	Very low	32.3	Very low	147 Å²	147	131.6 Å²	131.6	75%	0.754	76%	0.76	S	S	*	*			trans	77.5	81.6	162.1	-40	-173.3	0	0	0	117.7
974	N	27.8	Very low	32.5	Very low	149 Å²	149	131.7 Å²	131.7	80%	0.797	76%	0.761	S	S	*	*				68.8	119	127.6	-67.6	-15.3	0	0	0	122.7
975	S	28.4	Very low	32.9	Very low	96 Å²	96	129.8 Å²	129.8	67%	0.671	76%	0.758	S	S	*	*				100.5	124.1	117.3	-159.5	0	0	0	0	121.1
976	T	30.4	Very low	33.1	Very low	124 Å²	124	129.8 Å²	129.8	76%	0.761	76%	0.756	S	S	*	*			trans	55.6	105.7	142.9	52.6	0	0	0	0	120
977	G	34.3	Very low	33.4	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	75%	0.753	S	S	*	*			trans	-150.7	104.5	163.5	0	0	0	0	0	111.8
978	H	33.9	Very low	33.6	Very low	177 Å²	177	128.6 Å²	128.6	82%	0.819	75%	0.752	S	S	*	*			trans	-54.2	160.2	175.3	-56.5	-103.1	0	0	0	112.7
979	S	35.4	Very low	33.3	Very low	95 Å²	95	125.5 Å²	125.5	66%	0.664	74%	0.743	S	S	*	*			cis	-164.6	155.6	23.5	-150.4	0	0	0	0	114.9
980	S	35.4	Very low	33.4	Very low	92 Å²	92	121.2 Å²	121.2	64%	0.643	74%	0.736	S	S	*	*			trans	20.6	146.6	138	66.1	0	0	0	0	121.3
981	V	35.5	Very low	33.1	Very low	122 Å²	122	120.9 Å²	120.9	74%	0.739	74%	0.736	S	S	*	*				-160.3	117.7	53.7	168.7	0	0	0	0	107.3
982	V	32.9	Very low	33.2	Very low	118 Å²	118	123.8 Å²	123.8	72%	0.715	75%	0.746	S	S	*	*				61.8	118.4	90.8	176.3	0	0	0	0	112.7
983	L	35.5	Very low	33.5	Very low	160 Å²	160	121.6 Å²	121.6	84%	0.838	74%	0.743	S	S	*	*				-150.4	148.8	73.6	-80	164.5	0	0	0	114.5
984	T	38.5	Very low	33.7	Very low	119 Å²	119	120.5 Å²	120.5	73%	0.73	75%	0.745	S	S	*	*			trans	-128.8	162.6	157.7	56.1	0	0	0	0	109.4
985	P	40.5	Very low	33.8	Very low	116 Å²	116	122.5 Å²	122.5	75%	0.753	75%	0.746	S	S	*	*				-132.4	132.4	123.6	8.6	13.3	0	0	0	111.1
986	T	34.6	Very low	33.9	Very low	101 Å²	101	125.1 Å²	125.1	62%	0.62	75%	0.752	S	S	*	*				59.9	142.9	68.4	76.7	0	0	0	0	113.8
987	K	38.5	Very low	33.8	Very low	169 Å²	169	125.1 Å²	125.1	74%	0.735	75%	0.747	S	S	*	*			cis	-170.8	139.5	26.1	-131.2	152.1	-164.5	167.9	0	108.4
988	T	35.2	Very low	33.5	Very low	132 Å²	132	128.8 Å²	128.8	81%	0.81	74%	0.744	S	S	*	*				157	170.9	101.6	41.8	0	0	0	0	109.8
989	C	28.5	Very low	33.3	Very low	105 Å²	105	124.6 Å²	124.6	71%	0.709	73%	0.734	S	S	*	*				-175.8	148.1	-57	-102.7	0	0	0	0	111.8
990	C	31.5	Very low	33	Very low	107 Å²	107	126.2 Å²	126.2	72%	0.723	74%	0.736	S	S	*	*			trans	68.5	95.1	149.5	-59	0	0	0	0	122.7
991	S	29.1	Very low	32.7	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	74%	0.742	S	S	*	*				41.9	145.3	107	66.5	0	0	0	0	124.3
992	T	32.6	Very low	32.4	Very low	138 Å²	138	126.9 Å²	126.9	85%	0.847	73%	0.734	S	S	*	*			trans	111.8	132.9	143.1	-41.3	0	0	0	0	117.5
993	S	32.8	Very low	32.3	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	73%	0.733	S	S	*	*			trans	-77	165.2	174.6	-37.6	0	0	0	0	112.9
994	P	36.7	Very low	32.2	Very low	123 Å²	123	126.6 Å²	126.6	80%	0.799	73%	0.73	S	S	*	*				-154.8	145.7	87.9	38.7	-19.4	0	0	0	118.6
995	K	29.6	Very low	31.8	Very low	191 Å²	191	125.4 Å²	125.4	83%	0.83	72%	0.719	S	S	*	*				27.7	137.3	126	-127.5	178.8	-172.1	177.7	0	121.9
996	L	30.8	Very low	31.5	Very low	152 Å²	152	123.7 Å²	123.7	80%	0.796	71%	0.709	S	S	*	*			trans	110.7	102.6	145.9	-66.2	177	0	0	0	120.9
997	N	27.1	Very low	31.5	Very low	123 Å²	123	123.9 Å²	123.9	66%	0.658	71%	0.71	S	S	*	*				103.6	130.4	109.1	-156.3	47.7	0	0	0	122.2
998	E	28	Very low	31	Very low	155 Å²	155	122.8 Å²	122.8	72%	0.724	71%	0.713	S	S	*	*			trans	58.6	118.6	149.7	-88.1	168.6	167.4	0	0	124.4
999	S	30.5	Very low	30.8	Very low	89 Å²	89	123.8 Å²	123.8	62%	0.622	71%	0.711	S	S	*	*				118.8	132.5	110.1	-83	0	0	0	0	121
1000	N	30.3	Very low	30.8	Very low	130 Å²	130	123.7 Å²	123.7	70%	0.695	71%	0.712	S	S	*	*			trans	72.3	114.6	147.4	-61.9	-20.8	0	0	0	118.1
1001	N	27.3	Very low	30.7	Very low	146 Å²	146	124.3 Å²	124.3	78%	0.781	71%	0.713	S	S	*	*				72.6	142.1	88.2	-73.6	-1.6	0	0	0	114.1
1002	S	30.7	Very low	30.7	Very low	82 Å²	82	125.9 Å²	125.9	57%	0.573	71%	0.713	S	S	*	*			cis	-169.9	154.6	-7.6	-98.7	0	0	0	0	110.5
1003	N	29.3	Very low	30.6	Very low	130 Å²	130	125.6 Å²	125.6	70%	0.695	71%	0.706	S	S	*	*			trans	45	128.1	143.8	-48.8	-0.2	0	0	0	120.9
1004	N	33.8	Very low	30.5	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	71%	0.709	S	S	*	*				164.7	132.5	115.4	-78.7	-39.4	0	0	0	109.7
1005	N	30.9	Very low	30.2	Very low	93 Å²	93	127 Å²	127	50%	0.497	71%	0.707	S	S	.	*				65.8	129.5	60.9	-82.9	-23.9	0	0	0	114
1006	S	34.3	Very low	30.4	Very low	80 Å²	80	123.7 Å²	123.7	56%	0.559	70%	0.703	S	S	*	*			cis	-163.8	153.1	3.1	-73	0	0	0	0	114.5
1007	T	33.4	Very low	30.5	Very low	105 Å²	105	122.3 Å²	122.3	64%	0.644	70%	0.701	S	S	*	*			trans	55.3	136.5	136.1	61.3	0	0	0	0	125.9
1008	N	28.2	Very low	30.7	Very low	147 Å²	147	122.9 Å²	122.9	79%	0.786	71%	0.713	S	S	*	*			trans	88.5	158.5	130.2	-73.9	-8.1	0	0	0	123.5
1009	I	31.3	Very low	31.1	Very low	152 Å²	152	118.5 Å²	118.5	78%	0.779	71%	0.71	S	S	*	*			trans	74	100.1	172.2	-44.4	-175.7	0	0	0	113.3
1010	S	28	Very low	31.4	Very low	103 Å²	103	122 Å²	122	72%	0.72	72%	0.72	S	S	*	*				84.4	145.4	54.1	-57.6	0	0	0	0	115.2
1011	T	30.9	Very low	31.7	Very low	120 Å²	120	122.5 Å²	122.5	74%	0.736	72%	0.723	S	S	*	*			trans	82	115	172.3	68.3	0	0	0	0	119.8
1012	N	28.4	Very low	32.1	Very low	137 Å²	137	120 Å²	120	73%	0.733	72%	0.717	S	S	*	*				72.8	129.4	128.7	-62.7	5.1	0	0	0	123
1013	N	30.5	Very low	32.3	Very low	132 Å²	132	122.4 Å²	122.4	71%	0.706	73%	0.728	S	S	*	*			trans	78.5	105.4	141.1	-59.8	-6.1	0	0	0	120.8
1014	N	29.9	Very low	32.6	Very low	149 Å²	149	122.5 Å²	122.5	80%	0.797	72%	0.724	S	S	*	*				63	118.2	125.7	-64.4	3.6	0	0	0	121.9
1015	S	31	Very low	32.7	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	73%	0.725	S	S	*	*				92.5	157	126.5	-162.8	0	0	0	0	119.9
1016	T	33.8	Very low	32.6	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	73%	0.734	S	S	*	*			trans	89.6	91.3	162.1	-32.2	0	0	0	0	114.4
1017	T	32.2	Very low	32.8	Very low	123 Å²	123	123.9 Å²	123.9	76%	0.755	74%	0.74	S	S	*	*				89.3	120.5	64.1	-65	0	0	0	0	113.6
1018	C	32.1	Very low	32.8	Very low	135 Å²	135	127.8 Å²	127.8	91%	0.912	75%	0.752	S	S	*	*			trans	172.6	140.3	147.9	-96.9	0	0	0	0	108.7
1019	G	36.2	Very low	32.8	Very low	64 Å²	64	125.3 Å²	125.3	66%	0.66	75%	0.745	S	S	*	*			cis	159.6	166.6	-6.5	0	0	0	0	0	111.4
1020	I	36.9	Very low	32.8	Very low	161 Å²	161	124.8 Å²	124.8	83%	0.826	74%	0.743	S	S	*	*			trans	75.8	123.5	167.7	-55.2	171.4	0	0	0	115.2
1021	N	35.7	Very low	32.9	Very low	141 Å²	141	127.2 Å²	127.2	75%	0.754	74%	0.742	S	S	*	*			cis	-155.4	157.4	-3	-111.9	2.7	0	0	0	114.1
1022	S	36	Very low	32.8	Very low	94 Å²	94	128.2 Å²	128.2	66%	0.657	74%	0.738	S	S	*	*			trans	-10.8	159.2	164.6	-42.7	0	0	0	0	121.6
1023	V	36	Very low	32.7	Very low	133 Å²	133	126.4 Å²	126.4	81%	0.806	73%	0.729	S	S	*	*			cis	-148.8	124.7	38.9	174.8	0	0	0	0	108.7
1024	Q	34.3	Very low	32.8	Very low	131 Å²	131	128.1 Å²	128.1	61%	0.612	73%	0.73	S	S	*	*				99.2	140.9	53.8	-166	77.1	54.4	0	0	112.9	D1026	Q1024-D1026 PolarHBondContact NE2-OD2 3.29Å
1025	L	35.9	Very low	32.8	Very low	151 Å²	151	126.1 Å²	126.1	79%	0.791	73%	0.728	S	S	*	*			trans	94.6	126.7	171.4	-55	179.3	0	0	0	117.6
1026	D	30.1	Very low	32.9	Very low	125 Å²	125	126 Å²	126	67%	0.668	73%	0.727	S	S	*	*				-170.7	156	-64.6	-82.3	-29.8	0	0	0	109.9	Q1024	Q1024-D1026 PolarHBondContact NE2-OD2 3.29Å
1027	G	37.3	Very low	32.6	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	73%	0.732	S	S	*	*			trans	102.7	108	177.1	0	0	0	0	0	113.8
1028	E	33.2	Very low	32.4	Very low	188 Å²	188	124.7 Å²	124.7	88%	0.879	72%	0.722	S	S	*	*				72.3	140.9	56.2	-57	-163.5	137.7	0	0	113.7
1029	C	30.2	Very low	32.3	Very low	95 Å²	95	124.7 Å²	124.7	64%	0.642	71%	0.711	S	S	*	*			cis	-160.1	145	30.5	-143.1	0	0	0	0	114.2
1030	L	30.9	Very low	32	Very low	141 Å²	141	128.6 Å²	128.6	74%	0.738	71%	0.713	S	S	*	*			trans	52.8	129.8	143.4	-66.7	176.5	0	0	0	122.1
1031	H	29.9	Very low	31.7	Very low	153 Å²	153	128.1 Å²	128.1	71%	0.708	71%	0.707	S	S	*	*				66.6	141.1	77.4	-88.1	-119.8	0	0	0	115
1032	E	28	Very low	31.6	Very low	141 Å²	141	129 Å²	129	66%	0.659	71%	0.711	S	S	*	*			cis	-166.3	166.2	-7.2	-141.5	-173.7	143.4	0	0	111.9
1033	N	26.7	Very low	31.5	Very low	99 Å²	99	127.8 Å²	127.8	53%	0.529	71%	0.707	S	S	.	*			trans	61.1	122.1	148.1	-81.7	-42.7	0	0	0	124
1034	K	31.7	Very low	31.4	Very low	169 Å²	169	127.8 Å²	127.8	74%	0.735	71%	0.708	S	S	*	*				79.2	102.8	129.9	-68.7	168.9	-174.9	160.3	0	121.7
1035	S	30.1	Very low	31.5	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	71%	0.711	S	S	*	*				85.3	152.9	121.7	-56.3	0	0	0	0	120.6
1036	S	32.9	Very low	31.4	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	70%	0.702	S	S	*	*			trans	78.4	88.4	159.3	-55.4	0	0	0	0	118.6
1037	T	29.2	Very low	31.6	Very low	139 Å²	139	124.8 Å²	124.8	85%	0.853	70%	0.697	S	S	*	*				41.5	135.6	121.4	-23.3	0	0	0	0	120.9
1038	S	27.8	Very low	31.5	Very low	78 Å²	78	129.8 Å²	129.8	55%	0.545	70%	0.699	S	S	.	*				111.6	101.8	128.5	-165.7	0	0	0	0	119.2
1039	I	29.5	Very low	31.5	Very low	134 Å²	134	129.9 Å²	129.9	69%	0.687	70%	0.697	S	S	*	*			trans	70.5	153.9	137.8	-60.8	174.9	0	0	0	114.5
1040	Q	30.7	Very low	31.7	Very low	147 Å²	147	131 Å²	131	69%	0.687	70%	0.701	S	S	*	*			cis	-133	139.9	8.4	-142.9	117.6	22.8	0	0	108.2
1041	E	30.8	Very low	31.8	Very low	151 Å²	151	129.2 Å²	129.2	71%	0.706	70%	0.7	S	S	*	*				56.9	148.2	88.8	-47.1	178.3	124.3	0	0	117.3
1042	D	32.6	Very low	32.3	Very low	158 Å²	158	125.3 Å²	125.3	85%	0.845	69%	0.688	S	S	*	*			trans	68.2	152.3	165.8	-64	-21.1	0	0	0	121.4
1043	A	33.7	Very low	32.4	Very low	69 Å²	69	123.8 Å²	123.8	57%	0.57	68%	0.684	S	S	*	*			cis	-173.9	164.2	-28.9	0	0	0	0	0	110.2
1044	T	34.5	Very low	32.7	Very low	133 Å²	133	122.2 Å²	122.2	82%	0.816	68%	0.68	S	S	*	*			trans	67.9	159.6	162	82.8	0	0	0	0	116.6
1045	D	35.2	Very low	32.7	Very low	126 Å²	126	118.8 Å²	118.8	67%	0.674	68%	0.678	S	S	*	*			cis	-156.9	169	-19.3	-135.2	-20.7	0	0	0	113.7
1046	N	33.6	Very low	32.7	Very low	115 Å²	115	120.3 Å²	120.3	62%	0.615	68%	0.678	S	S	*	*			trans	43.1	119.8	144.3	-73.6	-43.9	0	0	0	123.8
1047	D	35.2	Very low	32.5	Very low	103 Å²	103	119.3 Å²	119.3	55%	0.551	67%	0.671	S	S	*	*				89.4	137.5	118.1	-87.3	-41.1	0	0	0	125.1
1048	K	35.3	Very low	32.4	Very low	173 Å²	173	118.5 Å²	118.5	75%	0.752	67%	0.666	S	S	*	*			trans	53.5	130.7	137.8	-62.4	156.2	-172.3	139.5	0	117.8
1049	K	34.2	Very low	32.5	Very low	190 Å²	190	119.3 Å²	119.3	83%	0.826	67%	0.671	S	S	*	*			cis	-169.2	144.9	37.6	-162.6	172.3	178.1	-179.3	0	112.2
1050	T	33	Very low	32.7	Very low	120 Å²	120	119.8 Å²	119.8	74%	0.736	68%	0.675	S	S	*	*			trans	-9.1	138.4	147.8	-15.9	0	0	0	0	116.1
1051	S	34.4	Very low	32.7	Very low	103 Å²	103	118.8 Å²	118.8	72%	0.72	67%	0.674	S	S	*	*				168.4	-178.7	75.9	57.5	0	0	0	0	111.5
1052	P	39	Very low	32.7	Very low	70 Å²	70	119.1 Å²	119.1	46%	0.455	68%	0.675	S	S	.	*			cis	-142.3	-176.6	-48.5	38.9	-21.5	0	0	0	115.3
1053	I	31.4	Very low	32.4	Very low	110 Å²	110	118.4 Å²	118.4	56%	0.564	67%	0.67	S	S	*	*			trans	70.5	144.4	146.4	-79	158.1	0	0	0	116.4	D618	D618-I1053 VanDerWaalsContact O-CG2 3.23Å; D618-I1053 WeakPolarHBondContact O-CG2 3.46Å
1054	S	31.7	Very low	32.3	Very low	65 Å²	65	124.2 Å²	124.2	46%	0.455	68%	0.683	S	S	.	*			cis	-135.8	144.2	18.5	-19.5	0	0	0	0	112.1	D618	D618-S1054 PolarHBondContact O-OG 2.9Å
1055	S	31.5	Very low	32.2	Very low	98 Å²	98	123 Å²	123	69%	0.685	68%	0.679	S	S	*	*				58	132.1	102	84.1	0	0	0	0	116
1056	N	30.3	Very low	31.8	Very low	138 Å²	138	122.3 Å²	122.3	74%	0.738	68%	0.684	S	S	*	*			cis	-155.6	141.9	8.9	-96.1	-12.8	0	0	0	107.5
1057	S	28.5	Very low	31.7	Very low	86 Å²	86	123.6 Å²	123.6	60%	0.601	69%	0.689	S	S	*	*				55.6	136.9	70.5	89	0	0	0	0	114.4
1058	T	27.8	Very low	31.4	Very low	122 Å²	122	126.5 Å²	126.5	75%	0.748	70%	0.7	S	S	*	*			cis	-172.2	175.4	-14.1	21.7	0	0	0	0	105.5
1059	S	29.7	Very low	31.3	Very low	95 Å²	95	124.5 Å²	124.5	66%	0.664	70%	0.697	S	S	*	*			trans	40.4	110.9	147.1	59.4	0	0	0	0	119.7
1060	D	32.8	Very low	31	Very low	143 Å²	143	121.5 Å²	121.5	77%	0.765	69%	0.69	S	S	*	*				177.8	162.8	116.8	-94	-0.3	0	0	0	109.4
1061	L	31.1	Very low	30.9	Very low	126 Å²	126	121.4 Å²	121.4	66%	0.66	69%	0.685	S	S	*	*			cis	177.5	144.3	-32.5	-110.6	-178.1	0	0	0	102.8
1062	H	30.9	Very low	30.7	Very low	159 Å²	159	122.3 Å²	122.3	74%	0.736	68%	0.682	S	S	*	*			trans	64.6	133	174.2	-67	83.1	0	0	0	117.8
1063	L	26	Very low	30.4	Very low	143 Å²	143	124.8 Å²	124.8	75%	0.749	69%	0.691	S	S	*	*			cis	88.2	138.9	49.9	-112.8	167.6	0	0	0	113.8
1064	K	31.8	Very low	30.6	Very low	191 Å²	191	125.5 Å²	125.5	83%	0.83	70%	0.696	S	S	*	*			trans	80	144.2	178.9	-56.4	172.9	-178	175.5	0	114.6
1065	S	32.8	Very low	30.8	Very low	106 Å²	106	128 Å²	128	74%	0.741	71%	0.705	S	S	*	*			cis	-159.5	166.3	-16.7	43.6	0	0	0	0	110.2
1066	C	27.1	Very low	31.1	Very low	113 Å²	113	128.8 Å²	128.8	76%	0.764	70%	0.701	S	S	*	*			trans	-54.9	145.6	161.4	-43.4	0	0	0	0	110.5
1067	L	31.4	Very low	31.6	Very low	141 Å²	141	127.6 Å²	127.6	74%	0.738	70%	0.699	S	S	*	*				174.9	125.1	119.7	-90.7	160.1	0	0	0	109.7
1068	E	28.2	Very low	32.1	Very low	165 Å²	165	128.5 Å²	128.5	77%	0.771	71%	0.705	S	S	*	*			trans	46.5	170.9	133.3	-66.4	176.1	157	0	0	122.5
1069	D	33.2	Very low	32.7	Very low	131 Å²	131	129.1 Å²	129.1	70%	0.701	70%	0.704	S	S	*	*			trans	64	87.9	159.8	-71.5	-25.7	0	0	0	121.3
1070	N	28.8	Very low	33	Very low	126 Å²	126	130.9 Å²	130.9	67%	0.674	71%	0.705	S	S	*	*				78.1	148.5	104.3	-90.8	-58.2	0	0	0	121.5
1071	N	30.6	Very low	33.3	Very low	118 Å²	118	132.3 Å²	132.3	63%	0.631	70%	0.704	S	S	*	*			trans	65.5	98.1	147.4	-71.7	-34	0	0	0	120
1072	N	30	Very low	33.7	Very low	122 Å²	122	133.6 Å²	133.6	65%	0.652	71%	0.707	S	S	*	*				78.2	129.7	106.6	-71.3	-6.2	0	0	0	121.1
1073	N	32.9	Very low	34.1	Very low	122 Å²	122	134 Å²	134	65%	0.652	71%	0.713	S	S	*	*				89.9	129.8	126.9	-76.4	7.4	0	0	0	120.1
1074	N	35.1	Very low	34.7	Very low	125 Å²	125	136.1 Å²	136.1	67%	0.668	72%	0.716	S	S	*	*			trans	74	148.3	142.5	-60.4	9.7	0	0	0	116.4
1075	N	35.5	Very low	34.9	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	71%	0.708	S	S	*	*			cis	-165.1	178.1	-10.7	-109.2	13.6	0	0	0	106.2
1076	D	39.7	Very low	35.2	Very low	114 Å²	114	135.2 Å²	135.2	61%	0.61	71%	0.707	S	S	*	*			cis	-158.1	161.2	5.6	-128.3	-35.1	0	0	0	111
1077	T	39.2	Very low	36	Very low	113 Å²	113	137.4 Å²	137.4	69%	0.693	71%	0.709	S	S	*	*			trans	46.8	121.1	154.9	59.8	0	0	0	0	119.8
1078	S	40.5	Very low	36.2	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	71%	0.711	S	S	*	*				160.8	173.9	78.3	49.9	0	0	0	0	109
1079	N	38.6	Very low	36.6	Very low	135 Å²	135	137.4 Å²	137.4	72%	0.722	71%	0.71	S	S	*	*			cis	-172.7	155.4	-26.2	-93.5	-8	0	0	0	107
1080	I	37.7	Very low	36.9	Very low	133 Å²	133	139.3 Å²	139.3	68%	0.682	72%	0.718	S	S	*	*			cis	-163.6	154.2	-16.1	-118.8	173	0	0	0	108.9
1081	K	38.8	Very low	37.4	Very low	172 Å²	172	138 Å²	138	75%	0.748	72%	0.719	S	S	*	*			trans	21.4	152.9	151.9	-60.9	-174.6	170.5	-142.4	0	122.8
1082	E	38.7	Very low	37.8	Very low	153 Å²	153	140.8 Å²	140.8	72%	0.715	73%	0.729	S	S	*	*			cis	177.9	-177.8	-6.2	176.9	165.3	-175	0	0	108.9
1083	I	40.1	Very low	38.4	Very low	169 Å²	169	140.7 Å²	140.7	87%	0.867	74%	0.737	S	S	*	*			trans	115.8	164.2	166.8	-58.1	160.8	0	0	0	116.2
1084	K	38.1	Very low	39.1	Very low	186 Å²	186	140.7 Å²	140.7	81%	0.809	74%	0.737	S	S	*	*			trans	-153.8	165	-137.3	-113.7	-178	176.9	-177.9	0	118
1085	N	36	Very low	39.8	Very low	123 Å²	123	140.3 Å²	140.3	66%	0.658	73%	0.733	S	S	*	*			trans	75.1	162.4	155.8	-63.9	17.4	0	0	0	119.7
1086	E	40	Very low	40.4	Very low	156 Å²	156	138.7 Å²	138.7	73%	0.729	72%	0.724	S	S	*	*			cis	-169	169	14.5	-134.2	152.4	-113.2	0	0	116.5
1087	I	42.7	Very low	40.6	Very low	158 Å²	158	140.5 Å²	140.5	81%	0.81	73%	0.731	S	S	*	*			trans	103.3	158.5	152.5	-63.2	153.2	0	0	0	124.7
1088	E	36.7	Very low	40.5	Very low	165 Å²	165	142.9 Å²	142.9	77%	0.771	74%	0.74	S	S	*	*			trans	-153.8	0	-147.9	-43.4	170.7	136.5	0	0	123.9
1089	N	36.8	Very low	40.1	Very low	142 Å²	142	140.7 Å²	140.7	76%	0.759	73%	0.734	S	S	*	*				0	0	0	-60.9	-40.4	0	0	0	132.4
1090	I	39.1	Very low	39.6	Very low	170 Å²	170	143 Å²	143	87%	0.872	74%	0.74	S	S	*	*				0	0	0	-76.5	168	0	0	0	127.1
1091	S	37.8	Very low	39.1	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	74%	0.74	S	S	*	*				0	0	0	-67.1	0	0	0	0	121.3
1092	E	39.2	Very low	38.6	Very low	177 Å²	177	142 Å²	142	83%	0.827	74%	0.739	S	S	*	*				0	0	0	-39.7	94.3	114.4	0	0	127.7
1093	S	43.6	Very low	38	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	74%	0.738	S	S	*	*				0	0	0	37	0	0	0	0	124
1094	N	47.6	Very low	37.6	Very low	122 Å²	122	140.6 Å²	140.6	65%	0.652	73%	0.732	S	S	*	*				0	0	0	-111.2	-75.2	0	0	0	128.7	P711 F712	P711-N1094 VanDerWaalsContact CD-OD1 3.24Å; P711-N1094 WeakPolarHBondContact CD-OD1 3.5Å; P711-N1094 PolarHBondContact O-OD1 3.21Å; F712-N1094 HydrophobicContact CB-CB 4.09Å; F712-N1094 HydrophobicContact CD2-CB 3.66Å; F712-N1094 HydrophobicContact CG-CB 4.25Å
1095	M	49.3	Very low	37.3	Very low	117 Å²	117	136.4 Å²	136.4	58%	0.576	72%	0.724	S	S	*	*				0	0	0	-160.6	-121.6	-69.1	0	0	131.3	P711 F712 L713	P711-M1095 CarbonylContact O-C 3.33Å; P711-M1095 WeakPolarHBondContact O-CA 3.33Å; P711-M1095 WeakPolarHBondContact O-CB 3.12Å; P711-M1095 PolarHBondContact O-N 3.39Å; F712-M1095 VanDerWaalsContact C-C 3.41Å; F712-M1095 CarbonylContact C-O 2.67Å; F712-M1095 VanDerWaalsContact CA-O 3.32Å; F712-M1095 WeakPolarHBondContact CA-O 3.09Å; F712-M1095 PolarHBondContact N-O 2.75Å; L713-M1095 PolarHBondContact N-O 3.07Å
1096	I	48.9	Very low	37.3	Very low	85 Å²	85	133.5 Å²	133.5	44%	0.436	71%	0.713	S	S	.	*				0	0	0	-115.8	-178.4	0	0	0	136.3	P711 F712 L713	P711-I1096 HydrophobicContact CB-CB 4.07Å; P711-I1096 HydrophobicContact CB-CD1 3.71Å; P711-I1096 HydrophobicContact CB-CG1 4.05Å; F712-I1096 VanDerWaalsContact N-CB 3.27Å; L713-I1096 HydrophobicContact CD2-CG2 4.28Å; L713-I1096 HydrophobicContact CG-CG2 4.43Å
1097	I	43.8	Very low	37.3	Very low	151 Å²	151	132 Å²	132	77%	0.774	71%	0.71	S	S	*	*				0	0	0	-26.5	176.3	0	0	0	117.2
1098	N	37	Very low	37.5	Very low	164 Å²	164	131.7 Å²	131.7	88%	0.877	71%	0.71	S	S	*	*				0	0	0	-170	40.7	0	0	0	114.8
1099	G	32.4	Very low	38.3	Very low	59 Å²	59	130 Å²	130	61%	0.608	71%	0.707	S	S	*	*				0	0	0	0	0	0	0	0	119.6
1100	E	28.4	Very low	39.6	Very low	183 Å²	183	126.7 Å²	126.7	86%	0.855	68%	0.684	S	S	*	*				0	0	0	-76.7	-170.3	-84.5	0	0	118.3
1101	N	26.1	Very low	41.3	Very low	124 Å²	124	120.2 Å²	120.2	66%	0.663	65%	0.653	S	S	*	*				0	0	0	-66	-12	0	0	0	112.1
1102	Q	27.8	Very low	43.3	Very low	159 Å²	159	123 Å²	123	74%	0.743	67%	0.666	S	S	*	*				0	0	0	-118.6	169.7	-88.2	0	0	112.4
1103	E	27.4	Very low	45.4	Very low	149 Å²	149	117.6 Å²	117.6	70%	0.696	64%	0.643	S	S	*	*				0	0	0	-37.7	-170.9	135.5	0	0	120.7
1104	I	31.2	Very low	47.6	Very low	144 Å²	144	112.3 Å²	112.3	74%	0.738	61%	0.605	S	S	*	*				0	0	0	20.6	168.2	0	0	0	127.9
1105	P	31.8	Very low	49.6	Very low	98 Å²	98	108.2 Å²	108.2	64%	0.636	59%	0.586	S	S	*	*				0	0	0	42.9	-18	0	0	0	121.8	S1118	P1105-S1118 WeakPolarHBondContact O-CB 3.38Å
1106	S	35	Very low	51.4	Low	62 Å²	62	107.7 Å²	107.7	43%	0.434	59%	0.585	S	S	.	*				0	0	0	87.2	0	0	0	0	129.8	S1118 D1120	S1106-S1118 WeakPolarHBondContact CB-OG 3.42Å; S1106-D1120 WeakPolarHBondContact CB-OD2 3.43Å; S1106-D1120 PolarHBondContact OG-OD2 2.85Å
1107	N	41.8	Very low	53.5	Low	124 Å²	124	104.3 Å²	104.3	66%	0.663	57%	0.567	S	S	*	*	S	Bend		0	126.9	0	-171.3	36.7	0	0	0	125.2	N1109 H1121	N1107-N1109 PolarHBondContact O-N 2.82Å; N1107-N1109 PolarHBondContact O-ND2 3.07Å; N1107-H1121 PolarHBondContact N-NE2 2.81Å; N1107-H1121 VanDerWaalsContact N-NE2 3.17Å
1108	N	45.3	Very low	55.9	Low	152 Å²	152	97.6 Å²	97.6	81%	0.813	53%	0.533	S	S	*	.	S	Bend	trans	45.2	-26.6	174.9	-155.6	42.9	0	0	0	118.2	R1110	N1108-R1110 PolarHBondContact O-N 2.96Å; N1108-R1110 VanDerWaalsContact O-N 3.16Å
1109	N	53.2	Low	58.6	Low	131 Å²	131	91.4 Å²	91.4	70%	0.701	50%	0.501	S	S	*	.			trans	-80.1	56	161.4	-50.5	-60.2	0	0	0	108.9	N1107 P1111 H1121	N1107-N1109 PolarHBondContact O-N 2.82Å; N1107-N1109 PolarHBondContact O-ND2 3.07Å; N1109-P1111 WeakPolarHBondContact O-CD 3.18Å; N1109-P1111 WeakPolarHBondContact O-CG 3.16Å; N1109-P1111 VanDerWaalsContact O-N 3.12Å; N1109-H1121 PolarHBondContact O-CE1 3.03Å
1110	R	64.3	Low	61.5	Low	71 Å²	71	91.6 Å²	91.6	27%	0.268	49%	0.488	S	S	.	.			trans	-66	110.7	167.3	-178.6	168.2	79.1	-124.6	-4.2	106.2	N1108 W1117 H1121 E1128	N1108-R1110 PolarHBondContact O-N 2.96Å; N1108-R1110 VanDerWaalsContact O-N 3.16Å; R1110-W1117 VanDerWaalsContact CD-CE2 3.47Å; R1110-W1117 VanDerWaalsContact CD-CZ2 3.46Å; R1110-W1117 HydrophobicContact CG-CD2 3.71Å; R1110-W1117 HydrophobicContact CG-CE3 4.37Å; R1110-W1117 HydrophobicContact CG-CG 4.05Å; R1110-W1117 HydrophobicContact CG-CH2 4.37Å; R1110-W1117 HydrophobicContact CG-CZ2 3.7Å; R1110-H1121 WeakPolarHBondContact CD-O 3.32Å; R1110-H1121 HydrophobicContact CG-CB 3.97Å; R1110-E1128 IonicContact CZ-OE1 2.8Å; R1110-E1128 IonicContact CZ-OE2 3.7Å; R1110-E1128 IonicContact NH1-OE1 2.77Å; R1110-E1128 PolarHBondContact NH1-OE1 3.48Å; R1110-E1128 IonicContact NH1-OE2 2.73Å; R1110-E1128 PolarHBondContact NH1-OE2 2.86Å; R1110-E1128 IonicContact NH2-OE1 3.77Å; R1110-E1128 IonicContact NH2-OE2 3.66Å; R1110-E1128 PolarHBondContact NH2-OE2 2.74Å
1111	P	75.9	Confident	64.7	Low	35 Å²	35	83.4 Å²	83.4	23%	0.227	45%	0.45	C	S	.	.			trans	-68.2	160.7	-164.3	-23.1	35.8	0	0	0	112.6	N1109 D1113 I1116 W1117	N1109-P1111 WeakPolarHBondContact O-CD 3.18Å; N1109-P1111 WeakPolarHBondContact O-CG 3.16Å; N1109-P1111 VanDerWaalsContact O-N 3.12Å; P1111-D1113 VanDerWaalsContact C-N 3.26Å; P1111-D1113 CarbonylContact C-O 3.54Å; P1111-D1113 PolarHBondContact O-N 3.22Å; P1111-I1116 HydrophobicContact CB-CD1 3.45Å; P1111-I1116 VanDerWaalsContact CB-CD1 3.45Å; P1111-I1116 HydrophobicContact CB-CG1 3.69Å; P1111-I1116 HydrophobicContact CG-CD1 3.7Å; P1111-I1116 HydrophobicContact CG-CG1 3.81Å; P1111-W1117 PolarHBondContact O-NE1 2.74Å
1112	T	79.8	Confident	67.9	Low	156 Å²	156	77.5 Å²	77.5	96%	0.957	42%	0.418	S	S	*	.	S	Bend	trans	-67.9	-30.1	176.9	48.1	0	0	0	0	112.4
1113	D	83.7	Confident	71.1	Confident	65 Å²	65	71.9 Å²	71.9	35%	0.348	39%	0.392	S	S	.	.	S	Bend	trans	-82.6	139.7	164.3	-176.3	3.7	0	0	0	109.3	P1111 S1115 I1116 W1117	P1111-D1113 VanDerWaalsContact C-N 3.26Å; P1111-D1113 CarbonylContact C-O 3.54Å; P1111-D1113 PolarHBondContact O-N 3.22Å; D1113-S1115 WeakPolarHBondContact OD1-CB 3.28Å; D1113-S1115 PolarHBondContact OD1-N 2.65Å; D1113-S1115 PolarHBondContact OD1-OG 2.69Å; D1113-S1115 PolarHBondContact OD2-OG 3.31Å; D1113-I1116 HydrophobicContact CB-CD1 4.45Å; D1113-I1116 HydrophobicContact CB-CG1 4.17Å; D1113-W1117 PolarHBondContact O-NE1 3.06Å
1114	V	89.2	Confident	74.2	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.042	38%	0.379	C	S	.	.	S	Bend	trans	-86.1	-21.9	-179.2	-174.7	0	0	0	0	111.5	I1116 W1117 G1145 L1148 L1149 F1177	V1114-I1116 PolarHBondContact O-N 2.93Å; V1114-W1117 HydrophobicContact CB-CD2 4.5Å; V1114-W1117 HydrophobicContact CG1-CD2 3.98Å; V1114-W1117 HydrophobicContact CG1-CE3 4.07Å; V1114-W1117 HydrophobicContact CG1-CG 4.41Å; V1114-W1117 HydrophobicContact CG1-CZ2 4.46Å; V1114-W1117 HydrophobicContact CG1-CZ3 4.33Å; V1114-W1117 HydrophobicContact CG2-CH2 4.38Å; V1114-W1117 HydrophobicContact CG2-CZ2 3.87Å; V1114-W1117 PolarHBondContact O-N 2.73Å; V1114-G1145 CarbonylContact O-C 3.38Å; V1114-G1145 WeakPolarHBondContact O-CA 3.49Å; V1114-L1148 HydrophobicContact CG1-CD2 4.06Å; V1114-L1149 HydrophobicContact CB-CD1 4.25Å; V1114-L1149 HydrophobicContact CB-CD2 4.09Å; V1114-L1149 HydrophobicContact CB-CG 4.2Å; V1114-L1149 HydrophobicContact CG1-CD2 4.04Å; V1114-L1149 HydrophobicContact CG1-CG 4.01Å; V1114-F1177 HydrophobicContact CB-CB 4.31Å; V1114-F1177 HydrophobicContact CB-CG 4.4Å; V1114-F1177 HydrophobicContact CG1-CB 4.12Å; V1114-F1177 HydrophobicContact CG1-CD2 3.88Å; V1114-F1177 HydrophobicContact CG1-CE2 4.48Å; V1114-F1177 HydrophobicContact CG1-CG 4.07Å; V1114-F1177 HydrophobicContact CG2-CB 3.96Å; V1114-F1177 HydrophobicContact CG2-CD1 3.67Å; V1114-F1177 HydrophobicContact CG2-CD2 4.18Å; V1114-F1177 HydrophobicContact CG2-CE1 4.16Å; V1114-F1177 HydrophobicContact CG2-CG 3.7Å
1115	S	88.6	Confident	77.2	Confident	37 Å²	37	62.6 Å²	62.6	26%	0.259	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-36.1	179.6	73.9	0	0	0	0	112.9	D1113 T1146	D1113-S1115 WeakPolarHBondContact OD1-CB 3.28Å; D1113-S1115 PolarHBondContact OD1-N 2.65Å; D1113-S1115 PolarHBondContact OD1-OG 2.69Å; D1113-S1115 PolarHBondContact OD2-OG 3.31Å; S1115-T1146 PolarHBondContact O-N 3.15Å
1116	I	87.6	Confident	80.2	Confident	105 Å²	105	58 Å²	58	54%	0.538	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	27.8	-175.9	50.6	165.5	0	0	0	113.2	P1111 D1113 V1114	P1111-I1116 HydrophobicContact CB-CD1 3.45Å; P1111-I1116 VanDerWaalsContact CB-CD1 3.45Å; P1111-I1116 HydrophobicContact CB-CG1 3.69Å; P1111-I1116 HydrophobicContact CG-CD1 3.7Å; P1111-I1116 HydrophobicContact CG-CG1 3.81Å; D1113-I1116 HydrophobicContact CB-CD1 4.45Å; D1113-I1116 HydrophobicContact CB-CG1 4.17Å; V1114-I1116 PolarHBondContact O-N 2.93Å
1117	W	92.7	Very high	82.9	Confident	15 Å²	15	58.6 Å²	58.6	6%	0.057	31%	0.313	C	S	.	.			trans	-82.3	139.5	167.8	-70.5	19.6	0	0	0	109.5	R1110 P1111 D1113 V1114 H1121 V1122 W1125 G1145 L1148 F1177	R1110-W1117 VanDerWaalsContact CD-CE2 3.47Å; R1110-W1117 VanDerWaalsContact CD-CZ2 3.46Å; R1110-W1117 HydrophobicContact CG-CD2 3.71Å; R1110-W1117 HydrophobicContact CG-CE3 4.37Å; R1110-W1117 HydrophobicContact CG-CG 4.05Å; R1110-W1117 HydrophobicContact CG-CH2 4.37Å; R1110-W1117 HydrophobicContact CG-CZ2 3.7Å; P1111-W1117 PolarHBondContact O-NE1 2.74Å; D1113-W1117 PolarHBondContact O-NE1 3.06Å; V1114-W1117 HydrophobicContact CB-CD2 4.5Å; V1114-W1117 HydrophobicContact CG1-CD2 3.98Å; V1114-W1117 HydrophobicContact CG1-CE3 4.07Å; V1114-W1117 HydrophobicContact CG1-CG 4.41Å; V1114-W1117 HydrophobicContact CG1-CZ2 4.46Å; V1114-W1117 HydrophobicContact CG1-CZ3 4.33Å; V1114-W1117 HydrophobicContact CG2-CH2 4.38Å; V1114-W1117 HydrophobicContact CG2-CZ2 3.87Å; V1114-W1117 PolarHBondContact O-N 2.73Å; W1117-H1121 HydrophobicContact CB-CB 3.69Å; W1117-H1121 HydrophobicContact CD2-CB 4.38Å; W1117-H1121 HydrophobicContact CG-CB 3.98Å; W1117-V1122 HydrophobicContact CB-CG2 4.21Å; W1117-V1122 HydrophobicContact CE3-CG2 4.15Å; W1117-W1125 HydrophobicContact CE3-CB 4.2Å; W1117-W1125 HydrophobicContact CH2-CB 3.93Å; W1117-W1125 AromaticContact CH2-CD1 3.8Å; W1117-W1125 HydrophobicContact CH2-CD2 4.33Å; W1117-W1125 AromaticContact CH2-CG 3.71Å; W1117-W1125 HydrophobicContact CH2-CG 3.71Å; W1117-W1125 HydrophobicContact CZ3-CB 3.4Å; W1117-W1125 AromaticContact CZ3-CD1 3.94Å; W1117-W1125 AromaticContact CZ3-CD2 3.76Å; W1117-W1125 HydrophobicContact CZ3-CD2 3.76Å; W1117-W1125 HydrophobicContact CZ3-CE3 4.2Å; W1117-W1125 AromaticContact CZ3-CG 3.36Å; W1117-W1125 HydrophobicContact CZ3-CG 3.36Å; W1117-G1145 WeakPolarHBondContact O-CA 3.39Å; W1117-G1145 PolarHBondContact O-N 3.15Å; W1117-L1148 HydrophobicContact CE3-CD2 4.01Å; W1117-L1148 HydrophobicContact CZ3-CD2 3.99Å; W1117-F1177 HydrophobicContact CH2-CE1 4.21Å; W1117-F1177 AromaticContact CH2-CE2 3.61Å; W1117-F1177 HydrophobicContact CH2-CE2 3.61Å; W1117-F1177 AromaticContact CH2-CZ 3.43Å; W1117-F1177 HydrophobicContact CH2-CZ 3.43Å; W1117-F1177 VanDerWaalsContact CH2-CZ 3.43Å; W1117-F1177 HydrophobicContact CZ2-CZ 4.29Å; W1117-F1177 AromaticContact CZ3-CE2 3.72Å; W1117-F1177 HydrophobicContact CZ3-CE2 3.72Å; W1117-F1177 HydrophobicContact CZ3-CZ 4.03Å
1118	S	93.9	Very high	85.2	Confident	9 Å²	9	57.8 Å²	57.8	6%	0.063	31%	0.305	C	S	.	.			trans	-83	173.7	165.4	65.2	0	0	0	0	112.6	P1105 S1106 D1120 H1121 V1122	P1105-S1118 WeakPolarHBondContact O-CB 3.38Å; S1106-S1118 WeakPolarHBondContact CB-OG 3.42Å; S1118-D1120 PolarHBondContact O-N 2.88Å; S1118-D1120 PolarHBondContact OG-N 2.9Å; S1118-H1121 PolarHBondContact N-ND1 3.24Å; S1118-H1121 WeakPolarHBondContact O-CA 3.19Å; S1118-H1121 WeakPolarHBondContact O-CB 3.43Å; S1118-H1121 PolarHBondContact O-N 3.2Å; S1118-H1121 PolarHBondContact OG-N 3.23Å; S1118-V1122 WeakPolarHBondContact O-CG2 3.29Å; S1118-V1122 PolarHBondContact O-N 3.15Å
1119	V	94.5	Very high	87.3	Confident	34 Å²	34	53.2 Å²	53.2	21%	0.206	28%	0.279	C	S	.	.	H	α-helix	trans	-49.7	-43.6	167.8	-169.5	0	0	0	0	111.8	H1121 V1122 Q1123 Y1139 E1142 D1144	V1119-H1121 PolarHBondContact O-N 3.43Å; V1119-V1122 PolarHBondContact O-N 2.7Å; V1119-Q1123 WeakPolarHBondContact O-CB 3.42Å; V1119-Q1123 PolarHBondContact O-N 2.6Å; V1119-Y1139 HydrophobicContact CG1-CD2 3.85Å; V1119-Y1139 HydrophobicContact CG1-CE2 4.49Å; V1119-Y1139 HydrophobicContact CG1-CG 4.33Å; V1119-E1142 HydrophobicContact CG2-CB 4.42Å; V1119-E1142 WeakPolarHBondContact CG2-O 3.09Å; V1119-D1144 HydrophobicContact CG2-CB 4.12Å
1120	D	93.3	Very high	89	Confident	64 Å²	64	49.5 Å²	49.5	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-41.1	174.6	-54.4	-52.9	0	0	0	112.3	S1106 S1118 Q1124	S1106-D1120 WeakPolarHBondContact CB-OD2 3.43Å; S1106-D1120 PolarHBondContact OG-OD2 2.85Å; S1118-D1120 PolarHBondContact O-N 2.88Å; S1118-D1120 PolarHBondContact OG-N 2.9Å; D1120-Q1124 WeakPolarHBondContact O-CB 3.33Å; D1120-Q1124 PolarHBondContact O-N 2.77Å
1121	H	94.6	Very high	90.4	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.046	26%	0.262	C	S	.	.	H	α-helix	trans	-68.9	-35.1	179.5	-70.8	160	0	0	0	112.1	N1107 N1109 R1110 W1117 S1118 V1119 W1125	N1107-H1121 PolarHBondContact N-NE2 2.81Å; N1107-H1121 VanDerWaalsContact N-NE2 3.17Å; N1109-H1121 PolarHBondContact O-CE1 3.03Å; R1110-H1121 WeakPolarHBondContact CD-O 3.32Å; R1110-H1121 HydrophobicContact CG-CB 3.97Å; W1117-H1121 HydrophobicContact CB-CB 3.69Å; W1117-H1121 HydrophobicContact CD2-CB 4.38Å; W1117-H1121 HydrophobicContact CG-CB 3.98Å; S1118-H1121 PolarHBondContact N-ND1 3.24Å; S1118-H1121 WeakPolarHBondContact O-CA 3.19Å; S1118-H1121 WeakPolarHBondContact O-CB 3.43Å; S1118-H1121 PolarHBondContact O-N 3.2Å; S1118-H1121 PolarHBondContact OG-N 3.23Å; V1119-H1121 PolarHBondContact O-N 3.43Å; H1121-W1125 VanDerWaalsContact O-CB 3.3Å; H1121-W1125 WeakPolarHBondContact O-CB 3.32Å; H1121-W1125 PolarHBondContact O-N 2.87Å
1122	V	95.1	Very high	91.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-45.4	173.2	176.4	0	0	0	0	111.4	W1117 S1118 V1119 Q1124 W1125 L1126 F1138 I1143 D1144 L1148	W1117-V1122 HydrophobicContact CB-CG2 4.21Å; W1117-V1122 HydrophobicContact CE3-CG2 4.15Å; S1118-V1122 WeakPolarHBondContact O-CG2 3.29Å; S1118-V1122 PolarHBondContact O-N 3.15Å; V1119-V1122 PolarHBondContact O-N 2.7Å; V1122-Q1124 PolarHBondContact O-N 2.73Å; V1122-W1125 HydrophobicContact CG1-CE3 4.39Å; V1122-W1125 PolarHBondContact O-N 3.39Å; V1122-L1126 HydrophobicContact CG1-CD1 4.29Å; V1122-L1126 PolarHBondContact O-N 3.18Å; V1122-F1138 HydrophobicContact CG1-CD1 3.74Å; V1122-F1138 HydrophobicContact CG1-CE1 4.48Å; V1122-I1143 WeakPolarHBondContact CB-O 3.44Å; V1122-I1143 HydrophobicContact CG1-CG2 4.38Å; V1122-I1143 WeakPolarHBondContact CG1-O 3.44Å; V1122-I1143 VanDerWaalsContact CG2-O 3.31Å; V1122-I1143 WeakPolarHBondContact CG2-O 3.37Å; V1122-D1144 VanDerWaalsContact CG2-C 3.45Å; V1122-L1148 HydrophobicContact CG1-CD1 3.98Å; V1122-L1148 HydrophobicContact CG1-CD2 4.17Å; V1122-L1148 HydrophobicContact CG1-CG 4.49Å; V1122-L1148 HydrophobicContact CG2-CB 4.15Å; V1122-L1148 HydrophobicContact CG2-CD2 4Å
1123	Q	95	Very high	91.5	Very high	42 Å²	42	49.1 Å²	49.1	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-49.6	173.8	-172.5	-165.6	51.2	0	0	110.4	V1119 W1125 L1126 L1127 A1135 Y1139	V1119-Q1123 WeakPolarHBondContact O-CB 3.42Å; V1119-Q1123 PolarHBondContact O-N 2.6Å; Q1123-W1125 VanDerWaalsContact C-N 3.32Å; Q1123-W1125 PolarHBondContact O-N 2.74Å; Q1123-L1126 PolarHBondContact O-N 3.11Å; Q1123-L1127 HydrophobicContact CG-CD1 4.16Å; Q1123-L1127 VanDerWaalsContact O-CG 3.28Å; Q1123-L1127 WeakPolarHBondContact O-CG 3.5Å; Q1123-L1127 PolarHBondContact O-N 2.79Å; Q1123-A1135 HydrophobicContact CG-CB 4.03Å; Q1123-Y1139 HydrophobicContact CB-CD2 4.21Å; Q1123-Y1139 VanDerWaalsContact CD-CD2 3.49Å; Q1123-Y1139 HydrophobicContact CG-CD2 4.26Å; Q1123-Y1139 HydrophobicContact CG-CG 4.46Å; Q1123-Y1139 VanDerWaalsContact NE2-CG 3.28Å
1124	Q	91.2	Very high	92	Very high	91 Å²	91	46.4 Å²	46.4	43%	0.425	24%	0.243	S	C	.	.	H	α-helix	trans	-59.8	-39.5	176.9	177.5	55.2	36	0	0	112.3	D1120 V1122 L1127 E1128	D1120-Q1124 WeakPolarHBondContact O-CB 3.33Å; D1120-Q1124 PolarHBondContact O-N 2.77Å; V1122-Q1124 PolarHBondContact O-N 2.73Å; Q1124-L1127 WeakPolarHBondContact O-CB 3.49Å; Q1124-L1127 PolarHBondContact O-N 2.98Å; Q1124-E1128 WeakPolarHBondContact CG-OE1 3.27Å; Q1124-E1128 PolarHBondContact NE2-OE1 3.14Å; Q1124-E1128 WeakPolarHBondContact O-CG 3.1Å; Q1124-E1128 PolarHBondContact O-N 3.39Å
1125	W	94.5	Very high	92.2	Very high	7 Å²	7	46.1 Å²	46.1	3%	0.027	24%	0.242	C	C	.	.	H	α-helix	trans	-67.4	-40.4	174.4	164.9	69.9	0	0	0	113.1	W1117 H1121 V1122 Q1123 L1127 E1128 E1129 L1148 R1173 I1174 F1177	W1117-W1125 HydrophobicContact CE3-CB 4.2Å; W1117-W1125 HydrophobicContact CH2-CB 3.93Å; W1117-W1125 AromaticContact CH2-CD1 3.8Å; W1117-W1125 HydrophobicContact CH2-CD2 4.33Å; W1117-W1125 AromaticContact CH2-CG 3.71Å; W1117-W1125 HydrophobicContact CH2-CG 3.71Å; W1117-W1125 HydrophobicContact CZ3-CB 3.4Å; W1117-W1125 AromaticContact CZ3-CD1 3.94Å; W1117-W1125 AromaticContact CZ3-CD2 3.76Å; W1117-W1125 HydrophobicContact CZ3-CD2 3.76Å; W1117-W1125 HydrophobicContact CZ3-CE3 4.2Å; W1117-W1125 AromaticContact CZ3-CG 3.36Å; W1117-W1125 HydrophobicContact CZ3-CG 3.36Å; H1121-W1125 VanDerWaalsContact O-CB 3.3Å; H1121-W1125 WeakPolarHBondContact O-CB 3.32Å; H1121-W1125 PolarHBondContact O-N 2.87Å; V1122-W1125 HydrophobicContact CG1-CE3 4.39Å; V1122-W1125 PolarHBondContact O-N 3.39Å; Q1123-W1125 VanDerWaalsContact C-N 3.32Å; Q1123-W1125 PolarHBondContact O-N 2.74Å; W1125-L1127 VanDerWaalsContact C-N 3.32Å; W1125-E1128 PolarHBondContact O-N 3.13Å; W1125-E1129 HydrophobicContact CZ2-CG 4.12Å; W1125-E1129 VanDerWaalsContact NE1-CG 3.31Å; W1125-E1129 PolarHBondContact O-N 2.81Å; W1125-L1148 HydrophobicContact CE3-CD1 4.44Å; W1125-L1148 HydrophobicContact CE3-CD2 3.82Å; W1125-L1148 HydrophobicContact CH2-CD1 4.49Å; W1125-L1148 HydrophobicContact CZ3-CD1 3.77Å; W1125-L1148 HydrophobicContact CZ3-CD2 3.82Å; W1125-L1148 HydrophobicContact CZ3-CG 4.41Å; W1125-R1173 HydrophobicContact CH2-CB 4.06Å; W1125-R1173 HydrophobicContact CZ2-CB 3.62Å; W1125-I1174 HydrophobicContact CH2-CG1 4.1Å; W1125-I1174 HydrophobicContact CZ3-CG1 4.5Å; W1125-F1177 AromaticContact CD1-CZ 3.9Å; W1125-F1177 AromaticContact CD2-CE2 3.83Å; W1125-F1177 HydrophobicContact CD2-CE2 3.83Å; W1125-F1177 HydrophobicContact CD2-CZ 4.28Å; W1125-F1177 AromaticContact CE2-CE2 3.36Å; W1125-F1177 AromaticContact CE2-CZ 3.63Å; W1125-F1177 HydrophobicContact CE3-CE2 4.34Å; W1125-F1177 HydrophobicContact CG-CE2 4.35Å; W1125-F1177 HydrophobicContact CG-CZ 4.43Å; W1125-F1177 HydrophobicContact CH2-CE2 4.09Å; W1125-F1177 HydrophobicContact CZ2-CD2 4.38Å; W1125-F1177 AromaticContact CZ2-CE2 3.5Å; W1125-F1177 HydrophobicContact CZ2-CE2 3.5Å; W1125-F1177 HydrophobicContact CZ2-CZ 4.04Å; W1125-F1177 HydrophobicContact CZ3-CE2 4.48Å; W1125-F1177 AromaticContact NE1-CE2 3.62Å; W1125-F1177 AromaticContact NE1-CZ 3.35Å; W1125-F1177 VanDerWaalsContact NE1-CZ 3.35Å
1126	L	94.6	Very high	92.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.9	-33.2	175.2	-76.8	168.6	0	0	0	112.5	V1122 Q1123 G1130 F1131 A1135 F1138 I1170	V1122-L1126 HydrophobicContact CG1-CD1 4.29Å; V1122-L1126 PolarHBondContact O-N 3.18Å; Q1123-L1126 PolarHBondContact O-N 3.11Å; L1126-G1130 PolarHBondContact O-N 3.13Å; L1126-F1131 HydrophobicContact CD2-CB 4.37Å; L1126-F1131 HydrophobicContact CD2-CD2 4.27Å; L1126-F1131 PolarHBondContact O-N 2.97Å; L1126-A1135 HydrophobicContact CB-CB 3.56Å; L1126-F1138 HydrophobicContact CD1-CB 3.53Å; L1126-F1138 HydrophobicContact CD1-CD1 3.52Å; L1126-F1138 HydrophobicContact CD1-CD2 3.42Å; L1126-F1138 VanDerWaalsContact CD1-CD2 3.42Å; L1126-F1138 HydrophobicContact CD1-CE1 4.02Å; L1126-F1138 HydrophobicContact CD1-CE2 3.9Å; L1126-F1138 HydrophobicContact CD1-CG 3.19Å; L1126-F1138 HydrophobicContact CD1-CZ 4.19Å; L1126-I1170 HydrophobicContact CD2-CB 4.47Å; L1126-I1170 HydrophobicContact CD2-CD1 4.1Å; L1126-I1170 HydrophobicContact CD2-CG1 3.88Å; L1126-I1170 HydrophobicContact CD2-CG2 3.81Å
1127	L	92.8	Very high	92.5	Very high	76 Å²	76	44.2 Å²	44.2	40%	0.398	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-44.1	169.8	-71.8	164.7	0	0	0	110.9	Q1123 Q1124 W1125 G1130 P1132 A1135	Q1123-L1127 HydrophobicContact CG-CD1 4.16Å; Q1123-L1127 VanDerWaalsContact O-CG 3.28Å; Q1123-L1127 WeakPolarHBondContact O-CG 3.5Å; Q1123-L1127 PolarHBondContact O-N 2.79Å; Q1124-L1127 WeakPolarHBondContact O-CB 3.49Å; Q1124-L1127 PolarHBondContact O-N 2.98Å; W1125-L1127 VanDerWaalsContact C-N 3.32Å; L1127-G1130 PolarHBondContact O-N 3Å; L1127-P1132 HydrophobicContact CD2-CB 3.85Å; L1127-A1135 HydrophobicContact CD2-CB 4.2Å; L1127-A1135 HydrophobicContact CG-CB 3.9Å
1128	E	90.1	Very high	92.5	Very high	107 Å²	107	43.5 Å²	43.5	50%	0.5	23%	0.227	S	C	.	.	H	α-helix	trans	-67.5	-41	176	-77.1	167.2	-139.4	0	0	114	R1110 Q1124 W1125 G1130	R1110-E1128 IonicContact CZ-OE1 2.8Å; R1110-E1128 IonicContact CZ-OE2 3.7Å; R1110-E1128 IonicContact NH1-OE1 2.77Å; R1110-E1128 PolarHBondContact NH1-OE1 3.48Å; R1110-E1128 IonicContact NH1-OE2 2.73Å; R1110-E1128 PolarHBondContact NH1-OE2 2.86Å; R1110-E1128 IonicContact NH2-OE1 3.77Å; R1110-E1128 IonicContact NH2-OE2 3.66Å; R1110-E1128 PolarHBondContact NH2-OE2 2.74Å; Q1124-E1128 WeakPolarHBondContact CG-OE1 3.27Å; Q1124-E1128 PolarHBondContact NE2-OE1 3.14Å; Q1124-E1128 WeakPolarHBondContact O-CG 3.1Å; Q1124-E1128 PolarHBondContact O-N 3.39Å; W1125-E1128 PolarHBondContact O-N 3.13Å; E1128-G1130 PolarHBondContact O-N 2.77Å
1129	E	88.9	Confident	92.5	Very high	56 Å²	56	48.1 Å²	48.1	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-76.2	-4.2	178.5	-83.5	-77.3	-155	0	0	113.7	W1125 F1131 R1173 R1176	W1125-E1129 HydrophobicContact CZ2-CG 4.12Å; W1125-E1129 VanDerWaalsContact NE1-CG 3.31Å; W1125-E1129 PolarHBondContact O-N 2.81Å; E1129-F1131 HydrophobicContact CB-CD2 4.01Å; E1129-F1131 HydrophobicContact CB-CE2 3.99Å; E1129-F1131 WeakPolarHBondContact O-CE2 3.26Å; E1129-R1173 IonicContact OE1-NE 3.58Å; E1129-R1173 PolarHBondContact OE1-NE 3.26Å; E1129-R1173 IonicContact OE2-CZ 2.71Å; E1129-R1173 VanDerWaalsContact OE2-CZ 3.24Å; E1129-R1173 IonicContact OE2-NE 3.87Å; E1129-R1173 PolarHBondContact OE2-NE 3.26Å; E1129-R1173 IonicContact OE2-NH2 3.93Å; E1129-R1173 PolarHBondContact OE2-NH2 3.08Å; E1129-R1176 IonicContact OE1-NH1 3.85Å; E1129-R1176 PolarHBondContact OE1-NH1 2.95Å
1130	G	89.7	Confident	92.4	Very high	53 Å²	53	52.4 Å²	52.4	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	28.8	169	0	0	0	0	0	115.9	L1126 L1127 E1128 P1132	L1126-G1130 PolarHBondContact O-N 3.13Å; L1127-G1130 PolarHBondContact O-N 3Å; E1128-G1130 PolarHBondContact O-N 2.77Å; G1130-P1132 VanDerWaalsContact C-CD 3.45Å; G1130-P1132 WeakPolarHBondContact O-CD 3.4Å
1131	F	93.2	Very high	92.3	Very high	13 Å²	13	54.9 Å²	54.9	6%	0.057	27%	0.271	C	S	.	.			trans	-123.1	62.8	-177.1	-54.9	-80.6	0	0	0	113.3	L1126 E1129 R1133 E1134 A1135 P1166 K1169 I1170	L1126-F1131 HydrophobicContact CD2-CB 4.37Å; L1126-F1131 HydrophobicContact CD2-CD2 4.27Å; L1126-F1131 PolarHBondContact O-N 2.97Å; E1129-F1131 HydrophobicContact CB-CD2 4.01Å; E1129-F1131 HydrophobicContact CB-CE2 3.99Å; E1129-F1131 WeakPolarHBondContact O-CE2 3.26Å; F1131-R1133 PolarHBondContact O-N 2.85Å; F1131-E1134 WeakPolarHBondContact CA-OE2 3.38Å; F1131-E1134 HydrophobicContact CB-CB 3.96Å; F1131-E1134 HydrophobicContact CB-CG 4.42Å; F1131-E1134 CarbonylContact O-C 3.56Å; F1131-E1134 PolarHBondContact O-N 3.02Å; F1131-E1134 VanDerWaalsContact O-N 3.17Å; F1131-A1135 WeakPolarHBondContact O-CB 3.39Å; F1131-A1135 PolarHBondContact O-N 2.78Å; F1131-P1166 HydrophobicContact CD1-CB 4.14Å; F1131-P1166 HydrophobicContact CE1-CB 4.41Å; F1131-K1169 HydrophobicContact CE1-CB 3.73Å; F1131-K1169 HydrophobicContact CE1-CD 3.92Å; F1131-K1169 HydrophobicContact CZ-CB 3.57Å; F1131-K1169 HydrophobicContact CZ-CD 4.11Å; F1131-I1170 HydrophobicContact CB-CD1 4.02Å; F1131-I1170 HydrophobicContact CB-CG1 4.3Å; F1131-I1170 HydrophobicContact CD1-CD1 3.97Å; F1131-I1170 HydrophobicContact CD1-CG1 3.84Å; F1131-I1170 HydrophobicContact CD2-CD1 4.43Å; F1131-I1170 HydrophobicContact CD2-CG1 3.79Å; F1131-I1170 HydrophobicContact CE1-CG1 4.12Å; F1131-I1170 HydrophobicContact CE2-CG1 4.07Å; F1131-I1170 HydrophobicContact CG-CD1 3.87Å; F1131-I1170 HydrophobicContact CG-CG1 3.69Å; F1131-I1170 HydrophobicContact CZ-CG1 4.25Å
1132	P	90.1	Very high	92.3	Very high	74 Å²	74	61.8 Å²	61.8	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-68.5	-28.2	-170	26.8	-36.2	0	0	0	115.4	L1127 G1130 E1134	L1127-P1132 HydrophobicContact CD2-CB 3.85Å; G1130-P1132 VanDerWaalsContact C-CD 3.45Å; G1130-P1132 WeakPolarHBondContact O-CD 3.4Å; P1132-E1134 VanDerWaalsContact C-N 3.34Å
1133	R	89.1	Confident	92.2	Very high	167 Å²	167	62.2 Å²	62.2	63%	0.63	31%	0.306	S	S	*	.	H	α-helix	trans	-78.5	-27.8	174.8	-66	178.2	-58.4	-79.8	-24.8	111.6	F1131 A1137	F1131-R1133 PolarHBondContact O-N 2.85Å; R1133-A1137 PolarHBondContact O-N 2.82Å
1134	E	92.5	Very high	92.2	Very high	7 Å²	7	62 Å²	62	3%	0.033	31%	0.306	C	S	.	.	H	α-helix	trans	-87.9	-29.1	-176.6	-54.5	73.1	-166.5	0	0	109.9	F1131 P1132 E1136 A1137 F1138 I1162 P1166 I1170	F1131-E1134 WeakPolarHBondContact CA-OE2 3.38Å; F1131-E1134 HydrophobicContact CB-CB 3.96Å; F1131-E1134 HydrophobicContact CB-CG 4.42Å; F1131-E1134 CarbonylContact O-C 3.56Å; F1131-E1134 PolarHBondContact O-N 3.02Å; F1131-E1134 VanDerWaalsContact O-N 3.17Å; P1132-E1134 VanDerWaalsContact C-N 3.34Å; E1134-E1136 VanDerWaalsContact C-N 3.31Å; E1134-E1136 PolarHBondContact O-N 2.89Å; E1134-A1137 CarbonylContact O-C 3.42Å; E1134-A1137 WeakPolarHBondContact O-CB 3.41Å; E1134-A1137 PolarHBondContact O-N 2.97Å; E1134-A1137 VanDerWaalsContact O-N 3.12Å; E1134-F1138 VanDerWaalsContact O-CD2 3.25Å; E1134-F1138 WeakPolarHBondContact O-CD2 3.41Å; E1134-F1138 PolarHBondContact O-N 2.92Å; E1134-I1162 HydrophobicContact CB-CD1 4.02Å; E1134-I1162 HydrophobicContact CB-CG1 4.3Å; E1134-I1162 HydrophobicContact CB-CG2 4.37Å; E1134-I1162 HydrophobicContact CG-CD1 4.4Å; E1134-I1162 HydrophobicContact CG-CG1 4.24Å; E1134-I1162 HydrophobicContact CG-CG2 3.61Å; E1134-P1166 HydrophobicContact CG-CB 3.85Å; E1134-I1170 HydrophobicContact CB-CD1 3.55Å; E1134-I1170 HydrophobicContact CG-CD1 4.01Å
1135	A	93.7	Very high	92.2	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-44	164.1	0	0	0	0	0	111.6	Q1123 L1126 L1127 F1131 A1137 F1138 Y1139	Q1123-A1135 HydrophobicContact CG-CB 4.03Å; L1126-A1135 HydrophobicContact CB-CB 3.56Å; L1127-A1135 HydrophobicContact CD2-CB 4.2Å; L1127-A1135 HydrophobicContact CG-CB 3.9Å; F1131-A1135 WeakPolarHBondContact O-CB 3.39Å; F1131-A1135 PolarHBondContact O-N 2.78Å; A1135-A1137 VanDerWaalsContact C-N 3.34Å; A1135-F1138 PolarHBondContact O-N 3.42Å; A1135-Y1139 WeakPolarHBondContact O-CB 3.32Å; A1135-Y1139 PolarHBondContact O-N 3.36Å
1136	E	91	Very high	92	Very high	84 Å²	84	60.7 Å²	60.7	39%	0.393	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-41.6	172.2	-177.2	62.6	-162.6	0	0	111.6	E1134 Y1139 Q1140	E1134-E1136 VanDerWaalsContact C-N 3.31Å; E1134-E1136 PolarHBondContact O-N 2.89Å; E1136-Y1139 PolarHBondContact O-N 3.47Å; E1136-Q1140 HydrophobicContact CG-CG 4.5Å; E1136-Q1140 WeakPolarHBondContact O-CB 3.29Å; E1136-Q1140 VanDerWaalsContact O-CG 3.24Å; E1136-Q1140 WeakPolarHBondContact O-CG 3.42Å; E1136-Q1140 PolarHBondContact O-N 2.93Å; E1136-Q1140 PolarHBondContact OE1-NE2 3.32Å
1137	A	91.3	Very high	91.9	Very high	18 Å²	18	63.3 Å²	63.3	15%	0.149	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-39.1	175.8	0	0	0	0	0	112.8	R1133 E1134 A1135 Q1141 I1162	R1133-A1137 PolarHBondContact O-N 2.82Å; E1134-A1137 CarbonylContact O-C 3.42Å; E1134-A1137 WeakPolarHBondContact O-CB 3.41Å; E1134-A1137 PolarHBondContact O-N 2.97Å; E1134-A1137 VanDerWaalsContact O-N 3.12Å; A1135-A1137 VanDerWaalsContact C-N 3.34Å; A1137-Q1141 WeakPolarHBondContact O-CB 3.47Å; A1137-Q1141 WeakPolarHBondContact O-CG 3.42Å; A1137-Q1141 PolarHBondContact O-N 3.39Å; A1137-Q1141 VanDerWaalsContact O-N 3.14Å; A1137-I1162 HydrophobicContact CB-CD1 4.48Å; A1137-I1162 HydrophobicContact CB-CG1 4.26Å
1138	F	94.1	Very high	91.9	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-66.9	-38.8	174.4	-88.6	-116.2	0	0	0	112	V1122 L1126 E1134 A1135 Q1141 E1142 I1143 L1148 M1151 L1160 I1162 I1170 I1174	V1122-F1138 HydrophobicContact CG1-CD1 3.74Å; V1122-F1138 HydrophobicContact CG1-CE1 4.48Å; L1126-F1138 HydrophobicContact CD1-CB 3.53Å; L1126-F1138 HydrophobicContact CD1-CD1 3.52Å; L1126-F1138 HydrophobicContact CD1-CD2 3.42Å; L1126-F1138 VanDerWaalsContact CD1-CD2 3.42Å; L1126-F1138 HydrophobicContact CD1-CE1 4.02Å; L1126-F1138 HydrophobicContact CD1-CE2 3.9Å; L1126-F1138 HydrophobicContact CD1-CG 3.19Å; L1126-F1138 HydrophobicContact CD1-CZ 4.19Å; E1134-F1138 VanDerWaalsContact O-CD2 3.25Å; E1134-F1138 WeakPolarHBondContact O-CD2 3.41Å; E1134-F1138 PolarHBondContact O-N 2.92Å; A1135-F1138 PolarHBondContact O-N 3.42Å; F1138-Q1141 CarbonylContact O-C 3.39Å; F1138-Q1141 PolarHBondContact O-N 3.4Å; F1138-E1142 PolarHBondContact O-N 3.36Å; F1138-I1143 HydrophobicContact CB-CB 4.35Å; F1138-I1143 HydrophobicContact CB-CD1 4.32Å; F1138-I1143 HydrophobicContact CD1-CB 3.77Å; F1138-I1143 HydrophobicContact CD1-CD1 3.57Å; F1138-I1143 HydrophobicContact CD1-CG1 4.21Å; F1138-I1143 HydrophobicContact CD1-CG2 3.64Å; F1138-I1143 HydrophobicContact CD2-CD1 4.47Å; F1138-I1143 HydrophobicContact CE1-CD1 3.95Å; F1138-I1143 HydrophobicContact CE1-CG2 4.01Å; F1138-I1143 HydrophobicContact CG-CB 4.4Å; F1138-I1143 HydrophobicContact CG-CD1 3.86Å; F1138-I1143 PolarHBondContact O-N 3.35Å; F1138-L1148 HydrophobicContact CD1-CD1 4.26Å; F1138-L1148 HydrophobicContact CE1-CD1 3.63Å; F1138-M1151 HydrophobicContact CD1-SD 4.4Å; F1138-M1151 HydrophobicContact CE1-SD 3.43Å; F1138-M1151 WeakPolarHBondContact CE1-SD 3.39Å; F1138-M1151 HydrophobicContact CZ-SD 3.71Å; F1138-L1160 HydrophobicContact CD2-CD1 3.56Å; F1138-L1160 HydrophobicContact CE1-CD1 4.23Å; F1138-L1160 HydrophobicContact CE2-CD1 3.21Å; F1138-L1160 HydrophobicContact CG-CD1 4.24Å; F1138-L1160 HydrophobicContact CZ-CD1 3.57Å; F1138-I1162 HydrophobicContact CD2-CD1 3.95Å; F1138-I1162 HydrophobicContact CE2-CD1 3.58Å; F1138-I1170 HydrophobicContact CE2-CD1 4.39Å; F1138-I1170 HydrophobicContact CE2-CG2 3.93Å; F1138-I1170 HydrophobicContact CZ-CG2 3.59Å; F1138-I1174 HydrophobicContact CE1-CD1 4.18Å; F1138-I1174 HydrophobicContact CZ-CD1 4.03Å
1139	Y	94.2	Very high	91.9	Very high	105 Å²	105	55 Å²	55	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-66.4	-43.9	175.4	-177.3	-88.8	0	0	0	111.8	V1119 Q1123 A1135 E1136 Q1141 E1142	V1119-Y1139 HydrophobicContact CG1-CD2 3.85Å; V1119-Y1139 HydrophobicContact CG1-CE2 4.49Å; V1119-Y1139 HydrophobicContact CG1-CG 4.33Å; Q1123-Y1139 HydrophobicContact CB-CD2 4.21Å; Q1123-Y1139 VanDerWaalsContact CD-CD2 3.49Å; Q1123-Y1139 HydrophobicContact CG-CD2 4.26Å; Q1123-Y1139 HydrophobicContact CG-CG 4.46Å; Q1123-Y1139 VanDerWaalsContact NE2-CG 3.28Å; A1135-Y1139 WeakPolarHBondContact O-CB 3.32Å; A1135-Y1139 PolarHBondContact O-N 3.36Å; E1136-Y1139 PolarHBondContact O-N 3.47Å; Y1139-Q1141 PolarHBondContact O-N 2.8Å; Y1139-E1142 PolarHBondContact O-N 2.86Å; Y1139-E1142 VanDerWaalsContact O-N 3.1Å
1140	Q	91.9	Very high	91.9	Very high	124 Å²	124	56.7 Å²	56.7	58%	0.579	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-8.9	174.1	-71.8	178.7	10.5	0	0	114.5	E1136	E1136-Q1140 HydrophobicContact CG-CG 4.5Å; E1136-Q1140 WeakPolarHBondContact O-CB 3.29Å; E1136-Q1140 VanDerWaalsContact O-CG 3.24Å; E1136-Q1140 WeakPolarHBondContact O-CG 3.42Å; E1136-Q1140 PolarHBondContact O-N 2.93Å; E1136-Q1140 PolarHBondContact OE1-NE2 3.32Å
1141	Q	91.4	Very high	92	Very high	117 Å²	117	54.8 Å²	54.8	55%	0.547	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	14.9	174.4	-62.9	-68.2	-70.4	0	0	111.3	A1137 F1138 Y1139 I1143 L1160	A1137-Q1141 WeakPolarHBondContact O-CB 3.47Å; A1137-Q1141 WeakPolarHBondContact O-CG 3.42Å; A1137-Q1141 PolarHBondContact O-N 3.39Å; A1137-Q1141 VanDerWaalsContact O-N 3.14Å; F1138-Q1141 CarbonylContact O-C 3.39Å; F1138-Q1141 PolarHBondContact O-N 3.4Å; Y1139-Q1141 PolarHBondContact O-N 2.8Å; Q1141-I1143 HydrophobicContact CB-CD1 4.06Å; Q1141-I1143 HydrophobicContact CB-CG1 3.97Å; Q1141-I1143 WeakPolarHBondContact O-CG1 3.15Å; Q1141-I1143 PolarHBondContact O-N 2.85Å; Q1141-I1143 VanDerWaalsContact O-N 3.11Å; Q1141-L1160 HydrophobicContact CB-CD2 4.07Å; Q1141-L1160 HydrophobicContact CG-CD2 3.9Å
1142	E	93.5	Very high	91.8	Very high	154 Å²	154	59.1 Å²	59.1	72%	0.72	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	34.1	173.4	-59.1	-177.3	163.3	0	0	114.1	V1119 F1138 Y1139 D1144	V1119-E1142 HydrophobicContact CG2-CB 4.42Å; V1119-E1142 WeakPolarHBondContact CG2-O 3.09Å; F1138-E1142 PolarHBondContact O-N 3.36Å; Y1139-E1142 PolarHBondContact O-N 2.86Å; Y1139-E1142 VanDerWaalsContact O-N 3.1Å; E1142-D1144 PolarHBondContact O-N 3.08Å; E1142-D1144 VanDerWaalsContact O-N 3.09Å
1143	I	93.6	Very high	91.8	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.051	28%	0.282	C	S	.	.			trans	-78.9	99.9	-174.3	-55.6	-177.6	0	0	0	110.3	V1122 F1138 Q1141 C1147 L1148 M1151 L1160	V1122-I1143 WeakPolarHBondContact CB-O 3.44Å; V1122-I1143 HydrophobicContact CG1-CG2 4.38Å; V1122-I1143 WeakPolarHBondContact CG1-O 3.44Å; V1122-I1143 VanDerWaalsContact CG2-O 3.31Å; V1122-I1143 WeakPolarHBondContact CG2-O 3.37Å; F1138-I1143 HydrophobicContact CB-CB 4.35Å; F1138-I1143 HydrophobicContact CB-CD1 4.32Å; F1138-I1143 HydrophobicContact CD1-CB 3.77Å; F1138-I1143 HydrophobicContact CD1-CD1 3.57Å; F1138-I1143 HydrophobicContact CD1-CG1 4.21Å; F1138-I1143 HydrophobicContact CD1-CG2 3.64Å; F1138-I1143 HydrophobicContact CD2-CD1 4.47Å; F1138-I1143 HydrophobicContact CE1-CD1 3.95Å; F1138-I1143 HydrophobicContact CE1-CG2 4.01Å; F1138-I1143 HydrophobicContact CG-CB 4.4Å; F1138-I1143 HydrophobicContact CG-CD1 3.86Å; F1138-I1143 PolarHBondContact O-N 3.35Å; Q1141-I1143 HydrophobicContact CB-CD1 4.06Å; Q1141-I1143 HydrophobicContact CB-CG1 3.97Å; Q1141-I1143 WeakPolarHBondContact O-CG1 3.15Å; Q1141-I1143 PolarHBondContact O-N 2.85Å; Q1141-I1143 VanDerWaalsContact O-N 3.11Å; I1143-C1147 HydrophobicContact CG2-CB 3.84Å; I1143-L1148 HydrophobicContact CG2-CB 4.38Å; I1143-M1151 HydrophobicContact CD1-CE 3.97Å; I1143-M1151 HydrophobicContact CD1-SD 3.94Å; I1143-M1151 HydrophobicContact CG2-SD 4.14Å; I1143-L1160 HydrophobicContact CD1-CD1 3.7Å; I1143-L1160 HydrophobicContact CD1-CD2 3.63Å; I1143-L1160 HydrophobicContact CD1-CG 4.33Å
1144	D	94.5	Very high	91.7	Very high	37 Å²	37	55.3 Å²	55.3	20%	0.198	27%	0.268	C	S	.	.			trans	-82.4	-174	169.2	72.3	23.4	0	0	0	113.1	V1119 V1122 E1142 T1146 C1147 L1148	V1119-D1144 HydrophobicContact CG2-CB 4.12Å; V1122-D1144 VanDerWaalsContact CG2-C 3.45Å; E1142-D1144 PolarHBondContact O-N 3.08Å; E1142-D1144 VanDerWaalsContact O-N 3.09Å; D1144-T1146 VanDerWaalsContact CG-OG1 3.26Å; D1144-T1146 WeakPolarHBondContact OD1-CB 3.47Å; D1144-T1146 PolarHBondContact OD1-N 3.19Å; D1144-T1146 VanDerWaalsContact OD1-N 3.08Å; D1144-T1146 PolarHBondContact OD1-OG1 3.12Å; D1144-T1146 PolarHBondContact OD2-OG1 2.92Å; D1144-C1147 PolarHBondContact O-N 3.46Å; D1144-C1147 WeakPolarHBondContact OD1-CB 3.17Å; D1144-C1147 PolarHBondContact OD1-N 2.88Å; D1144-L1148 WeakPolarHBondContact O-CB 3.41Å; D1144-L1148 PolarHBondContact O-N 3.39Å
1145	G	92.3	Very high	91.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-41.1	-177.2	0	0	0	0	0	114.9	V1114 W1117 L1148 L1149	V1114-G1145 CarbonylContact O-C 3.38Å; V1114-G1145 WeakPolarHBondContact O-CA 3.49Å; W1117-G1145 WeakPolarHBondContact O-CA 3.39Å; W1117-G1145 PolarHBondContact O-N 3.15Å; G1145-L1148 PolarHBondContact O-N 2.87Å; G1145-L1149 WeakPolarHBondContact O-CG 3.39Å; G1145-L1149 PolarHBondContact O-N 3.48Å
1146	T	88.9	Confident	91.4	Very high	70 Å²	70	56.6 Å²	56.6	43%	0.429	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-51	170.9	18.3	0	0	0	0	110.8	S1115 D1144 L1148 L1149 L1150	S1115-T1146 PolarHBondContact O-N 3.15Å; D1144-T1146 VanDerWaalsContact CG-OG1 3.26Å; D1144-T1146 WeakPolarHBondContact OD1-CB 3.47Å; D1144-T1146 PolarHBondContact OD1-N 3.19Å; D1144-T1146 VanDerWaalsContact OD1-N 3.08Å; D1144-T1146 PolarHBondContact OD1-OG1 3.12Å; D1144-T1146 PolarHBondContact OD2-OG1 2.92Å; T1146-L1148 VanDerWaalsContact C-N 3.33Å; T1146-L1148 PolarHBondContact O-N 3.43Å; T1146-L1149 PolarHBondContact O-N 2.81Å; T1146-L1150 WeakPolarHBondContact O-CB 3.18Å; T1146-L1150 VanDerWaalsContact O-CG 3.31Å; T1146-L1150 WeakPolarHBondContact O-CG 3.24Å; T1146-L1150 PolarHBondContact O-N 3.45Å
1147	C	92.4	Very high	91.3	Very high	55 Å²	55	54.5 Å²	54.5	37%	0.372	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-44.3	173.6	-71.2	0	0	0	0	111.3	I1143 D1144 L1149 L1150 M1151	I1143-C1147 HydrophobicContact CG2-CB 3.84Å; D1144-C1147 PolarHBondContact O-N 3.46Å; D1144-C1147 WeakPolarHBondContact OD1-CB 3.17Å; D1144-C1147 PolarHBondContact OD1-N 2.88Å; C1147-L1149 VanDerWaalsContact C-N 3.34Å; C1147-L1149 PolarHBondContact O-N 2.84Å; C1147-L1150 CarbonylContact O-C 3.59Å; C1147-L1150 PolarHBondContact O-N 3.23Å; C1147-L1150 VanDerWaalsContact O-N 3.13Å; C1147-M1151 WeakPolarHBondContact O-CG 3.35Å; C1147-M1151 PolarHBondContact O-N 2.92Å
1148	L	92.9	Very high	90.8	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-39.5	179.6	-171	69.4	0	0	0	112.6	V1114 W1117 V1122 W1125 F1138 I1143 D1144 G1145 T1146 I1174 F1177	V1114-L1148 HydrophobicContact CG1-CD2 4.06Å; W1117-L1148 HydrophobicContact CE3-CD2 4.01Å; W1117-L1148 HydrophobicContact CZ3-CD2 3.99Å; V1122-L1148 HydrophobicContact CG1-CD1 3.98Å; V1122-L1148 HydrophobicContact CG1-CD2 4.17Å; V1122-L1148 HydrophobicContact CG1-CG 4.49Å; V1122-L1148 HydrophobicContact CG2-CB 4.15Å; V1122-L1148 HydrophobicContact CG2-CD2 4Å; W1125-L1148 HydrophobicContact CE3-CD1 4.44Å; W1125-L1148 HydrophobicContact CE3-CD2 3.82Å; W1125-L1148 HydrophobicContact CH2-CD1 4.49Å; W1125-L1148 HydrophobicContact CZ3-CD1 3.77Å; W1125-L1148 HydrophobicContact CZ3-CD2 3.82Å; W1125-L1148 HydrophobicContact CZ3-CG 4.41Å; F1138-L1148 HydrophobicContact CD1-CD1 4.26Å; F1138-L1148 HydrophobicContact CE1-CD1 3.63Å; I1143-L1148 HydrophobicContact CG2-CB 4.38Å; D1144-L1148 WeakPolarHBondContact O-CB 3.41Å; D1144-L1148 PolarHBondContact O-N 3.39Å; G1145-L1148 PolarHBondContact O-N 2.87Å; T1146-L1148 VanDerWaalsContact C-N 3.33Å; T1146-L1148 PolarHBondContact O-N 3.43Å; L1148-I1174 HydrophobicContact CD1-CD1 3.67Å; L1148-I1174 HydrophobicContact CD1-CG1 3.54Å; L1148-I1174 HydrophobicContact CG-CG1 4.15Å; L1148-I1174 VanDerWaalsContact O-CG2 3.29Å; L1148-I1174 WeakPolarHBondContact O-CG2 3.45Å; L1148-F1177 HydrophobicContact CD2-CD2 3.95Å; L1148-F1177 HydrophobicContact CD2-CE2 4.07Å
1149	L	91.5	Very high	90.1	Very high	7 Å²	7	59.9 Å²	59.9	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-73	-33.8	174.5	-72.9	177.9	0	0	0	112.5	V1114 G1145 T1146 C1147 F1177 Q1178 C1181 P1184	V1114-L1149 HydrophobicContact CB-CD1 4.25Å; V1114-L1149 HydrophobicContact CB-CD2 4.09Å; V1114-L1149 HydrophobicContact CB-CG 4.2Å; V1114-L1149 HydrophobicContact CG1-CD2 4.04Å; V1114-L1149 HydrophobicContact CG1-CG 4.01Å; G1145-L1149 WeakPolarHBondContact O-CG 3.39Å; G1145-L1149 PolarHBondContact O-N 3.48Å; T1146-L1149 PolarHBondContact O-N 2.81Å; C1147-L1149 VanDerWaalsContact C-N 3.34Å; C1147-L1149 PolarHBondContact O-N 2.84Å; L1149-F1177 HydrophobicContact CD2-CB 3.67Å; L1149-Q1178 VanDerWaalsContact O-CG 3.32Å; L1149-Q1178 WeakPolarHBondContact O-CG 3.38Å; L1149-Q1178 PolarHBondContact O-NE2 3.3Å; L1149-C1181 HydrophobicContact CD1-CB 4.27Å; L1149-C1181 HydrophobicContact CD2-CB 4.39Å; L1149-P1184 HydrophobicContact CB-CG 4.04Å; L1149-P1184 HydrophobicContact CD1-CG 4.46Å
1150	L	88.9	Confident	89.6	Confident	93 Å²	93	55.9 Å²	55.9	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-78	-20.8	177.8	-68.6	170.9	0	0	0	113.6	T1146 C1147 K1152 P1184	T1146-L1150 WeakPolarHBondContact O-CB 3.18Å; T1146-L1150 VanDerWaalsContact O-CG 3.31Å; T1146-L1150 WeakPolarHBondContact O-CG 3.24Å; T1146-L1150 PolarHBondContact O-N 3.45Å; C1147-L1150 CarbonylContact O-C 3.59Å; C1147-L1150 PolarHBondContact O-N 3.23Å; C1147-L1150 VanDerWaalsContact O-N 3.13Å; L1150-K1152 PolarHBondContact O-N 3.28Å; L1150-K1152 VanDerWaalsContact O-N 3.13Å; L1150-P1184 HydrophobicContact CD2-CG 4.41Å
1151	M	90.4	Very high	89.2	Confident	12 Å²	12	53 Å²	53	6%	0.059	28%	0.278	C	S	.	.			trans	-52.9	116.2	-177.1	-72.8	-149.8	87.2	0	0	112.9	F1138 I1143 C1147 D1155 V1156 L1160 I1174 Q1178	F1138-M1151 HydrophobicContact CD1-SD 4.4Å; F1138-M1151 HydrophobicContact CE1-SD 3.43Å; F1138-M1151 WeakPolarHBondContact CE1-SD 3.39Å; F1138-M1151 HydrophobicContact CZ-SD 3.71Å; I1143-M1151 HydrophobicContact CD1-CE 3.97Å; I1143-M1151 HydrophobicContact CD1-SD 3.94Å; I1143-M1151 HydrophobicContact CG2-SD 4.14Å; C1147-M1151 WeakPolarHBondContact O-CG 3.35Å; C1147-M1151 PolarHBondContact O-N 2.92Å; M1151-D1155 HydrophobicContact CE-CB 3.62Å; M1151-V1156 HydrophobicContact CB-CG2 4.1Å; M1151-V1156 HydrophobicContact CE-CB 4.44Å; M1151-V1156 HydrophobicContact CE-CG2 3.53Å; M1151-V1156 HydrophobicContact SD-CG2 3.65Å; M1151-L1160 HydrophobicContact CE-CD1 3.72Å; M1151-L1160 HydrophobicContact CE-CD2 4.28Å; M1151-L1160 HydrophobicContact CE-CG 4.12Å; M1151-L1160 HydrophobicContact SD-CD1 4.4Å; M1151-I1174 HydrophobicContact CB-CD1 4.26Å; M1151-I1174 HydrophobicContact CB-CG2 4.32Å; M1151-I1174 HydrophobicContact SD-CD1 3.94Å; M1151-Q1178 PolarHBondContact O-NE2 2.72Å
1152	K	89.8	Confident	89	Confident	105 Å²	105	48.2 Å²	48.2	46%	0.457	26%	0.256	S	S	.	.			trans	-83	173	174.6	-54.3	166.2	-173.8	165.4	0	110	L1150 M1154 D1155	L1150-K1152 PolarHBondContact O-N 3.28Å; L1150-K1152 VanDerWaalsContact O-N 3.13Å; K1152-M1154 VanDerWaalsContact C-N 3.25Å; K1152-M1154 PolarHBondContact O-N 2.85Å; K1152-D1155 WeakPolarHBondContact CB-OD1 3.39Å; K1152-D1155 PolarHBondContact N-OD2 2.65Å
1153	R	89.8	Confident	88.8	Confident	96 Å²	96	48.4 Å²	48.4	36%	0.362	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-32.5	178.9	-175.7	179.1	-72.7	112.5	-2.8	112.8	D806 L1157 Y1171	D806-R1153 VanDerWaalsContact CG-NH2 3.34Å; D806-R1153 IonicContact OD1-CZ 3.27Å; D806-R1153 IonicContact OD1-NH1 2.86Å; D806-R1153 IonicContact OD1-NH2 2.74Å; D806-R1153 PolarHBondContact OD1-NH2 3.48Å; D806-R1153 IonicContact OD2-NH2 2.73Å; R1153-L1157 HydrophobicContact CG-CD1 3.69Å; R1153-L1157 HydrophobicContact CG-CG 4.27Å; R1153-L1157 VanDerWaalsContact O-CB 3.28Å; R1153-L1157 WeakPolarHBondContact O-CB 3.23Å; R1153-L1157 WeakPolarHBondContact O-CG 3.38Å; R1153-L1157 PolarHBondContact O-N 2.98Å; R1153-Y1171 HydrophobicContact CB-CD1 4.32Å; R1153-Y1171 HydrophobicContact CB-CE1 3.78Å; R1153-Y1171 HydrophobicContact CB-CE2 4.07Å; R1153-Y1171 HydrophobicContact CG-CD1 4.16Å; R1153-Y1171 HydrophobicContact CG-CE1 3.96Å
1154	M	88.1	Confident	88.5	Confident	65 Å²	65	53.7 Å²	53.7	32%	0.32	28%	0.282	S	S	.	.	H	α-helix	trans	-72.3	-57.1	-175	-161.4	61.6	77	0	0	110.1	V881 A882 K1152 V1156 L1157 T1158	V881-M1154 HydrophobicContact CG1-CE 4.26Å; A882-M1154 HydrophobicContact CB-CG 4.19Å; K1152-M1154 VanDerWaalsContact C-N 3.25Å; K1152-M1154 PolarHBondContact O-N 2.85Å; M1154-V1156 VanDerWaalsContact C-N 3.32Å; M1154-V1156 PolarHBondContact O-N 2.87Å; M1154-V1156 VanDerWaalsContact O-N 3.15Å; M1154-L1157 CarbonylContact O-C 3.44Å; M1154-L1157 WeakPolarHBondContact O-CA 3.24Å; M1154-L1157 PolarHBondContact O-N 2.69Å; M1154-T1158 HydrophobicContact CG-CG2 4.48Å; M1154-T1158 WeakPolarHBondContact CG-OG1 3.43Å; M1154-T1158 PolarHBondContact O-N 2.78Å; M1154-T1158 PolarHBondContact O-OG1 3Å; M1154-T1158 HydrophobicContact SD-CG2 3.73Å
1155	D	89.1	Confident	88.3	Confident	35 Å²	35	54 Å²	54	19%	0.187	29%	0.294	C	S	.	.	I	π-helix	trans	-34.6	-60	176.6	-37.5	9.4	0	0	0	111.3	M1151 K1152 E1159 L1160	M1151-D1155 HydrophobicContact CE-CB 3.62Å; K1152-D1155 WeakPolarHBondContact CB-OD1 3.39Å; K1152-D1155 PolarHBondContact N-OD2 2.65Å; D1155-E1159 WeakPolarHBondContact O-CB 3.49Å; D1155-E1159 PolarHBondContact O-N 2.87Å; D1155-L1160 PolarHBondContact O-N 3.46Å
1156	V	89.2	Confident	88.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	I	π-helix	trans	-68.3	-40	179.5	-173.5	0	0	0	0	113.1	M1151 M1154 A1167 I1170 Y1171 I1174	M1151-V1156 HydrophobicContact CB-CG2 4.1Å; M1151-V1156 HydrophobicContact CE-CB 4.44Å; M1151-V1156 HydrophobicContact CE-CG2 3.53Å; M1151-V1156 HydrophobicContact SD-CG2 3.65Å; M1154-V1156 VanDerWaalsContact C-N 3.32Å; M1154-V1156 PolarHBondContact O-N 2.87Å; M1154-V1156 VanDerWaalsContact O-N 3.15Å; V1156-A1167 HydrophobicContact CG1-CB 4.37Å; V1156-A1167 WeakPolarHBondContact CG1-O 3.28Å; V1156-A1167 WeakPolarHBondContact O-CB 3.41Å; V1156-I1170 HydrophobicContact CG1-CB 4.18Å; V1156-I1170 HydrophobicContact CG1-CG2 4.03Å; V1156-Y1171 HydrophobicContact CG2-CD2 4.09Å; V1156-I1174 HydrophobicContact CG2-CD1 3.66Å
1157	L	89.1	Confident	88.5	Confident	40 Å²	40	52 Å²	52	21%	0.209	28%	0.282	C	S	.	.	I	π-helix	trans	-76	-22.9	-176	-70.3	-172.4	0	0	0	113.8	R1153 M1154 L1164 A1167 V1168	R1153-L1157 HydrophobicContact CG-CD1 3.69Å; R1153-L1157 HydrophobicContact CG-CG 4.27Å; R1153-L1157 VanDerWaalsContact O-CB 3.28Å; R1153-L1157 WeakPolarHBondContact O-CB 3.23Å; R1153-L1157 WeakPolarHBondContact O-CG 3.38Å; R1153-L1157 PolarHBondContact O-N 2.98Å; M1154-L1157 CarbonylContact O-C 3.44Å; M1154-L1157 WeakPolarHBondContact O-CA 3.24Å; M1154-L1157 PolarHBondContact O-N 2.69Å; L1157-L1164 HydrophobicContact CD2-CD1 4.18Å; L1157-A1167 HydrophobicContact CD2-CB 3.66Å; L1157-V1168 HydrophobicContact CD2-CB 4.34Å; L1157-V1168 HydrophobicContact CD2-CG2 3.57Å
1158	T	81.7	Confident	88.4	Confident	21 Å²	21	52.2 Å²	52.2	13%	0.129	28%	0.282	C	S	.	.	I	π-helix	trans	-137.6	-39.9	-165	63.3	0	0	0	0	115.3	G884 T885 M1154	G884-T1158 VanDerWaalsContact CA-CB 3.45Å; T885-T1158 PolarHBondContact OG1-O 3.41Å; M1154-T1158 HydrophobicContact CG-CG2 4.48Å; M1154-T1158 WeakPolarHBondContact CG-OG1 3.43Å; M1154-T1158 PolarHBondContact O-N 2.78Å; M1154-T1158 PolarHBondContact O-OG1 3Å; M1154-T1158 HydrophobicContact SD-CG2 3.73Å
1159	E	79.7	Confident	88.4	Confident	110 Å²	110	57.5 Å²	57.5	51%	0.514	31%	0.305	S	S	.	.	I	π-helix	trans	-84.6	-38.1	-167.8	-54.2	-172.8	158.9	0	0	110.8	D1155 G1161	D1155-E1159 WeakPolarHBondContact O-CB 3.49Å; D1155-E1159 PolarHBondContact O-N 2.87Å; E1159-G1161 PolarHBondContact O-N 2.7Å; E1159-G1161 VanDerWaalsContact O-N 3.07Å
1160	L	82.2	Confident	88.5	Confident	22 Å²	22	57.2 Å²	57.2	12%	0.115	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	2.4	176	-52.6	-170.6	0	0	0	115.2	F1138 Q1141 I1143 M1151 D1155 I1162	F1138-L1160 HydrophobicContact CD2-CD1 3.56Å; F1138-L1160 HydrophobicContact CE1-CD1 4.23Å; F1138-L1160 HydrophobicContact CE2-CD1 3.21Å; F1138-L1160 HydrophobicContact CG-CD1 4.24Å; F1138-L1160 HydrophobicContact CZ-CD1 3.57Å; Q1141-L1160 HydrophobicContact CB-CD2 4.07Å; Q1141-L1160 HydrophobicContact CG-CD2 3.9Å; I1143-L1160 HydrophobicContact CD1-CD1 3.7Å; I1143-L1160 HydrophobicContact CD1-CD2 3.63Å; I1143-L1160 HydrophobicContact CD1-CG 4.33Å; M1151-L1160 HydrophobicContact CE-CD1 3.72Å; M1151-L1160 HydrophobicContact CE-CD2 4.28Å; M1151-L1160 HydrophobicContact CE-CG 4.12Å; M1151-L1160 HydrophobicContact SD-CD1 4.4Å; D1155-L1160 PolarHBondContact O-N 3.46Å; L1160-I1162 HydrophobicContact CB-CD1 3.65Å; L1160-I1162 HydrophobicContact CB-CG1 3.83Å; L1160-I1162 HydrophobicContact CD1-CD1 3.74Å; L1160-I1162 HydrophobicContact CG-CD1 4.36Å; L1160-I1162 PolarHBondContact O-N 2.69Å
1161	G	84.4	Confident	88.8	Confident	63 Å²	63	54 Å²	54	65%	0.649	29%	0.285	S	S	*	.			trans	64	9.4	-177.3	0	0	0	0	0	115.3	E1159	E1159-G1161 PolarHBondContact O-N 2.7Å; E1159-G1161 VanDerWaalsContact O-N 3.07Å
1162	I	87.2	Confident	88.8	Confident	16 Å²	16	57.7 Å²	57.7	8%	0.082	30%	0.302	C	S	.	.			trans	-72.5	140.9	-175.7	-63.2	168	0	0	0	110.5	E1134 A1137 F1138 L1160 L1164 P1166 A1167 I1170	E1134-I1162 HydrophobicContact CB-CD1 4.02Å; E1134-I1162 HydrophobicContact CB-CG1 4.3Å; E1134-I1162 HydrophobicContact CB-CG2 4.37Å; E1134-I1162 HydrophobicContact CG-CD1 4.4Å; E1134-I1162 HydrophobicContact CG-CG1 4.24Å; E1134-I1162 HydrophobicContact CG-CG2 3.61Å; A1137-I1162 HydrophobicContact CB-CD1 4.48Å; A1137-I1162 HydrophobicContact CB-CG1 4.26Å; F1138-I1162 HydrophobicContact CD2-CD1 3.95Å; F1138-I1162 HydrophobicContact CE2-CD1 3.58Å; L1160-I1162 HydrophobicContact CB-CD1 3.65Å; L1160-I1162 HydrophobicContact CB-CG1 3.83Å; L1160-I1162 HydrophobicContact CD1-CD1 3.74Å; L1160-I1162 HydrophobicContact CG-CD1 4.36Å; L1160-I1162 PolarHBondContact O-N 2.69Å; I1162-L1164 PolarHBondContact O-N 3.39Å; I1162-P1166 HydrophobicContact CG2-CB 3.81Å; I1162-A1167 HydrophobicContact CB-CB 4.14Å; I1162-A1167 HydrophobicContact CG2-CB 3.78Å; I1162-I1170 HydrophobicContact CD1-CD1 4.32Å
1163	K	90.1	Very high	88.9	Confident	159 Å²	159	54.5 Å²	54.5	69%	0.691	29%	0.287	S	S	*	.			trans	-61.1	134.8	175.2	-67.6	177.3	-178.7	175.3	0	110.3	G1165 P1166 A1167	K1163-G1165 PolarHBondContact O-N 3.4Å; K1163-P1166 HydrophobicContact CB-CG 4.43Å; K1163-P1166 WeakPolarHBondContact O-CD 3.47Å; K1163-A1167 PolarHBondContact O-N 2.84Å
1164	L	87.1	Confident	89	Confident	120 Å²	120	49.9 Å²	49.9	63%	0.628	27%	0.27	S	S	*	.	H	α-helix	trans	-45.4	-37.9	-175.5	-169.9	73	0	0	0	114.7	L1157 I1162 V1168	L1157-L1164 HydrophobicContact CD2-CD1 4.18Å; I1162-L1164 PolarHBondContact O-N 3.39Å; L1164-V1168 HydrophobicContact CD1-CG2 4.4Å; L1164-V1168 HydrophobicContact CG-CG2 4.42Å; L1164-V1168 WeakPolarHBondContact O-CB 3.04Å; L1164-V1168 VanDerWaalsContact O-CG2 3.26Å; L1164-V1168 WeakPolarHBondContact O-CG2 3.43Å; L1164-V1168 PolarHBondContact O-N 3.33Å
1165	G	89.3	Confident	89.1	Confident	43 Å²	43	50.3 Å²	50.3	44%	0.443	27%	0.27	S	S	.	.	H	α-helix	trans	-62.1	-63	177.5	0	0	0	0	0	113.6	K1163 A1167 K1169	K1163-G1165 PolarHBondContact O-N 3.4Å; G1165-A1167 VanDerWaalsContact C-N 3.33Å; G1165-A1167 PolarHBondContact O-N 2.92Å; G1165-K1169 WeakPolarHBondContact O-CG 3.41Å; G1165-K1169 PolarHBondContact O-N 3Å
1166	P	92.3	Very high	89.1	Confident	28 Å²	28	54 Å²	54	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-51.9	-44.8	167.6	-30.6	35	0	0	0	114.2	F1131 E1134 I1162 K1163 V1168 K1169 I1170	F1131-P1166 HydrophobicContact CD1-CB 4.14Å; F1131-P1166 HydrophobicContact CE1-CB 4.41Å; E1134-P1166 HydrophobicContact CG-CB 3.85Å; I1162-P1166 HydrophobicContact CG2-CB 3.81Å; K1163-P1166 HydrophobicContact CB-CG 4.43Å; K1163-P1166 WeakPolarHBondContact O-CD 3.47Å; P1166-V1168 PolarHBondContact O-N 2.81Å; P1166-K1169 CarbonylContact O-C 3.55Å; P1166-K1169 WeakPolarHBondContact O-CB 3.3Å; P1166-K1169 PolarHBondContact O-N 3.01Å; P1166-K1169 VanDerWaalsContact O-N 3.08Å; P1166-I1170 WeakPolarHBondContact O-CG1 3.39Å; P1166-I1170 PolarHBondContact O-N 3.24Å
1167	A	92.7	Very high	89	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-48.6	-176.5	0	0	0	0	0	113.1	V1156 L1157 I1162 K1163 G1165 K1169 I1170 Y1171	V1156-A1167 HydrophobicContact CG1-CB 4.37Å; V1156-A1167 WeakPolarHBondContact CG1-O 3.28Å; V1156-A1167 WeakPolarHBondContact O-CB 3.41Å; L1157-A1167 HydrophobicContact CD2-CB 3.66Å; I1162-A1167 HydrophobicContact CB-CB 4.14Å; I1162-A1167 HydrophobicContact CG2-CB 3.78Å; K1163-A1167 PolarHBondContact O-N 2.84Å; G1165-A1167 VanDerWaalsContact C-N 3.33Å; G1165-A1167 PolarHBondContact O-N 2.92Å; A1167-K1169 VanDerWaalsContact C-N 3.27Å; A1167-K1169 PolarHBondContact O-N 3.31Å; A1167-I1170 PolarHBondContact O-N 2.98Å; A1167-Y1171 PolarHBondContact O-N 3.12Å
1168	V	90.8	Very high	88.9	Confident	61 Å²	61	56.3 Å²	56.3	37%	0.37	29%	0.291	S	S	.	.	H	α-helix	trans	-57.4	-42.5	174	169.3	0	0	0	0	110.9	L1157 L1164 P1166 I1170 Y1171 E1172	L1157-V1168 HydrophobicContact CD2-CB 4.34Å; L1157-V1168 HydrophobicContact CD2-CG2 3.57Å; L1164-V1168 HydrophobicContact CD1-CG2 4.4Å; L1164-V1168 HydrophobicContact CG-CG2 4.42Å; L1164-V1168 WeakPolarHBondContact O-CB 3.04Å; L1164-V1168 VanDerWaalsContact O-CG2 3.26Å; L1164-V1168 WeakPolarHBondContact O-CG2 3.43Å; L1164-V1168 PolarHBondContact O-N 3.33Å; P1166-V1168 PolarHBondContact O-N 2.81Å; V1168-I1170 PolarHBondContact O-N 3.04Å; V1168-Y1171 PolarHBondContact O-N 3.38Å; V1168-E1172 WeakPolarHBondContact O-CB 3.49Å; V1168-E1172 WeakPolarHBondContact O-CG 3.42Å; V1168-E1172 PolarHBondContact O-N 2.93Å
1169	K	92.7	Very high	88.7	Confident	112 Å²	112	59.5 Å²	59.5	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-68.9	-30.4	-179.6	-71.6	175.8	173.3	-173.2	0	113.8	F1131 G1165 P1166 A1167 R1173	F1131-K1169 HydrophobicContact CE1-CB 3.73Å; F1131-K1169 HydrophobicContact CE1-CD 3.92Å; F1131-K1169 HydrophobicContact CZ-CB 3.57Å; F1131-K1169 HydrophobicContact CZ-CD 4.11Å; G1165-K1169 WeakPolarHBondContact O-CG 3.41Å; G1165-K1169 PolarHBondContact O-N 3Å; P1166-K1169 CarbonylContact O-C 3.55Å; P1166-K1169 WeakPolarHBondContact O-CB 3.3Å; P1166-K1169 PolarHBondContact O-N 3.01Å; P1166-K1169 VanDerWaalsContact O-N 3.08Å; A1167-K1169 VanDerWaalsContact C-N 3.27Å; A1167-K1169 PolarHBondContact O-N 3.31Å; K1169-R1173 VanDerWaalsContact O-CD 3.24Å; K1169-R1173 WeakPolarHBondContact O-CD 3.36Å; K1169-R1173 VanDerWaalsContact O-CG 3.3Å; K1169-R1173 WeakPolarHBondContact O-CG 3.47Å; K1169-R1173 PolarHBondContact O-NH1 3.46Å
1170	I	94.1	Very high	88.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-75.5	-46	175.8	-68.9	164	0	0	0	109.2	L1126 F1131 E1134 F1138 V1156 I1162 P1166 A1167 V1168 E1172 R1173 I1174	L1126-I1170 HydrophobicContact CD2-CB 4.47Å; L1126-I1170 HydrophobicContact CD2-CD1 4.1Å; L1126-I1170 HydrophobicContact CD2-CG1 3.88Å; L1126-I1170 HydrophobicContact CD2-CG2 3.81Å; F1131-I1170 HydrophobicContact CB-CD1 4.02Å; F1131-I1170 HydrophobicContact CB-CG1 4.3Å; F1131-I1170 HydrophobicContact CD1-CD1 3.97Å; F1131-I1170 HydrophobicContact CD1-CG1 3.84Å; F1131-I1170 HydrophobicContact CD2-CD1 4.43Å; F1131-I1170 HydrophobicContact CD2-CG1 3.79Å; F1131-I1170 HydrophobicContact CE1-CG1 4.12Å; F1131-I1170 HydrophobicContact CE2-CG1 4.07Å; F1131-I1170 HydrophobicContact CG-CD1 3.87Å; F1131-I1170 HydrophobicContact CG-CG1 3.69Å; F1131-I1170 HydrophobicContact CZ-CG1 4.25Å; E1134-I1170 HydrophobicContact CB-CD1 3.55Å; E1134-I1170 HydrophobicContact CG-CD1 4.01Å; F1138-I1170 HydrophobicContact CE2-CD1 4.39Å; F1138-I1170 HydrophobicContact CE2-CG2 3.93Å; F1138-I1170 HydrophobicContact CZ-CG2 3.59Å; V1156-I1170 HydrophobicContact CG1-CB 4.18Å; V1156-I1170 HydrophobicContact CG1-CG2 4.03Å; I1162-I1170 HydrophobicContact CD1-CD1 4.32Å; P1166-I1170 WeakPolarHBondContact O-CG1 3.39Å; P1166-I1170 PolarHBondContact O-N 3.24Å; A1167-I1170 PolarHBondContact O-N 2.98Å; V1168-I1170 PolarHBondContact O-N 3.04Å; I1170-E1172 VanDerWaalsContact C-N 3.32Å; I1170-E1172 PolarHBondContact O-N 3.44Å; I1170-R1173 WeakPolarHBondContact O-CA 3.45Å; I1170-R1173 WeakPolarHBondContact O-CB 3.11Å; I1170-R1173 PolarHBondContact O-N 3.36Å; I1170-I1174 HydrophobicContact CG2-CD1 3.81Å; I1170-I1174 HydrophobicContact CG2-CG1 4.4Å; I1170-I1174 PolarHBondContact O-N 3.48Å
1171	Y	94.2	Very high	86.9	Confident	27 Å²	27	61.3 Å²	61.3	11%	0.106	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-36.3	175.1	-172.8	-105.7	0	0	0	112.8	R1153 V1156 A1167 V1168 R1173 I1174 K1175	R1153-Y1171 HydrophobicContact CB-CD1 4.32Å; R1153-Y1171 HydrophobicContact CB-CE1 3.78Å; R1153-Y1171 HydrophobicContact CB-CE2 4.07Å; R1153-Y1171 HydrophobicContact CG-CD1 4.16Å; R1153-Y1171 HydrophobicContact CG-CE1 3.96Å; V1156-Y1171 HydrophobicContact CG2-CD2 4.09Å; A1167-Y1171 PolarHBondContact O-N 3.12Å; V1168-Y1171 PolarHBondContact O-N 3.38Å; Y1171-R1173 PolarHBondContact O-N 2.8Å; Y1171-I1174 HydrophobicContact CD2-CG2 4.5Å; Y1171-I1174 PolarHBondContact O-N 2.9Å; Y1171-K1175 HydrophobicContact CE1-CD 4.43Å; Y1171-K1175 WeakPolarHBondContact O-CB 3.41Å; Y1171-K1175 PolarHBondContact O-N 3Å
1172	E	91.6	Very high	85.3	Confident	88 Å²	88	60.5 Å²	60.5	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-12.3	169.8	-84.7	-173.5	165.6	0	0	114.5	V1168 I1170 R1176	V1168-E1172 WeakPolarHBondContact O-CB 3.49Å; V1168-E1172 WeakPolarHBondContact O-CG 3.42Å; V1168-E1172 PolarHBondContact O-N 2.93Å; I1170-E1172 VanDerWaalsContact C-N 3.32Å; I1170-E1172 PolarHBondContact O-N 3.44Å; E1172-R1176 PolarHBondContact O-NE 2.86Å
1173	R	91.5	Very high	83.1	Confident	38 Å²	38	62.7 Å²	62.7	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-109.8	-37.6	178.1	-58.1	159.3	154.3	75.1	-2.3	112.7	W1125 E1129 K1169 I1170 Y1171 K1175 R1176 F1177	W1125-R1173 HydrophobicContact CH2-CB 4.06Å; W1125-R1173 HydrophobicContact CZ2-CB 3.62Å; E1129-R1173 IonicContact OE1-NE 3.58Å; E1129-R1173 PolarHBondContact OE1-NE 3.26Å; E1129-R1173 IonicContact OE2-CZ 2.71Å; E1129-R1173 VanDerWaalsContact OE2-CZ 3.24Å; E1129-R1173 IonicContact OE2-NE 3.87Å; E1129-R1173 PolarHBondContact OE2-NE 3.26Å; E1129-R1173 IonicContact OE2-NH2 3.93Å; E1129-R1173 PolarHBondContact OE2-NH2 3.08Å; K1169-R1173 VanDerWaalsContact O-CD 3.24Å; K1169-R1173 WeakPolarHBondContact O-CD 3.36Å; K1169-R1173 VanDerWaalsContact O-CG 3.3Å; K1169-R1173 WeakPolarHBondContact O-CG 3.47Å; K1169-R1173 PolarHBondContact O-NH1 3.46Å; I1170-R1173 WeakPolarHBondContact O-CA 3.45Å; I1170-R1173 WeakPolarHBondContact O-CB 3.11Å; I1170-R1173 PolarHBondContact O-N 3.36Å; Y1171-R1173 PolarHBondContact O-N 2.8Å; R1173-K1175 PolarHBondContact O-N 2.78Å; R1173-R1176 WeakPolarHBondContact O-CA 3.36Å; R1173-R1176 WeakPolarHBondContact O-CB 2.99Å; R1173-R1176 PolarHBondContact O-N 2.87Å; R1173-F1177 PolarHBondContact O-N 3.11Å
1174	I	92.6	Very high	80.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-52.5	-46	164.9	-72.7	167.8	0	0	0	109.8	W1125 F1138 L1148 M1151 V1156 I1170 Y1171 R1176 F1177 Q1178	W1125-I1174 HydrophobicContact CH2-CG1 4.1Å; W1125-I1174 HydrophobicContact CZ3-CG1 4.5Å; F1138-I1174 HydrophobicContact CE1-CD1 4.18Å; F1138-I1174 HydrophobicContact CZ-CD1 4.03Å; L1148-I1174 HydrophobicContact CD1-CD1 3.67Å; L1148-I1174 HydrophobicContact CD1-CG1 3.54Å; L1148-I1174 HydrophobicContact CG-CG1 4.15Å; L1148-I1174 VanDerWaalsContact O-CG2 3.29Å; L1148-I1174 WeakPolarHBondContact O-CG2 3.45Å; M1151-I1174 HydrophobicContact CB-CD1 4.26Å; M1151-I1174 HydrophobicContact CB-CG2 4.32Å; M1151-I1174 HydrophobicContact SD-CD1 3.94Å; V1156-I1174 HydrophobicContact CG2-CD1 3.66Å; I1170-I1174 HydrophobicContact CG2-CD1 3.81Å; I1170-I1174 HydrophobicContact CG2-CG1 4.4Å; I1170-I1174 PolarHBondContact O-N 3.48Å; Y1171-I1174 HydrophobicContact CD2-CG2 4.5Å; Y1171-I1174 PolarHBondContact O-N 2.9Å; I1174-R1176 PolarHBondContact O-N 3.4Å; I1174-F1177 PolarHBondContact O-N 2.92Å; I1174-Q1178 HydrophobicContact CG2-CG 4.23Å; I1174-Q1178 PolarHBondContact O-N 3.37Å
1175	K	90.4	Very high	78.2	Confident	74 Å²	74	61 Å²	61	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-9.7	174.2	-169.8	150.4	-178	148.2	0	114.3	T803 D806 Y1171 R1173 S1179	T803-K1175 PolarHBondContact O-NZ 2.63Å; D806-K1175 IonicContact OD1-NZ 2.66Å; D806-K1175 PolarHBondContact OD1-NZ 3.16Å; Y1171-K1175 HydrophobicContact CE1-CD 4.43Å; Y1171-K1175 WeakPolarHBondContact O-CB 3.41Å; Y1171-K1175 PolarHBondContact O-N 3Å; R1173-K1175 PolarHBondContact O-N 2.78Å; K1175-S1179 WeakPolarHBondContact O-CB 3.42Å; K1175-S1179 PolarHBondContact O-OG 3.42Å
1176	R	88.8	Confident	77.7	Confident	112 Å²	112	61.9 Å²	61.9	42%	0.423	34%	0.336	S	S	.	.	H	α-helix	trans	-81.8	-38.2	167.7	-56.4	171.8	-172.8	170.6	-1.9	111.4	E1129 E1172 R1173 I1174 S1179 Q1180	E1129-R1176 IonicContact OE1-NH1 3.85Å; E1129-R1176 PolarHBondContact OE1-NH1 2.95Å; E1172-R1176 PolarHBondContact O-NE 2.86Å; R1173-R1176 WeakPolarHBondContact O-CA 3.36Å; R1173-R1176 WeakPolarHBondContact O-CB 2.99Å; R1173-R1176 PolarHBondContact O-N 2.87Å; I1174-R1176 PolarHBondContact O-N 3.4Å; R1176-S1179 WeakPolarHBondContact CA-OG 3.03Å; R1176-S1179 PolarHBondContact O-N 2.74Å; R1176-S1179 PolarHBondContact O-OG 3.39Å; R1176-Q1180 WeakPolarHBondContact O-CG 3.24Å; R1176-Q1180 PolarHBondContact O-N 2.62Å; R1176-Q1180 PolarHBondContact O-NE2 2.94Å
1177	F	86.5	Confident	76.9	Confident	31 Å²	31	63.6 Å²	63.6	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-72.9	-42.9	177	-59.6	-35.9	0	0	0	111.6	V1114 W1117 W1125 L1148 L1149 R1173 I1174 S1179 Q1180 C1181	V1114-F1177 HydrophobicContact CB-CB 4.31Å; V1114-F1177 HydrophobicContact CB-CG 4.4Å; V1114-F1177 HydrophobicContact CG1-CB 4.12Å; V1114-F1177 HydrophobicContact CG1-CD2 3.88Å; V1114-F1177 HydrophobicContact CG1-CE2 4.48Å; V1114-F1177 HydrophobicContact CG1-CG 4.07Å; V1114-F1177 HydrophobicContact CG2-CB 3.96Å; V1114-F1177 HydrophobicContact CG2-CD1 3.67Å; V1114-F1177 HydrophobicContact CG2-CD2 4.18Å; V1114-F1177 HydrophobicContact CG2-CE1 4.16Å; V1114-F1177 HydrophobicContact CG2-CG 3.7Å; W1117-F1177 HydrophobicContact CH2-CE1 4.21Å; W1117-F1177 AromaticContact CH2-CE2 3.61Å; W1117-F1177 HydrophobicContact CH2-CE2 3.61Å; W1117-F1177 AromaticContact CH2-CZ 3.43Å; W1117-F1177 HydrophobicContact CH2-CZ 3.43Å; W1117-F1177 VanDerWaalsContact CH2-CZ 3.43Å; W1117-F1177 HydrophobicContact CZ2-CZ 4.29Å; W1117-F1177 AromaticContact CZ3-CE2 3.72Å; W1117-F1177 HydrophobicContact CZ3-CE2 3.72Å; W1117-F1177 HydrophobicContact CZ3-CZ 4.03Å; W1125-F1177 AromaticContact CD1-CZ 3.9Å; W1125-F1177 AromaticContact CD2-CE2 3.83Å; W1125-F1177 HydrophobicContact CD2-CE2 3.83Å; W1125-F1177 HydrophobicContact CD2-CZ 4.28Å; W1125-F1177 AromaticContact CE2-CE2 3.36Å; W1125-F1177 AromaticContact CE2-CZ 3.63Å; W1125-F1177 HydrophobicContact CE3-CE2 4.34Å; W1125-F1177 HydrophobicContact CG-CE2 4.35Å; W1125-F1177 HydrophobicContact CG-CZ 4.43Å; W1125-F1177 HydrophobicContact CH2-CE2 4.09Å; W1125-F1177 HydrophobicContact CZ2-CD2 4.38Å; W1125-F1177 AromaticContact CZ2-CE2 3.5Å; W1125-F1177 HydrophobicContact CZ2-CE2 3.5Å; W1125-F1177 HydrophobicContact CZ2-CZ 4.04Å; W1125-F1177 HydrophobicContact CZ3-CE2 4.48Å; W1125-F1177 AromaticContact NE1-CE2 3.62Å; W1125-F1177 AromaticContact NE1-CZ 3.35Å; W1125-F1177 VanDerWaalsContact NE1-CZ 3.35Å; L1148-F1177 HydrophobicContact CD2-CD2 3.95Å; L1148-F1177 HydrophobicContact CD2-CE2 4.07Å; L1149-F1177 HydrophobicContact CD2-CB 3.67Å; R1173-F1177 PolarHBondContact O-N 3.11Å; I1174-F1177 PolarHBondContact O-N 2.92Å; F1177-S1179 PolarHBondContact O-N 3.42Å; F1177-Q1180 PolarHBondContact O-N 2.93Å; F1177-C1181 PolarHBondContact O-N 3.48Å
1178	Q	86.9	Confident	76	Confident	58 Å²	58	67.2 Å²	67.2	27%	0.271	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-8.4	167.3	-65	169.2	-25.6	0	0	114.1	L1149 M1151 I1174	L1149-Q1178 VanDerWaalsContact O-CG 3.32Å; L1149-Q1178 WeakPolarHBondContact O-CG 3.38Å; L1149-Q1178 PolarHBondContact O-NE2 3.3Å; M1151-Q1178 PolarHBondContact O-NE2 2.72Å; I1174-Q1178 HydrophobicContact CG2-CG 4.23Å; I1174-Q1178 PolarHBondContact O-N 3.37Å
1179	S	77.8	Confident	75.2	Confident	87 Å²	87	67.5 Å²	67.5	61%	0.608	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	6	173.6	73.6	0	0	0	0	113.9	K1175 R1176 F1177	K1175-S1179 WeakPolarHBondContact O-CB 3.42Å; K1175-S1179 PolarHBondContact O-OG 3.42Å; R1176-S1179 WeakPolarHBondContact CA-OG 3.03Å; R1176-S1179 PolarHBondContact O-N 2.74Å; R1176-S1179 PolarHBondContact O-OG 3.39Å; F1177-S1179 PolarHBondContact O-N 3.42Å
1180	Q	66	Low	74.1	Confident	145 Å²	145	64.8 Å²	64.8	68%	0.678	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	-34.1	-179.2	-77.9	171.9	108.5	0	0	111.7	R1176 F1177	R1176-Q1180 WeakPolarHBondContact O-CG 3.24Å; R1176-Q1180 PolarHBondContact O-N 2.62Å; R1176-Q1180 PolarHBondContact O-NE2 2.94Å; F1177-Q1180 PolarHBondContact O-N 2.93Å
1181	C	57.9	Low	72.7	Confident	26 Å²	26	69.1 Å²	69.1	18%	0.176	38%	0.379	C	S	.	.	S	Bend	trans	-81.8	132.5	159.2	-52.5	0	0	0	0	107.8	L1149 F1177	L1149-C1181 HydrophobicContact CD1-CB 4.27Å; L1149-C1181 HydrophobicContact CD2-CB 4.39Å; F1177-C1181 PolarHBondContact O-N 3.48Å
1182	G	49.9	Very low	71.2	Confident	45 Å²	45	72.1 Å²	72.1	46%	0.464	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-54.9	152.6	156.6	0	0	0	0	0	109.4	E787 P1184	E787-G1182 VanDerWaalsContact OE2-C 3.27Å; E787-G1182 WeakPolarHBondContact OE2-CA 3.37Å; G1182-P1184 VanDerWaalsContact O-CD 3.29Å; G1182-P1184 WeakPolarHBondContact O-CD 3.32Å; G1182-P1184 VanDerWaalsContact O-N 3.1Å
1183	S	42.1	Very low	69.6	Low	63 Å²	63	70.8 Å²	70.8	44%	0.441	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-61.9	118.2	-163.1	54	0	0	0	0	111	E787	E787-S1183 PolarHBondContact OE2-N 3.46Å
1184	P	41.2	Very low	67.8	Low	56 Å²	56	73.6 Å²	73.6	36%	0.364	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-61.6	143.5	166.4	28.2	-33.1	0	0	0	108.8	L1149 L1150 G1182	L1149-P1184 HydrophobicContact CB-CG 4.04Å; L1149-P1184 HydrophobicContact CD1-CG 4.46Å; L1150-P1184 HydrophobicContact CD2-CG 4.41Å; G1182-P1184 VanDerWaalsContact O-CD 3.29Å; G1182-P1184 WeakPolarHBondContact O-CD 3.32Å; G1182-P1184 VanDerWaalsContact O-N 3.1Å
1185	T	33.6	Very low	65.6	Low	186 Å²	186	80.3 Å²	80.3	100%	1.141	46%	0.457	S	S	*	.			trans	-59	0	-177.5	53	0	0	0	0	113

Retrieved 1,185 of 1,185 residues in 510.1 ms (Link to these results)

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