A0A3Q0KM06_SCHMA Loading...

Bromo domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KM06, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,417 aa.

						>A0A3Q0KM06_SCHMA|A0A3Q0KM06
MYHKNNPSCFFFDQIKPIRREISEYKKSSVYDTSTIQLHSENAELINNNANDQLSNDTMYNSSSTKNTTRSITLTATEEKMTNPKGQLINKESNLKQLDYYSWVEMSEQIVKDILIFLHQQNVKEIKHPRILDYRLDETWDELISMVDSNSRDWQLPAIKNAYNIWIQENPPEVDAYGMKYESVKKTNSSYGLEIAGAYTPTPRSSVFRKQSSKPSLTNNESMSIHVKTPTERNSNDMQHTSERASNVRRIKRDNSPPKILVSNSPSESSRSTQKLDSLKDSLKHSLPFSPDKENESSSATGKESKIYVLPTNRLHIPSKHILSTGVLSQLCIGLNPGLSHLTRYQPFILFFLNVSLVNFPRYCEPQYILYSSLLNLKEFNFMPRNPLVNRKMNSYTQMNYHDKDFNDIDYNVIQDTTNNNMSVDKKFADNKITLLFKVGFNRVKKIRMPIMKLYQITSATSVPSSALIQFYKKDLFNKIEHDLMDNILLSTITNLSITKRIESIPSQITLYTNKSEKVDKSSNILLKLYLEKLANVIQSQKDLMKTNQCTKHEQSYPWVSYSTDGTLTVRYPCGSPAIIWSSSPLIYHKPCENLDNSDSSSVNKGKVNKANKPKQFLQSPCIPLQKSTTNVTITTTSTTINSSSGIPMLGTQNVQHRTGFYLSIFGIPRVLSYKSEVDTDIGKTDNIYNSHFSKSSSTTDNEISRNNKKDNSFSTELIQKSRNTARKLDSVRENISSSCSMNSGSNFSEFYLEQTKVDDNLQNEDVDDKKFNIGPLIAHFTPSGDGVVYYPHNINSNNTTIFNSTDHINNLQPANIHAIFTKEYCYVFKNSNGELEYEFPSFTEKSLHDPTIRYPVTLDINLNRYIRLVRTNSHDLTIIFKTEEDVILTIDCFQNLYSNDSGECDTYDHPMNFEDKSKQLKQQFVLSKLPFLSSVVDNTNQNKQLLMSRKRKEESLQKLFKNIPPNDDLQSLSKHLTESMKQISFLCNQWLEIMRHCLGLQRQRIPSPRSAHQLLRYRSLDYMTKGYGTFTSVSTANRASDYNSLVHFDKLICNSFEQKSMRLSKSTSERNINKTSFKKKYPDTFFTNDKNKAPLIIGNDKSSEAILMNENLTRSLSTENNQKMIMGKHYSIVNAADIFPVACPILLRSWLNEIKHHKYFKHLNKPRQLDETTLQHSVELNHDENESLEKAFIDILINPSKFDNQLLSTLSTLSNKGCRCSRHTPPAITDLEFDIFLNKLMQSYQAAVIIVYDSRLPDGIHIGTCDLLCQLYTKQQNTLPTCSRTVDDKIHIMTATEHFSERLYDKYKIAGTGACASISTRMADYRFFIYDIAQNLNNNVNNSQECPLLLKRYNGRPKPGDCLIIIQGKLCFIGSSFTGYEELPWSKQQLDKKVAQCRNQLIKQGFSIPTDFQFVQ
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	21.2	Very low	22.4	Very low	250 Å²	250	166.9 Å²	166.9	100%	1.232	84%	0.844	S	S	*	*				0	138.4	0	-87.4	-176	153	0	0	108.7
2	Y	20.2	Very low	22.4	Very low	213 Å²	213	169.8 Å²	169.8	84%	0.835	85%	0.847	S	S	*	*			trans	-70.2	146.4	175.7	-98.8	-100.9	0	0	0	112.2
3	H	22.8	Very low	22.4	Very low	173 Å²	173	167.8 Å²	167.8	80%	0.801	84%	0.841	S	S	*	*			trans	170.7	110.2	134.2	-96.9	-76	0	0	0	107.6
4	K	20.2	Very low	22.4	Very low	164 Å²	164	168.1 Å²	168.1	71%	0.713	84%	0.838	S	S	*	*				54	104.2	81.5	-78.6	-175.2	175.5	179.7	0	113.3
5	N	25.5	Very low	22.5	Very low	165 Å²	165	166.7 Å²	166.7	88%	0.882	83%	0.833	S	S	*	*				177.1	119.2	126.2	-82.9	-12.6	0	0	0	114.2
6	N	25.5	Very low	22.5	Very low	169 Å²	169	167.4 Å²	167.4	90%	0.904	83%	0.829	S	S	*	*			trans	100.7	128.5	152.4	-113	7.8	0	0	0	123.1
7	P	21.4	Very low	22.7	Very low	107 Å²	107	163.8 Å²	163.8	70%	0.695	82%	0.821	S	S	*	*			trans	-113.6	146.6	-171.9	40.8	-27.1	0	0	0	114.4
8	S	22.3	Very low	22.9	Very low	122 Å²	122	164.4 Å²	164.4	85%	0.853	83%	0.825	S	S	*	*			trans	-168.2	57.5	158	43.6	0	0	0	0	111.8
9	C	22.4	Very low	23	Very low	123 Å²	123	167.6 Å²	167.6	83%	0.831	83%	0.826	S	S	*	*			trans	-112.7	106	165.6	-60.8	0	0	0	0	109.2
10	F	22	Very low	23	Very low	166 Å²	166	171 Å²	171	73%	0.728	83%	0.829	S	S	*	*			trans	-146	113.9	165	-85.9	-88.7	0	0	0	104.4
11	F	22.8	Very low	23.1	Very low	184 Å²	184	171.8 Å²	171.8	81%	0.807	83%	0.832	S	S	*	*	S	Bend		-162.6	151.9	70.8	-95.6	-101.3	0	0	0	108.1
12	F	22	Very low	23.4	Very low	201 Å²	201	168.3 Å²	168.3	88%	0.882	82%	0.816	S	S	*	*	S	Bend	trans	104.8	25	174.5	-67.3	-77.5	0	0	0	120.1
13	D	23.3	Very low	23.7	Very low	144 Å²	144	163.1 Å²	163.1	77%	0.77	81%	0.811	S	S	*	*			trans	-131.1	25.2	170.4	-107.6	-6.4	0	0	0	115.6	I15	D13-I15 PolarHBondContact O-N 3.04Å
14	Q	22.4	Very low	23.8	Very low	172 Å²	172	163.3 Å²	163.3	80%	0.804	81%	0.812	S	S	*	*			trans	-94.9	49.2	171	-70.3	-161.4	0.6	0	0	113.6
15	I	23.1	Very low	24	Very low	148 Å²	148	165.9 Å²	165.9	76%	0.759	82%	0.819	S	S	*	*			trans	-143.6	74.2	148.1	-51.9	-179.7	0	0	0	107.2	D13 P17	D13-I15 PolarHBondContact O-N 3.04Å; I15-P17 WeakPolarHBondContact O-CD 3.37Å
16	K	23.1	Very low	23.9	Very low	178 Å²	178	166.9 Å²	166.9	77%	0.774	82%	0.816	S	S	*	*			trans	-72.6	120.4	161.3	-92.5	-177.9	178.7	173.2	0	107.7	I18	K16-I18 PolarHBondContact O-N 3Å
17	P	26.3	Very low	23.8	Very low	105 Å²	105	169.3 Å²	169.3	68%	0.682	82%	0.818	S	S	*	*			trans	-64.3	124.9	175.9	24.4	-30.5	0	0	0	109.4	I15 R19	I15-P17 WeakPolarHBondContact O-CD 3.37Å; P17-R19 VanDerWaalsContact C-N 3.34Å; P17-R19 PolarHBondContact O-N 3.12Å
18	I	25.7	Very low	23.9	Very low	176 Å²	176	169 Å²	169	90%	0.903	82%	0.819	S	S	*	*			trans	-56.9	93.7	173.5	-62.5	164.1	0	0	0	108.5	K16	K16-I18 PolarHBondContact O-N 3Å
19	R	23.9	Very low	23.9	Very low	224 Å²	224	168 Å²	168	85%	0.845	81%	0.812	S	S	*	*			trans	-149.7	73.6	171.9	-80.1	-166.9	179.5	-176.1	1.1	109.7	P17	P17-R19 VanDerWaalsContact C-N 3.34Å; P17-R19 PolarHBondContact O-N 3.12Å
20	R	24.2	Very low	23.8	Very low	235 Å²	235	168.3 Å²	168.3	89%	0.887	81%	0.81	S	S	*	*	S	Bend	trans	-175.3	43.7	155.5	-114.2	178.3	-149.4	167	6.1	117.6
21	E	25.9	Very low	24	Very low	189 Å²	189	171 Å²	171	88%	0.883	82%	0.817	S	S	*	*	S	Bend	trans	-134.7	13.6	168.7	-75.5	-169.7	170.5	0	0	115.9
22	I	26.9	Very low	24	Very low	176 Å²	176	169 Å²	169	90%	0.903	81%	0.814	S	S	*	*	S	Bend	trans	-106.1	38	174.7	-42.6	179.5	0	0	0	111.6
23	S	25.1	Very low	23.9	Very low	105 Å²	105	166 Å²	166	73%	0.734	81%	0.812	S	S	*	*	S	Bend	trans	-113.4	1.7	173.5	57.2	0	0	0	0	115.2
24	E	26.1	Very low	24	Very low	176 Å²	176	163.8 Å²	163.8	82%	0.822	81%	0.808	S	S	*	*	S	Bend	trans	-118.1	0.2	-177	-75.5	-166.4	159.4	0	0	116.6
25	Y	23.5	Very low	24.1	Very low	218 Å²	218	161.4 Å²	161.4	86%	0.855	81%	0.805	S	S	*	*	S	Bend	trans	-113.3	112.5	168.5	-86.5	-88.5	0	0	0	111.5
26	K	24.9	Very low	24.3	Very low	187 Å²	187	162.6 Å²	162.6	81%	0.813	81%	0.812	S	S	*	*			trans	97.6	53.3	165.9	-55.6	-178.6	177.6	-179.5	0	117.2
27	K	22.7	Very low	24.2	Very low	220 Å²	220	161.9 Å²	161.9	96%	0.957	81%	0.811	S	S	*	*				-83.2	86	126	-86.5	-178	175.2	177.1	0	108.5
28	S	23	Very low	24	Very low	100 Å²	100	163.9 Å²	163.9	70%	0.699	82%	0.815	S	S	*	*			trans	-170.2	78.7	161.4	64.3	0	0	0	0	111
29	S	22	Very low	23.9	Very low	101 Å²	101	164.6 Å²	164.6	71%	0.706	81%	0.814	S	S	*	*			trans	-172.5	81.3	145.7	57	0	0	0	0	107.2	Y31	S29-Y31 PolarHBondContact O-N 3.34Å
30	V	21.5	Very low	23.8	Very low	130 Å²	130	158.7 Å²	158.7	79%	0.788	81%	0.807	S	S	*	*			trans	-64.2	116.9	158.4	175	0	0	0	0	105.8
31	Y	25.1	Very low	23.9	Very low	223 Å²	223	156.5 Å²	156.5	88%	0.875	81%	0.807	S	S	*	*			trans	-114.3	125.6	155.1	-92.1	-76.8	0	0	0	107.1	S29	S29-Y31 PolarHBondContact O-N 3.34Å
32	D	22.5	Very low	23.9	Very low	140 Å²	140	155.1 Å²	155.1	75%	0.749	81%	0.806	S	S	*	*			trans	-60	136.9	-171.2	-79.6	-49.8	0	0	0	113.9	S34	D32-S34 PolarHBondContact O-N 3.4Å
33	T	21.4	Very low	23.9	Very low	139 Å²	139	151.9 Å²	151.9	85%	0.853	81%	0.805	S	S	*	*			trans	-66.5	114.7	155.9	32.9	0	0	0	0	110.9
34	S	25.5	Very low	23.8	Very low	98 Å²	98	155.5 Å²	155.5	69%	0.685	81%	0.811	S	S	*	*			trans	-141.5	95.4	152.5	49.5	0	0	0	0	107.6	D32	D32-S34 PolarHBondContact O-N 3.4Å
35	T	23.4	Very low	23.6	Very low	121 Å²	121	154.9 Å²	154.9	74%	0.742	81%	0.812	S	S	*	*				50.8	90.8	101.6	-33.9	0	0	0	0	113.6
36	I	26.5	Very low	23.7	Very low	174 Å²	174	150.8 Å²	150.8	89%	0.892	80%	0.804	S	S	*	*			trans	-131	119.1	150.6	-60.4	-178.5	0	0	0	107.9
37	Q	21.8	Very low	23.6	Very low	162 Å²	162	148.6 Å²	148.6	76%	0.757	80%	0.801	S	S	*	*			trans	-75	148.6	-175.6	-111.1	154	-58	0	0	112.9
38	L	22	Very low	23.9	Very low	148 Å²	148	145 Å²	145	78%	0.775	79%	0.792	S	S	*	*			trans	-12.2	133.1	153.8	-69.4	147.2	0	0	0	117.6
39	H	24.4	Very low	23.9	Very low	190 Å²	190	147 Å²	147	88%	0.88	80%	0.795	S	S	*	*			trans	-144.3	114.8	137	-97.9	-74.8	0	0	0	110.3
40	S	22.3	Very low	24	Very low	100 Å²	100	145.7 Å²	145.7	70%	0.699	79%	0.79	S	S	*	*			trans	-87	130.2	164.9	51	0	0	0	0	108.9
41	E	26	Very low	24.1	Very low	189 Å²	189	146.6 Å²	146.6	88%	0.883	79%	0.791	S	S	*	*			trans	-147.8	136.9	159.7	-117.3	172.9	-162.9	0	0	110.7
42	N	25.1	Very low	24.3	Very low	161 Å²	161	144.1 Å²	144.1	86%	0.861	79%	0.793	S	S	*	*			trans	-78.6	144	-167.5	-61.6	-48.3	0	0	0	112.3
43	A	27.6	Very low	24.4	Very low	107 Å²	107	146.2 Å²	146.2	88%	0.884	80%	0.798	S	S	*	*			trans	-148	84.8	158.3	0	0	0	0	0	109.7
44	E	22.6	Very low	24.6	Very low	181 Å²	181	147.6 Å²	147.6	85%	0.846	80%	0.799	S	S	*	*			trans	-86.5	135.5	155.4	-74.8	-177.2	149.8	0	0	107.8
45	L	22.6	Very low	24.4	Very low	163 Å²	163	147 Å²	147	85%	0.853	80%	0.795	S	S	*	*			trans	176.4	128.9	138.5	-95.9	148.6	0	0	0	112.8
46	I	24.6	Very low	24.4	Very low	132 Å²	132	147.5 Å²	147.5	68%	0.677	79%	0.793	S	S	*	*			trans	91.6	93.1	143.3	-54.8	160.2	0	0	0	118.9
47	N	22.3	Very low	24.3	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	79%	0.785	S	S	*	*			trans	-37.8	128.6	144.3	-158.6	13.5	0	0	0	114.9
48	N	29.1	Very low	24.4	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	78%	0.783	S	S	*	*			trans	-132.9	107.5	161.2	-86.1	-29.7	0	0	0	110.1
49	N	23.3	Very low	24.4	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	79%	0.785	S	S	*	*			trans	-12.3	161.9	143.5	-61.8	-29.8	0	0	0	116.3
50	A	23.7	Very low	24.3	Very low	74 Å²	74	144.6 Å²	144.6	61%	0.612	78%	0.78	S	S	*	*			cis	175.1	145.1	-17.1	0	0	0	0	0	103.4
51	N	24.1	Very low	24.6	Very low	148 Å²	148	147.3 Å²	147.3	79%	0.791	79%	0.787	S	S	*	*			trans	59.3	114.9	158	-60.1	-23	0	0	0	119.2
52	D	30.1	Very low	24.3	Very low	172 Å²	172	142.8 Å²	142.8	92%	0.92	78%	0.775	S	S	*	*				-149.6	104.4	129	-94.7	-31.1	0	0	0	109.3
53	Q	23.2	Very low	24.2	Very low	183 Å²	183	140.2 Å²	140.2	86%	0.855	77%	0.77	S	S	*	*			trans	-87	122.2	158.9	-74.3	179.3	-4.1	0	0	106.6
54	L	25.5	Very low	24	Very low	168 Å²	168	140.2 Å²	140.2	88%	0.88	76%	0.764	S	S	*	*			trans	-148.1	110.3	151.2	-139.5	82.7	0	0	0	110.5
55	S	21.6	Very low	24.2	Very low	86 Å²	86	137.8 Å²	137.8	60%	0.601	76%	0.761	S	S	*	*			trans	-54.7	148	155.6	50.4	0	0	0	0	111.5
56	N	23.6	Very low	24.2	Very low	131 Å²	131	139.5 Å²	139.5	70%	0.701	76%	0.762	S	S	*	*				156	142.6	123.5	-78.9	-13.3	0	0	0	113.3
57	D	25.5	Very low	24.4	Very low	133 Å²	133	140.9 Å²	140.9	71%	0.711	77%	0.771	S	S	*	*			trans	75.9	101.3	147.3	-57.3	-28.8	0	0	0	119.5
58	T	22.8	Very low	24.4	Very low	117 Å²	117	140 Å²	140	72%	0.718	77%	0.771	S	S	*	*				57.2	107.1	74.4	-32.9	0	0	0	0	112.2
59	M	22.8	Very low	24.2	Very low	167 Å²	167	139.5 Å²	139.5	82%	0.823	77%	0.773	S	S	*	*			trans	167.5	115.8	137.8	-91.7	-82.2	-168.5	0	0	111.9
60	Y	21.6	Very low	24.1	Very low	196 Å²	196	144 Å²	144	77%	0.769	78%	0.779	S	S	*	*			trans	17.3	123.1	131.8	-75.8	-97.9	0	0	0	118.3
61	N	28.4	Very low	23.9	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	79%	0.786	S	S	*	*				-165.9	135.4	104.3	-100.2	-31.2	0	0	0	113.9
62	S	21.1	Very low	23.9	Very low	93 Å²	93	146 Å²	146	65%	0.65	79%	0.787	S	S	*	*			trans	-70.8	160	173.2	47.9	0	0	0	0	113.4
63	S	21.9	Very low	23.4	Very low	108 Å²	108	144.1 Å²	144.1	76%	0.755	78%	0.782	S	S	*	*			trans	104.9	131.2	133.1	76.7	0	0	0	0	119
64	S	23.1	Very low	23.4	Very low	106 Å²	106	143 Å²	143	74%	0.741	78%	0.781	S	S	*	*			trans	77.5	101.9	140.6	170.9	0	0	0	0	118
65	T	28.2	Very low	23.1	Very low	130 Å²	130	141.3 Å²	141.3	80%	0.798	78%	0.778	S	S	*	*				-158.2	121	118.7	21.3	0	0	0	0	110.8
66	K	22.7	Very low	23.3	Very low	199 Å²	199	141.7 Å²	141.7	87%	0.865	79%	0.786	S	S	*	*			trans	-70.7	122.6	163.4	-73.6	170.4	173.4	173	0	108.1
67	N	28.4	Very low	23.3	Very low	162 Å²	162	142.3 Å²	142.3	87%	0.866	80%	0.795	S	S	*	*			trans	-119.7	113.5	160.1	-91.8	-16.8	0	0	0	109.6
68	T	22.5	Very low	23.3	Very low	123 Å²	123	144.9 Å²	144.9	76%	0.755	80%	0.802	S	S	*	*			trans	-92.1	117.8	171.5	-50.8	0	0	0	0	106.8
69	T	24.3	Very low	23.2	Very low	134 Å²	134	148.3 Å²	148.3	82%	0.822	81%	0.81	S	S	*	*			trans	173.6	121	139.3	24.7	0	0	0	0	113.8
70	R	20.5	Very low	23.4	Very low	235 Å²	235	149.4 Å²	149.4	89%	0.887	81%	0.81	S	S	*	*			trans	35.2	115.7	139.2	-83.9	175.2	171.5	168.3	-3	122
71	S	20.4	Very low	23.3	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	82%	0.819	S	S	*	*			trans	-4.1	133.5	140.8	7	0	0	0	0	119.9
72	I	24	Very low	23.2	Very low	159 Å²	159	148.3 Å²	148.3	82%	0.815	82%	0.819	S	S	*	*				-157.5	130.2	127.4	-85.2	136.8	0	0	0	108.1	L74	I72-L74 HydrophobicContact CG2-CG 4.45Å
73	T	19.2	Very low	23.3	Very low	132 Å²	132	150.7 Å²	150.7	81%	0.81	82%	0.824	S	S	*	*			trans	-82.3	123.2	172.7	-50.6	0	0	0	0	109.3
74	L	23.3	Very low	23.6	Very low	160 Å²	160	151.3 Å²	151.3	84%	0.838	83%	0.826	S	S	*	*			trans	-138.7	124.5	158.4	-83.2	172.1	0	0	0	109.6	I72	I72-L74 HydrophobicContact CG2-CG 4.45Å
75	T	20.2	Very low	23.9	Very low	132 Å²	132	155.7 Å²	155.7	81%	0.81	83%	0.832	S	S	*	*			trans	-69.6	132.9	175.7	42.1	0	0	0	0	112
76	A	25.4	Very low	23.8	Very low	94 Å²	94	152.6 Å²	152.6	78%	0.777	83%	0.826	S	S	*	*			trans	-151.3	120.8	153.7	0	0	0	0	0	109.5
77	T	22.7	Very low	24.4	Very low	144 Å²	144	152.1 Å²	152.1	88%	0.883	83%	0.826	S	S	*	*			trans	-64.7	124.7	180	28.7	0	0	0	0	112.3
78	E	25.5	Very low	24.6	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	83%	0.827	S	S	*	*			trans	-85.6	107	168.9	-69.5	-174.4	151.2	0	0	110
79	E	21.4	Very low	25.4	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	82%	0.821	S	S	*	*			trans	-89.6	113.5	158.1	-76.2	-177	156.9	0	0	108.3
80	K	26.2	Very low	26.4	Very low	191 Å²	191	150.7 Å²	150.7	83%	0.83	81%	0.807	S	S	*	*			trans	-120.2	102.4	164.2	-99.5	-179.7	178.7	170.5	0	109.7	T82	K80-T82 PolarHBondContact O-N 2.75Å
81	M	20.8	Very low	27.5	Very low	193 Å²	193	147.7 Å²	147.7	95%	0.951	80%	0.8	S	S	*	*			trans	-51.9	121	169.6	-74.2	157.7	64.1	0	0	111.5
82	T	25.8	Very low	28.5	Very low	137 Å²	137	148.3 Å²	148.3	84%	0.84	79%	0.791	S	S	*	*			trans	-113.6	129.9	158.9	45.4	0	0	0	0	109.4	K80	K80-T82 PolarHBondContact O-N 2.75Å
83	N	22.7	Very low	29.4	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	77%	0.772	S	S	*	*			trans	-68.9	131.1	-167.1	-168.6	-11.5	0	0	0	112.2	K85	N83-K85 PolarHBondContact O-N 2.85Å
84	P	28.2	Very low	30.9	Very low	121 Å²	121	141 Å²	141	79%	0.786	75%	0.754	S	S	*	*			trans	-79.7	84.3	-174.3	32.4	-35	0	0	0	111.6	G86	P84-G86 PolarHBondContact O-N 2.9Å
85	K	29.3	Very low	32.1	Very low	198 Å²	198	138.5 Å²	138.5	86%	0.861	74%	0.74	S	S	*	*			trans	-78.6	108.3	161.8	-83.6	-176.3	176.1	179.3	0	109.3	N83	N83-K85 PolarHBondContact O-N 2.85Å
86	G	27.2	Very low	33.2	Very low	65 Å²	65	138.8 Å²	138.8	67%	0.67	73%	0.73	S	S	*	*			trans	56.3	76.3	152.8	0	0	0	0	0	115.5	P84 L88	P84-G86 PolarHBondContact O-N 2.9Å; G86-L88 PolarHBondContact O-N 2.84Å
87	Q	33.8	Very low	34.3	Very low	188 Å²	188	138.9 Å²	138.9	88%	0.879	72%	0.715	S	S	*	*			trans	-60.5	93	153.2	-82.8	179	-11.7	0	0	107.4	I89	Q87-I89 PolarHBondContact O-N 3.23Å
88	L	33.4	Very low	35.9	Very low	168 Å²	168	137.6 Å²	137.6	88%	0.88	70%	0.702	S	S	*	*			trans	-56.8	91.1	155.6	-88.9	149.4	0	0	0	105.8	G86 N90	G86-L88 PolarHBondContact O-N 2.84Å; L88-N90 PolarHBondContact O-N 3.07Å
89	I	40.1	Very low	37.1	Very low	124 Å²	124	133.9 Å²	133.9	64%	0.636	69%	0.688	S	S	*	*			trans	-53.7	105.9	174.9	-66.3	161.1	0	0	0	106	Q87 K91	Q87-I89 PolarHBondContact O-N 3.23Å; I89-K91 PolarHBondContact O-N 2.88Å
90	N	45.4	Very low	38.3	Very low	97 Å²	97	129.4 Å²	129.4	52%	0.519	66%	0.664	S	S	.	*			trans	-68	98.1	-170.2	-166.3	-6	0	0	0	108.1	L88 E92 S93 N94	L88-N90 PolarHBondContact O-N 3.07Å; N90-E92 PolarHBondContact O-N 3.29Å; N90-S93 PolarHBondContact O-N 2.97Å; N90-S93 PolarHBondContact O-OG 3.42Å; N90-N94 PolarHBondContact O-N 3.26Å
91	K	42.1	Very low	39.7	Very low	173 Å²	173	126.9 Å²	126.9	75%	0.752	65%	0.65	S	S	*	*	H	α-helix	trans	-52.1	-27.5	-177.2	-72.4	-179.5	177	177.1	0	112.2	I89 L95	I89-K91 PolarHBondContact O-N 2.88Å; K91-L95 PolarHBondContact O-N 2.74Å; K91-L95 VanDerWaalsContact O-N 3.13Å
92	E	41.6	Very low	41.5	Very low	120 Å²	120	120.4 Å²	120.4	56%	0.561	62%	0.624	S	S	*	*	H	α-helix	trans	-73.2	-33.1	179.2	-151.7	176.1	-168.8	0	0	113.3	N90 K96	N90-E92 PolarHBondContact O-N 3.29Å; E92-K96 WeakPolarHBondContact O-CG 3.34Å; E92-K96 PolarHBondContact O-N 3.29Å; E92-K96 VanDerWaalsContact O-N 3.12Å
93	S	44.3	Very low	42.7	Very low	58 Å²	58	121.9 Å²	121.9	41%	0.406	61%	0.614	S	S	.	*	H	α-helix	trans	-70.3	-40.8	175	69.3	0	0	0	0	111	N90 K96 Q97	N90-S93 PolarHBondContact O-N 2.97Å; N90-S93 PolarHBondContact O-OG 3.42Å; S93-K96 PolarHBondContact O-N 3.14Å; S93-Q97 WeakPolarHBondContact O-CB 3.43Å; S93-Q97 PolarHBondContact O-N 3.32Å
94	N	48.7	Very low	44.2	Very low	80 Å²	80	116.7 Å²	116.7	43%	0.428	59%	0.587	S	S	.	*	H	α-helix	trans	-65.2	-38.9	176.7	-78.8	-18.2	0	0	0	112.1	N90 Q97 L98	N90-N94 PolarHBondContact O-N 3.26Å; N94-Q97 PolarHBondContact O-N 2.73Å; N94-L98 WeakPolarHBondContact O-CB 3.36Å; N94-L98 PolarHBondContact O-N 2.98Å
95	L	49.3	Very low	45.6	Very low	106 Å²	106	117.7 Å²	117.7	56%	0.555	58%	0.582	S	S	*	*	H	α-helix	trans	-62.5	-45.8	174	-89.3	160.2	0	0	0	111.9	K91 Q97 L98 D99	K91-L95 PolarHBondContact O-N 2.74Å; K91-L95 VanDerWaalsContact O-N 3.13Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.23Å; L95-L98 WeakPolarHBondContact O-CB 3.45Å; L95-L98 PolarHBondContact O-N 3.42Å; L95-D99 PolarHBondContact O-N 3.46Å
96	K	42.6	Very low	46.7	Very low	138 Å²	138	113.1 Å²	113.1	60%	0.6	56%	0.564	S	S	*	*	H	α-helix	trans	-63.2	-37.3	176	-73.6	175.9	-178	171.6	0	112.5	E92 S93 L98 Y100	E92-K96 WeakPolarHBondContact O-CG 3.34Å; E92-K96 PolarHBondContact O-N 3.29Å; E92-K96 VanDerWaalsContact O-N 3.12Å; S93-K96 PolarHBondContact O-N 3.14Å; K96-L98 VanDerWaalsContact C-N 3.35Å; K96-Y100 WeakPolarHBondContact O-CB 3.17Å; K96-Y100 PolarHBondContact O-N 2.86Å
97	Q	48.6	Very low	47.3	Very low	97 Å²	97	111.9 Å²	111.9	45%	0.453	55%	0.546	S	S	.	.	H	α-helix	trans	-67.2	-38.9	176.4	-142.8	177.6	-3.7	0	0	111	S93 N94 L95 Y100 Y101	S93-Q97 WeakPolarHBondContact O-CB 3.43Å; S93-Q97 PolarHBondContact O-N 3.32Å; N94-Q97 PolarHBondContact O-N 2.73Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.23Å; Q97-Y100 PolarHBondContact O-N 3.42Å; Q97-Y101 HydrophobicContact CG-CD2 4.33Å; Q97-Y101 HydrophobicContact CG-CE2 3.74Å; Q97-Y101 WeakPolarHBondContact O-CD2 3.21Å; Q97-Y101 PolarHBondContact O-N 2.89Å
98	L	57	Low	48.3	Very low	117 Å²	117	107.3 Å²	107.3	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-66.7	-43.2	175.6	-157.4	78.3	0	0	0	112.1	N94 L95 K96 Y100 Y101 S102	N94-L98 WeakPolarHBondContact O-CB 3.36Å; N94-L98 PolarHBondContact O-N 2.98Å; L95-L98 WeakPolarHBondContact O-CB 3.45Å; L95-L98 PolarHBondContact O-N 3.42Å; K96-L98 VanDerWaalsContact C-N 3.35Å; L98-Y100 VanDerWaalsContact C-N 3.3Å; L98-Y100 PolarHBondContact O-N 3.37Å; L98-Y101 PolarHBondContact O-N 3.01Å; L98-S102 WeakPolarHBondContact O-CB 3.27Å; L98-S102 PolarHBondContact O-N 3.38Å
99	D	50.5	Low	49.5	Very low	107 Å²	107	103.8 Å²	103.8	57%	0.572	50%	0.503	S	S	*	.	H	α-helix	trans	-61.3	-40	174.5	-77.5	-14.4	0	0	0	111.3	L95 S102 W103	L95-D99 PolarHBondContact O-N 3.46Å; D99-S102 PolarHBondContact O-N 3.47Å; D99-W103 WeakPolarHBondContact O-CB 3.34Å; D99-W103 PolarHBondContact O-N 3.37Å
100	Y	47	Very low	50	Low	96 Å²	96	102.2 Å²	102.2	38%	0.376	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-48.6	175.6	179.7	-100.6	0	0	0	112	K96 Q97 L98 S102 W103 V104 Q155	K96-Y100 WeakPolarHBondContact O-CB 3.17Å; K96-Y100 PolarHBondContact O-N 2.86Å; Q97-Y100 PolarHBondContact O-N 3.42Å; L98-Y100 VanDerWaalsContact C-N 3.3Å; L98-Y100 PolarHBondContact O-N 3.37Å; Y100-S102 VanDerWaalsContact C-N 3.33Å; Y100-S102 PolarHBondContact O-N 2.98Å; Y100-W103 PolarHBondContact O-N 3.26Å; Y100-V104 HydrophobicContact CD1-CG2 4.35Å; Y100-V104 HydrophobicContact CE1-CG2 3.88Å; Y100-V104 HydrophobicContact CE2-CG2 4.25Å; Y100-V104 WeakPolarHBondContact O-CG2 3.5Å; Y100-V104 PolarHBondContact O-N 2.85Å; Y100-Q155 PolarHBondContact OH-OE1 3.1Å
101	Y	55.9	Low	50.2	Low	138 Å²	138	102.3 Å²	102.3	54%	0.541	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-40.4	177.1	-72.9	-56.1	0	0	0	112	Q97 L98 W103 V104 E105	Q97-Y101 HydrophobicContact CG-CD2 4.33Å; Q97-Y101 HydrophobicContact CG-CE2 3.74Å; Q97-Y101 WeakPolarHBondContact O-CD2 3.21Å; Q97-Y101 PolarHBondContact O-N 2.89Å; L98-Y101 PolarHBondContact O-N 3.01Å; Y101-W103 VanDerWaalsContact C-N 3.33Å; Y101-W103 PolarHBondContact O-N 2.94Å; Y101-V104 PolarHBondContact O-N 3.36Å; Y101-E105 WeakPolarHBondContact O-CB 3.4Å; Y101-E105 PolarHBondContact O-N 3.3Å
102	S	58	Low	51	Low	57 Å²	57	99.3 Å²	99.3	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-41	174.1	178.7	0	0	0	0	112.1	L98 D99 Y100 E105 M106	L98-S102 WeakPolarHBondContact O-CB 3.27Å; L98-S102 PolarHBondContact O-N 3.38Å; D99-S102 PolarHBondContact O-N 3.47Å; Y100-S102 VanDerWaalsContact C-N 3.33Å; Y100-S102 PolarHBondContact O-N 2.98Å; S102-E105 PolarHBondContact O-N 3.42Å; S102-M106 WeakPolarHBondContact O-CB 3.46Å; S102-M106 PolarHBondContact O-N 2.81Å
103	W	52.2	Low	51.8	Low	167 Å²	167	97.4 Å²	97.4	63%	0.633	48%	0.48	S	S	*	.	H	α-helix	trans	-66.4	-42.1	177.2	-178.6	81.4	0	0	0	112.4	D99 Y100 Y101 M106 S107	D99-W103 WeakPolarHBondContact O-CB 3.34Å; D99-W103 PolarHBondContact O-N 3.37Å; Y100-W103 PolarHBondContact O-N 3.26Å; Y101-W103 VanDerWaalsContact C-N 3.33Å; Y101-W103 PolarHBondContact O-N 2.94Å; W103-M106 PolarHBondContact O-N 3.33Å; W103-S107 WeakPolarHBondContact O-CB 3.27Å; W103-S107 PolarHBondContact O-N 2.84Å; W103-S107 PolarHBondContact O-OG 3.01Å
104	V	52.5	Low	51.9	Low	35 Å²	35	98.9 Å²	98.9	21%	0.212	48%	0.482	C	S	.	.	H	α-helix	trans	-61.9	-46	175.8	172	0	0	0	0	110.8	Y100 Y101 M106 S107 E108	Y100-V104 HydrophobicContact CD1-CG2 4.35Å; Y100-V104 HydrophobicContact CE1-CG2 3.88Å; Y100-V104 HydrophobicContact CE2-CG2 4.25Å; Y100-V104 WeakPolarHBondContact O-CG2 3.5Å; Y100-V104 PolarHBondContact O-N 2.85Å; Y101-V104 PolarHBondContact O-N 3.36Å; V104-M106 PolarHBondContact O-N 3.48Å; V104-S107 WeakPolarHBondContact O-CB 3.49Å; V104-S107 PolarHBondContact O-N 3.31Å; V104-E108 PolarHBondContact O-N 2.94Å
105	E	58.6	Low	52	Low	143 Å²	143	100 Å²	100	67%	0.668	49%	0.487	S	S	*	.	H	α-helix	trans	-63.2	-42.4	179.7	-162.8	174.1	-155.3	0	0	111.8	Y101 S102 S107 E108 Q109	Y101-E105 WeakPolarHBondContact O-CB 3.4Å; Y101-E105 PolarHBondContact O-N 3.3Å; S102-E105 PolarHBondContact O-N 3.42Å; E105-S107 VanDerWaalsContact C-N 3.33Å; E105-S107 PolarHBondContact O-N 2.78Å; E105-E108 PolarHBondContact O-N 2.74Å; E105-Q109 PolarHBondContact O-N 3.16Å
106	M	51.5	Low	52.5	Low	102 Å²	102	99.2 Å²	99.2	50%	0.502	48%	0.483	S	S	.	.	H	α-helix	trans	-61	-41.5	173.5	-161.5	84.5	61	0	0	111.9	S102 W103 V104 Q109 I110	S102-M106 WeakPolarHBondContact O-CB 3.46Å; S102-M106 PolarHBondContact O-N 2.81Å; W103-M106 PolarHBondContact O-N 3.33Å; V104-M106 PolarHBondContact O-N 3.48Å; M106-Q109 PolarHBondContact O-N 3.28Å; M106-I110 HydrophobicContact CG-CD1 4.23Å; M106-I110 VanDerWaalsContact O-CG1 3.28Å; M106-I110 WeakPolarHBondContact O-CG1 3.45Å; M106-I110 PolarHBondContact O-N 3.02Å
107	S	41.1	Very low	52.7	Low	39 Å²	39	98.7 Å²	98.7	27%	0.273	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-44.4	-179.8	-54.8	0	0	0	0	111.4	W103 V104 E105 Q109 I110 V111	W103-S107 WeakPolarHBondContact O-CB 3.27Å; W103-S107 PolarHBondContact O-N 2.84Å; W103-S107 PolarHBondContact O-OG 3.01Å; V104-S107 WeakPolarHBondContact O-CB 3.49Å; V104-S107 PolarHBondContact O-N 3.31Å; E105-S107 VanDerWaalsContact C-N 3.33Å; E105-S107 PolarHBondContact O-N 2.78Å; S107-Q109 VanDerWaalsContact C-N 3.33Å; S107-Q109 PolarHBondContact O-N 3.48Å; S107-I110 PolarHBondContact O-N 2.85Å; S107-V111 WeakPolarHBondContact O-CG2 3.39Å; S107-V111 PolarHBondContact O-N 3.2Å; S107-V111 VanDerWaalsContact O-N 3.1Å
108	E	53.9	Low	52.4	Low	92 Å²	92	96.3 Å²	96.3	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-41.3	174.4	-75.6	-168.2	171.5	0	0	111.8	V104 E105 V111 K112	V104-E108 PolarHBondContact O-N 2.94Å; E105-E108 PolarHBondContact O-N 2.74Å; E108-V111 PolarHBondContact O-N 2.76Å; E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.26Å
109	Q	59.5	Low	52	Low	93 Å²	93	97.8 Å²	97.8	44%	0.435	47%	0.474	S	S	.	.	H	α-helix	trans	-65.3	-44.3	178.9	-168.5	59.2	42.7	0	0	111.7	E105 M106 S107 V111 K112 D113	E105-Q109 PolarHBondContact O-N 3.16Å; M106-Q109 PolarHBondContact O-N 3.28Å; S107-Q109 VanDerWaalsContact C-N 3.33Å; S107-Q109 PolarHBondContact O-N 3.48Å; Q109-V111 VanDerWaalsContact C-N 3.3Å; Q109-V111 PolarHBondContact O-N 3.22Å; Q109-K112 PolarHBondContact O-N 3.2Å; Q109-D113 PolarHBondContact NE2-OD1 2.94Å; Q109-D113 WeakPolarHBondContact O-CB 3.28Å; Q109-D113 PolarHBondContact O-N 3.12Å
110	I	49.4	Very low	52.1	Low	91 Å²	91	99.7 Å²	99.7	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-59.3	-42.7	175.9	-69.8	165.2	0	0	0	111	M106 S107 D113 I114	M106-I110 HydrophobicContact CG-CD1 4.23Å; M106-I110 VanDerWaalsContact O-CG1 3.28Å; M106-I110 WeakPolarHBondContact O-CG1 3.45Å; M106-I110 PolarHBondContact O-N 3.02Å; S107-I110 PolarHBondContact O-N 2.85Å; I110-D113 PolarHBondContact O-N 3.09Å; I110-I114 HydrophobicContact CG2-CD1 3.71Å; I110-I114 HydrophobicContact CG2-CG1 4.38Å; I110-I114 WeakPolarHBondContact O-CB 3.37Å; I110-I114 WeakPolarHBondContact O-CG1 3.39Å; I110-I114 PolarHBondContact O-N 3.4Å
111	V	49.4	Very low	52.1	Low	99 Å²	99	101 Å²	101	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-41.5	178.1	173	0	0	0	0	111.1	S107 E108 Q109 L115	S107-V111 WeakPolarHBondContact O-CG2 3.39Å; S107-V111 PolarHBondContact O-N 3.2Å; S107-V111 VanDerWaalsContact O-N 3.1Å; E108-V111 PolarHBondContact O-N 2.76Å; Q109-V111 VanDerWaalsContact C-N 3.3Å; Q109-V111 PolarHBondContact O-N 3.22Å; V111-L115 WeakPolarHBondContact O-CB 3.46Å; V111-L115 PolarHBondContact O-N 3.21Å
112	K	60.4	Low	51.4	Low	110 Å²	110	100.5 Å²	100.5	48%	0.478	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174.4	-76.4	175.3	-176.1	164.9	0	111.9	E108 Q109 L115 I116	E108-K112 WeakPolarHBondContact O-CG 3.3Å; E108-K112 PolarHBondContact O-N 3.26Å; Q109-K112 PolarHBondContact O-N 3.2Å; K112-L115 WeakPolarHBondContact O-CB 3.49Å; K112-L115 PolarHBondContact O-N 3.05Å; K112-I116 VanDerWaalsContact O-CG1 3.29Å; K112-I116 WeakPolarHBondContact O-CG1 3.48Å; K112-I116 PolarHBondContact O-N 2.9Å
113	D	58	Low	50.2	Low	81 Å²	81	100.9 Å²	100.9	43%	0.433	50%	0.496	S	S	.	.	H	α-helix	trans	-64.2	-43.2	180	-68.4	-13.8	0	0	0	111	Q109 I110 I116 F117	Q109-D113 PolarHBondContact NE2-OD1 2.94Å; Q109-D113 WeakPolarHBondContact O-CB 3.28Å; Q109-D113 PolarHBondContact O-N 3.12Å; I110-D113 PolarHBondContact O-N 3.09Å; D113-I116 PolarHBondContact O-N 2.87Å; D113-F117 WeakPolarHBondContact O-CB 3.37Å; D113-F117 PolarHBondContact O-N 3.49Å
114	I	45.5	Very low	49.6	Very low	88 Å²	88	102 Å²	102	45%	0.451	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-48.4	172.4	-70.7	169	0	0	0	109.7	I110 I116 F117 L118	I110-I114 HydrophobicContact CG2-CD1 3.71Å; I110-I114 HydrophobicContact CG2-CG1 4.38Å; I110-I114 WeakPolarHBondContact O-CB 3.37Å; I110-I114 WeakPolarHBondContact O-CG1 3.39Å; I110-I114 PolarHBondContact O-N 3.4Å; I114-I116 VanDerWaalsContact C-N 3.32Å; I114-I116 PolarHBondContact O-N 3.11Å; I114-F117 PolarHBondContact O-N 3.24Å; I114-L118 HydrophobicContact CG2-CD1 3.56Å; I114-L118 HydrophobicContact CG2-CG 4.05Å; I114-L118 WeakPolarHBondContact O-CB 3.41Å; I114-L118 WeakPolarHBondContact O-CG 3.41Å; I114-L118 PolarHBondContact O-N 3.13Å
115	L	52.1	Low	48.6	Very low	104 Å²	104	108.1 Å²	108.1	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-58.4	-42.8	179.6	-171.4	76.5	0	0	0	112.4	V111 K112 L118 H119	V111-L115 WeakPolarHBondContact O-CB 3.46Å; V111-L115 PolarHBondContact O-N 3.21Å; K112-L115 WeakPolarHBondContact O-CB 3.49Å; K112-L115 PolarHBondContact O-N 3.05Å; L115-L118 PolarHBondContact O-N 2.84Å; L115-H119 PolarHBondContact O-N 2.87Å; L115-H119 PolarHBondContact O-ND1 3.31Å
116	I	59.3	Low	47.4	Very low	90 Å²	90	106 Å²	106	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-64.1	-47	176.1	-68.3	165	0	0	0	110.1	K112 D113 I114 L118 H119 Q120	K112-I116 VanDerWaalsContact O-CG1 3.29Å; K112-I116 WeakPolarHBondContact O-CG1 3.48Å; K112-I116 PolarHBondContact O-N 2.9Å; D113-I116 PolarHBondContact O-N 2.87Å; I114-I116 VanDerWaalsContact C-N 3.32Å; I114-I116 PolarHBondContact O-N 3.11Å; I116-L118 VanDerWaalsContact C-N 3.28Å; I116-L118 PolarHBondContact O-N 3.4Å; I116-H119 PolarHBondContact O-N 3.31Å; I116-Q120 HydrophobicContact CG2-CG 4.42Å; I116-Q120 WeakPolarHBondContact O-CG 3.29Å; I116-Q120 PolarHBondContact O-N 3.01Å
117	F	47.6	Very low	46.6	Very low	127 Å²	127	110.8 Å²	110.8	56%	0.557	54%	0.542	S	S	*	.	H	α-helix	trans	-61.4	-39.1	179.6	-149.4	-87.8	0	0	0	111.5	D113 I114 Q120 Q121	D113-F117 WeakPolarHBondContact O-CB 3.37Å; D113-F117 PolarHBondContact O-N 3.49Å; I114-F117 PolarHBondContact O-N 3.24Å; F117-Q120 PolarHBondContact O-N 2.87Å; F117-Q121 HydrophobicContact CD1-CG 3.92Å; F117-Q121 HydrophobicContact CE1-CG 3.91Å; F117-Q121 VanDerWaalsContact O-CB 3.31Å; F117-Q121 WeakPolarHBondContact O-CB 3.45Å; F117-Q121 VanDerWaalsContact O-CG 3.32Å; F117-Q121 WeakPolarHBondContact O-CG 3.28Å; F117-Q121 PolarHBondContact O-N 2.95Å
118	L	41.3	Very low	46	Very low	46 Å²	46	115.8 Å²	115.8	24%	0.241	56%	0.56	C	S	.	*	H	α-helix	trans	-69.4	-39.1	177.5	-66.7	174.7	0	0	0	112.7	I114 L115 I116 N122 V123 I126	I114-L118 HydrophobicContact CG2-CD1 3.56Å; I114-L118 HydrophobicContact CG2-CG 4.05Å; I114-L118 WeakPolarHBondContact O-CB 3.41Å; I114-L118 WeakPolarHBondContact O-CG 3.41Å; I114-L118 PolarHBondContact O-N 3.13Å; L115-L118 PolarHBondContact O-N 2.84Å; I116-L118 VanDerWaalsContact C-N 3.28Å; I116-L118 PolarHBondContact O-N 3.4Å; L118-N122 PolarHBondContact O-N 3.4Å; L118-N122 VanDerWaalsContact O-N 3.14Å; L118-V123 HydrophobicContact CD2-CB 3.97Å; L118-V123 HydrophobicContact CD2-CG1 4.24Å; L118-V123 HydrophobicContact CD2-CG2 4.14Å; L118-V123 PolarHBondContact O-N 3.09Å; L118-V123 VanDerWaalsContact O-N 3.09Å; L118-I126 HydrophobicContact CD1-CD1 3.69Å; L118-I126 HydrophobicContact CD2-CD1 3.18Å; L118-I126 HydrophobicContact CD2-CG1 4.28Å; L118-I126 HydrophobicContact CG-CD1 4.05Å
119	H	49.4	Very low	44.8	Very low	148 Å²	148	115.3 Å²	115.3	69%	0.685	57%	0.566	S	S	*	*	H	α-helix	trans	-63.4	-44.3	171.7	-97.7	88.2	0	0	0	111.6	L115 I116 Q121 N122	L115-H119 PolarHBondContact O-N 2.87Å; L115-H119 PolarHBondContact O-ND1 3.31Å; I116-H119 PolarHBondContact O-N 3.31Å; H119-Q121 PolarHBondContact O-N 3.48Å; H119-N122 PolarHBondContact O-N 3.49Å
120	Q	51	Low	43.4	Very low	147 Å²	147	120.8 Å²	120.8	69%	0.687	58%	0.582	S	S	*	*	H	α-helix	trans	-65.2	-38.1	178.9	-73.6	177.8	-2.3	0	0	112.6	I116 F117 N122	I116-Q120 HydrophobicContact CG2-CG 4.42Å; I116-Q120 WeakPolarHBondContact O-CG 3.29Å; I116-Q120 PolarHBondContact O-N 3.01Å; F117-Q120 PolarHBondContact O-N 2.87Å; Q120-N122 VanDerWaalsContact C-N 3.26Å; Q120-N122 PolarHBondContact O-N 3.39Å
121	Q	47.3	Very low	42.6	Very low	125 Å²	125	123 Å²	123	58%	0.584	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	1.1	178.6	-71.2	-83.3	-18	0	0	113.2	F117 H119 V123	F117-Q121 HydrophobicContact CD1-CG 3.92Å; F117-Q121 HydrophobicContact CE1-CG 3.91Å; F117-Q121 VanDerWaalsContact O-CB 3.31Å; F117-Q121 WeakPolarHBondContact O-CB 3.45Å; F117-Q121 VanDerWaalsContact O-CG 3.32Å; F117-Q121 WeakPolarHBondContact O-CG 3.28Å; F117-Q121 PolarHBondContact O-N 2.95Å; H119-Q121 PolarHBondContact O-N 3.48Å; Q121-V123 HydrophobicContact CB-CG2 3.53Å; Q121-V123 PolarHBondContact O-N 2.91Å; Q121-V123 VanDerWaalsContact O-N 3.16Å
122	N	40.8	Very low	41.6	Very low	127 Å²	127	125 Å²	125	68%	0.679	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.9	32.9	179.7	-133.9	-9.2	0	0	0	112.8	L118 H119 Q120 K124	L118-N122 PolarHBondContact O-N 3.4Å; L118-N122 VanDerWaalsContact O-N 3.14Å; H119-N122 PolarHBondContact O-N 3.49Å; Q120-N122 VanDerWaalsContact C-N 3.26Å; Q120-N122 PolarHBondContact O-N 3.39Å; N122-K124 PolarHBondContact O-N 2.82Å
123	V	33.9	Very low	40.4	Very low	65 Å²	65	123.8 Å²	123.8	39%	0.394	60%	0.599	S	S	.	*			trans	-79.9	93.2	-175.6	-173.5	0	0	0	0	108.5	L118 Q121 E125 I126	L118-V123 HydrophobicContact CD2-CB 3.97Å; L118-V123 HydrophobicContact CD2-CG1 4.24Å; L118-V123 HydrophobicContact CD2-CG2 4.14Å; L118-V123 PolarHBondContact O-N 3.09Å; L118-V123 VanDerWaalsContact O-N 3.09Å; Q121-V123 HydrophobicContact CB-CG2 3.53Å; Q121-V123 PolarHBondContact O-N 2.91Å; Q121-V123 VanDerWaalsContact O-N 3.16Å; V123-E125 PolarHBondContact O-N 3.35Å; V123-I126 HydrophobicContact CG1-CD1 4.23Å; V123-I126 HydrophobicContact CG1-CG1 3.84Å
124	K	38.9	Very low	39	Very low	189 Å²	189	129.5 Å²	129.5	82%	0.822	62%	0.616	S	S	*	*			trans	-74.6	-9.4	-179.3	-70.8	-172.4	176.8	-177	0	114.6	N122	N122-K124 PolarHBondContact O-N 2.82Å
125	E	31.7	Very low	38.4	Very low	164 Å²	164	133.3 Å²	133.3	77%	0.766	63%	0.625	S	S	*	*			trans	-139.3	104.2	-172.8	-71.9	178.9	-179	0	0	111	V123	V123-E125 PolarHBondContact O-N 3.35Å
126	I	34.7	Very low	37.5	Very low	99 Å²	99	135.3 Å²	135.3	51%	0.508	64%	0.635	S	S	.	*			trans	-117.7	110.8	158.5	-67.8	-173.8	0	0	0	108.9	L118 V123 H128	L118-I126 HydrophobicContact CD1-CD1 3.69Å; L118-I126 HydrophobicContact CD2-CD1 3.18Å; L118-I126 HydrophobicContact CD2-CG1 4.28Å; L118-I126 HydrophobicContact CG-CD1 4.05Å; V123-I126 HydrophobicContact CG1-CD1 4.23Å; V123-I126 HydrophobicContact CG1-CG1 3.84Å; I126-H128 PolarHBondContact O-N 2.94Å
127	K	34.5	Very low	36.4	Very low	203 Å²	203	139 Å²	139	88%	0.883	66%	0.656	S	S	*	*			trans	-57	119	161.7	-72.9	175.9	177.2	171.3	0	108.2
128	H	27.4	Very low	35.7	Very low	143 Å²	143	136 Å²	136	66%	0.662	64%	0.643	S	S	*	*			trans	14.6	111.7	167.2	-113.8	-60	0	0	0	116.4	I126 R130	I126-H128 PolarHBondContact O-N 2.94Å; H128-R130 PolarHBondContact O-N 3.34Å
129	P	28.7	Very low	35.5	Very low	83 Å²	83	137.6 Å²	137.6	54%	0.539	66%	0.655	S	S	.	*			trans	-63.7	112.2	170.6	23.9	-29.4	0	0	0	109.7	I131	P129-I131 PolarHBondContact O-N 2.86Å
130	R	29.9	Very low	34.9	Very low	207 Å²	207	139.6 Å²	139.6	78%	0.781	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-60.9	2.8	-179.6	-64.9	-167.9	-177.6	172.5	-1	115.3	H128 L132 D133	H128-R130 PolarHBondContact O-N 3.34Å; R130-L132 PolarHBondContact O-N 3.02Å; R130-L132 VanDerWaalsContact O-N 3.13Å; R130-D133 VanDerWaalsContact CB-OD2 3.27Å; R130-D133 WeakPolarHBondContact CB-OD2 3.17Å; R130-D133 WeakPolarHBondContact CG-OD2 3.34Å; R130-D133 WeakPolarHBondContact O-CB 3.25Å; R130-D133 PolarHBondContact O-N 3.06Å
131	I	32.3	Very low	34.2	Very low	137 Å²	137	138.7 Å²	138.7	70%	0.703	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-62	-17.6	174.3	-82.6	169.6	0	0	0	111.7	P129 Y134	P129-I131 PolarHBondContact O-N 2.86Å; I131-Y134 WeakPolarHBondContact O-CD2 2.97Å
132	L	28.2	Very low	33.8	Very low	142 Å²	142	137.1 Å²	137.1	74%	0.743	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-91.7	-0	174.7	-62.4	172.7	0	0	0	114.3	R130 Y134	R130-L132 PolarHBondContact O-N 3.02Å; R130-L132 VanDerWaalsContact O-N 3.13Å; L132-Y134 VanDerWaalsContact C-N 3.26Å; L132-Y134 PolarHBondContact O-N 3.41Å
133	D	35.3	Very low	33.4	Very low	85 Å²	85	134.5 Å²	134.5	46%	0.455	64%	0.635	S	S	.	*			trans	-80.8	5.7	-175.8	-73.5	-19.8	0	0	0	114.4	R130 R135	R130-D133 VanDerWaalsContact CB-OD2 3.27Å; R130-D133 WeakPolarHBondContact CB-OD2 3.17Å; R130-D133 WeakPolarHBondContact CG-OD2 3.34Å; R130-D133 WeakPolarHBondContact O-CB 3.25Å; R130-D133 PolarHBondContact O-N 3.06Å; D133-R135 PolarHBondContact O-N 2.87Å
134	Y	30.1	Very low	33.6	Very low	200 Å²	200	135.8 Å²	135.8	78%	0.784	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	71.8	176.1	-68.8	-74.6	0	0	0	111.5	I131 L132	I131-Y134 WeakPolarHBondContact O-CD2 2.97Å; L132-Y134 VanDerWaalsContact C-N 3.26Å; L132-Y134 PolarHBondContact O-N 3.41Å
135	R	32.1	Very low	33.5	Very low	169 Å²	169	131 Å²	131	64%	0.638	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.2	23	155.7	-101.9	163.7	-158.3	-130.7	10.5	116.7	D133 D137 E138	D133-R135 PolarHBondContact O-N 2.87Å; R135-D137 PolarHBondContact O-N 3.15Å; R135-E138 PolarHBondContact O-N 3.43Å
136	L	33	Very low	33.5	Very low	146 Å²	146	129.2 Å²	129.2	76%	0.764	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	3.4	-177	-81.7	167.8	0	0	0	117
137	D	36.4	Very low	33.4	Very low	167 Å²	167	129.5 Å²	129.5	89%	0.893	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6.4	175.3	-68.2	-23.6	0	0	0	113.3	R135	R135-D137 PolarHBondContact O-N 3.15Å
138	E	33	Very low	33.3	Very low	63 Å²	63	125.2 Å²	125.2	29%	0.294	62%	0.615	S	S	.	*	S	Bend	trans	-87.7	134.4	175.9	-73.3	168.2	-175.2	0	0	110.6	R135 E142 L143	R135-E138 PolarHBondContact O-N 3.43Å; E138-E142 WeakPolarHBondContact CA-OE2 3.37Å; E138-E142 HydrophobicContact CB-CB 4.24Å; E138-L143 HydrophobicContact CB-CD2 4.47Å; E138-L143 HydrophobicContact CB-CG 4.26Å
139	T	38.3	Very low	33.6	Very low	80 Å²	80	124 Å²	124	49%	0.491	62%	0.623	S	S	.	*			trans	-68.3	155.7	174.1	54.8	0	0	0	0	111.1	D141 E142 L143	T139-D141 PolarHBondContact O-N 2.89Å; T139-E142 PolarHBondContact N-OE2 3.37Å; T139-E142 WeakPolarHBondContact O-CA 3.48Å; T139-E142 WeakPolarHBondContact O-CB 3.44Å; T139-E142 PolarHBondContact O-N 3.18Å; T139-E142 VanDerWaalsContact OG1-CD 3.31Å; T139-E142 WeakPolarHBondContact OG1-CG 3.44Å; T139-E142 PolarHBondContact OG1-N 3.3Å; T139-E142 PolarHBondContact OG1-OE2 2.99Å; T139-L143 PolarHBondContact O-N 3.37Å
140	W	34.7	Very low	33.8	Very low	191 Å²	191	126.1 Å²	126.1	72%	0.723	63%	0.629	S	S	*	*	H	α-helix	trans	-56.7	-33.8	177.7	-119.7	122.6	0	0	0	111.9	L143 I144	W140-L143 HydrophobicContact CE3-CB 4.23Å; W140-L143 PolarHBondContact O-N 3.43Å; W140-I144 HydrophobicContact CD2-CD1 4.3Å; W140-I144 HydrophobicContact CE3-CD1 3.35Å; W140-I144 HydrophobicContact CE3-CG1 3.44Å; W140-I144 VanDerWaalsContact CE3-CG1 3.44Å; W140-I144 HydrophobicContact CZ3-CD1 3.65Å; W140-I144 HydrophobicContact CZ3-CG1 3.46Å; W140-I144 VanDerWaalsContact CZ3-CG1 3.46Å; W140-I144 WeakPolarHBondContact O-CB 3.33Å; W140-I144 WeakPolarHBondContact O-CG1 3.17Å; W140-I144 PolarHBondContact O-N 2.82Å
141	D	37.9	Very low	33.9	Very low	128 Å²	128	120.9 Å²	120.9	68%	0.684	63%	0.625	S	S	*	*	H	α-helix	trans	-70.2	-33.2	175.7	-68.1	-37.2	0	0	0	112.6	T139 S145	T139-D141 PolarHBondContact O-N 2.89Å; D141-S145 WeakPolarHBondContact O-CB 3.41Å; D141-S145 PolarHBondContact O-N 3.03Å; D141-S145 PolarHBondContact O-OG 2.81Å
142	E	38.5	Very low	34	Very low	92 Å²	92	123.9 Å²	123.9	43%	0.43	63%	0.627	S	S	.	*	H	α-helix	trans	-68.6	-41.8	170.3	-75.2	166	153.1	0	0	110.9	E138 T139 I144 S145 M146	E138-E142 WeakPolarHBondContact CA-OE2 3.37Å; E138-E142 HydrophobicContact CB-CB 4.24Å; T139-E142 PolarHBondContact N-OE2 3.37Å; T139-E142 WeakPolarHBondContact O-CA 3.48Å; T139-E142 WeakPolarHBondContact O-CB 3.44Å; T139-E142 PolarHBondContact O-N 3.18Å; T139-E142 VanDerWaalsContact OG1-CD 3.31Å; T139-E142 WeakPolarHBondContact OG1-CG 3.44Å; T139-E142 PolarHBondContact OG1-N 3.3Å; T139-E142 PolarHBondContact OG1-OE2 2.99Å; E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.31Å; E142-S145 WeakPolarHBondContact CA-OG 3.36Å; E142-S145 PolarHBondContact O-OG 3.38Å; E142-M146 VanDerWaalsContact O-CB 3.3Å; E142-M146 WeakPolarHBondContact O-CB 3Å; E142-M146 WeakPolarHBondContact O-CG 3.2Å; E142-M146 PolarHBondContact O-N 2.9Å
143	L	32.4	Very low	34.5	Very low	72 Å²	72	124.3 Å²	124.3	38%	0.377	63%	0.63	S	S	.	*	H	α-helix	trans	-61.9	-39.4	175.2	-74.9	169.1	0	0	0	112.2	E138 T139 W140 V147	E138-L143 HydrophobicContact CB-CD2 4.47Å; E138-L143 HydrophobicContact CB-CG 4.26Å; T139-L143 PolarHBondContact O-N 3.37Å; W140-L143 HydrophobicContact CE3-CB 4.23Å; W140-L143 PolarHBondContact O-N 3.43Å; L143-V147 WeakPolarHBondContact O-CG2 3.41Å; L143-V147 PolarHBondContact O-N 2.83Å
144	I	37.8	Very low	34.6	Very low	92 Å²	92	125 Å²	125	47%	0.472	63%	0.626	S	S	.	*	H	α-helix	trans	-77.7	-44.3	178.4	-72.3	159.4	0	0	0	111.7	W140 E142 M146 V147	W140-I144 HydrophobicContact CD2-CD1 4.3Å; W140-I144 HydrophobicContact CE3-CD1 3.35Å; W140-I144 HydrophobicContact CE3-CG1 3.44Å; W140-I144 VanDerWaalsContact CE3-CG1 3.44Å; W140-I144 HydrophobicContact CZ3-CD1 3.65Å; W140-I144 HydrophobicContact CZ3-CG1 3.46Å; W140-I144 VanDerWaalsContact CZ3-CG1 3.46Å; W140-I144 WeakPolarHBondContact O-CB 3.33Å; W140-I144 WeakPolarHBondContact O-CG1 3.17Å; W140-I144 PolarHBondContact O-N 2.82Å; E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.31Å; I144-M146 PolarHBondContact O-N 3.19Å; I144-V147 VanDerWaalsContact O-CB 3.31Å; I144-V147 WeakPolarHBondContact O-CB 3.36Å; I144-V147 PolarHBondContact O-N 2.65Å
145	S	36.3	Very low	35.3	Very low	88 Å²	88	122.2 Å²	122.2	62%	0.615	62%	0.62	S	S	*	*	H	α-helix	trans	-68.4	-26.4	-178.9	61.5	0	0	0	0	112.5	D141 E142 V147	D141-S145 WeakPolarHBondContact O-CB 3.41Å; D141-S145 PolarHBondContact O-N 3.03Å; D141-S145 PolarHBondContact O-OG 2.81Å; E142-S145 WeakPolarHBondContact CA-OG 3.36Å; E142-S145 PolarHBondContact O-OG 3.38Å; S145-V147 VanDerWaalsContact C-N 3.35Å
146	M	32.7	Very low	35.5	Very low	127 Å²	127	118.5 Å²	118.5	63%	0.626	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	2.4	169.4	-69	-169	69.2	0	0	113.9	E142 I144 D148	E142-M146 VanDerWaalsContact O-CB 3.3Å; E142-M146 WeakPolarHBondContact O-CB 3Å; E142-M146 WeakPolarHBondContact O-CG 3.2Å; E142-M146 PolarHBondContact O-N 2.9Å; I144-M146 PolarHBondContact O-N 3.19Å; M146-D148 PolarHBondContact O-N 2.92Å
147	V	31.2	Very low	36.5	Very low	104 Å²	104	116.5 Å²	116.5	63%	0.63	61%	0.609	S	S	*	*			trans	-73.3	69.6	157.7	-169.3	0	0	0	0	107.4	L143 I144 S145 S149	L143-V147 WeakPolarHBondContact O-CG2 3.41Å; L143-V147 PolarHBondContact O-N 2.83Å; I144-V147 VanDerWaalsContact O-CB 3.31Å; I144-V147 WeakPolarHBondContact O-CB 3.36Å; I144-V147 PolarHBondContact O-N 2.65Å; S145-V147 VanDerWaalsContact C-N 3.35Å; V147-S149 PolarHBondContact O-N 2.84Å
148	D	32.3	Very low	37.1	Very low	114 Å²	114	112 Å²	112	61%	0.61	59%	0.594	S	S	*	*			trans	-53.4	134.4	149.5	-84.6	-30.8	0	0	0	106	M146 N150	M146-D148 PolarHBondContact O-N 2.92Å; D148-N150 PolarHBondContact O-N 3.27Å
149	S	34.3	Very low	37.5	Very low	118 Å²	118	112.5 Å²	112.5	83%	0.825	60%	0.598	S	S	*	*	S	Bend	trans	-57.3	6.8	178.9	43.9	0	0	0	0	114.8	V147 S151	V147-S149 PolarHBondContact O-N 2.84Å; S149-S151 PolarHBondContact O-N 3.49Å
150	N	32.4	Very low	38.1	Very low	127 Å²	127	113.8 Å²	113.8	68%	0.679	60%	0.597	S	S	*	*			trans	-75.8	91.7	170.4	-61.7	-18.3	0	0	0	108	D148 R152	D148-N150 PolarHBondContact O-N 3.27Å; N150-R152 PolarHBondContact O-N 2.89Å
151	S	33	Very low	39.5	Very low	97 Å²	97	109.4 Å²	109.4	68%	0.678	59%	0.588	S	S	*	*			trans	-34.7	129.8	164.1	50.7	0	0	0	0	111.1	S149 D153	S149-S151 PolarHBondContact O-N 3.49Å; S151-D153 PolarHBondContact O-N 3.3Å; S151-D153 VanDerWaalsContact O-N 3.14Å
152	R	34	Very low	40.1	Very low	199 Å²	199	106 Å²	106	75%	0.751	58%	0.577	S	S	*	*			trans	-34.7	122.3	173.4	-73.1	-177.7	-176	-138.5	-0.7	110.1	N150 W154	N150-R152 PolarHBondContact O-N 2.89Å; R152-W154 HydrophobicContact CB-CZ2 4.41Å; R152-W154 PolarHBondContact O-N 3.31Å; R152-W154 PolarHBondContact O-NE1 2.85Å
153	D	39.3	Very low	40.6	Very low	151 Å²	151	106.5 Å²	106.5	81%	0.807	58%	0.576	S	S	*	*			trans	-67	85.9	177.5	-76.2	-32.1	0	0	0	109.8	S151 Q155	S151-D153 PolarHBondContact O-N 3.3Å; S151-D153 VanDerWaalsContact O-N 3.14Å; D153-Q155 PolarHBondContact O-N 2.9Å; D153-Q155 VanDerWaalsContact O-N 3.12Å
154	W	37.7	Very low	41.9	Very low	101 Å²	101	106.5 Å²	106.5	38%	0.383	58%	0.576	S	S	.	*			trans	-73.3	98	167	-54.5	95.4	0	0	0	107.1	R152 L156 I159 K160 Y163	R152-W154 HydrophobicContact CB-CZ2 4.41Å; R152-W154 PolarHBondContact O-N 3.31Å; R152-W154 PolarHBondContact O-NE1 2.85Å; W154-L156 PolarHBondContact O-N 2.99Å; W154-L156 VanDerWaalsContact O-N 3.13Å; W154-I159 HydrophobicContact CE3-CG2 4.31Å; W154-I159 HydrophobicContact CZ3-CG2 4.5Å; W154-K160 HydrophobicContact CB-CB 4.13Å; W154-K160 HydrophobicContact CD2-CB 4.4Å; W154-K160 HydrophobicContact CG-CB 4.12Å; W154-K160 HydrophobicContact CG-CD 4.5Å; W154-K160 HydrophobicContact CG-CG 4.39Å; W154-Y163 AromaticContact CH2-CD1 3.94Å; W154-Y163 HydrophobicContact CH2-CD1 3.94Å; W154-Y163 HydrophobicContact CH2-CE1 4.15Å; W154-Y163 HydrophobicContact CH2-CG 4.17Å; W154-Y163 HydrophobicContact CZ2-CD1 4.36Å; W154-Y163 HydrophobicContact CZ2-CE1 4.44Å
155	Q	43.3	Very low	43	Very low	141 Å²	141	105.6 Å²	105.6	66%	0.659	57%	0.572	S	S	*	*	S	Bend	trans	-62.2	-21.7	-176.5	-69	-173.8	-10.1	0	0	113.5	Y100 D153	Y100-Q155 PolarHBondContact OH-OE1 3.1Å; D153-Q155 PolarHBondContact O-N 2.9Å; D153-Q155 VanDerWaalsContact O-N 3.12Å
156	L	37.7	Very low	43.7	Very low	91 Å²	91	107.6 Å²	107.6	48%	0.476	57%	0.566	S	S	.	*			trans	-127.6	123.3	177.7	-76.9	160.6	0	0	0	111.2	W154 A158 I159 K160	W154-L156 PolarHBondContact O-N 2.99Å; W154-L156 VanDerWaalsContact O-N 3.13Å; L156-A158 PolarHBondContact O-N 2.82Å; L156-A158 VanDerWaalsContact O-N 3.16Å; L156-I159 HydrophobicContact CB-CD1 4.03Å; L156-I159 HydrophobicContact CB-CG1 4.01Å; L156-I159 HydrophobicContact CD1-CD1 4.07Å; L156-I159 PolarHBondContact O-N 2.8Å; L156-I159 VanDerWaalsContact O-N 3.09Å; L156-K160 PolarHBondContact O-N 2.79Å
157	P	53.4	Low	44.8	Very low	104 Å²	104	105 Å²	105	68%	0.675	55%	0.554	S	S	*	*	H	α-helix	trans	-55.2	-30.8	173.5	-26.6	34.4	0	0	0	113.4	K160 N161	P157-K160 PolarHBondContact O-N 3.32Å; P157-N161 WeakPolarHBondContact O-CB 3.31Å; P157-N161 PolarHBondContact O-N 3.43Å
158	A	49	Very low	45.9	Very low	71 Å²	71	107.4 Å²	107.4	59%	0.587	56%	0.558	S	S	*	*	H	α-helix	trans	-63.5	-40.9	177.3	0	0	0	0	0	112.6	L156 N161 A162	L156-A158 PolarHBondContact O-N 2.82Å; L156-A158 VanDerWaalsContact O-N 3.16Å; A158-N161 PolarHBondContact O-N 3.3Å; A158-A162 WeakPolarHBondContact O-CB 3.47Å; A158-A162 PolarHBondContact O-N 3.14Å
159	I	41.2	Very low	46.8	Very low	74 Å²	74	108.8 Å²	108.8	38%	0.379	56%	0.561	S	S	.	*	H	α-helix	trans	-68.4	-42.4	177.8	-61	177	0	0	0	110	W154 L156 N161 A162 Y163	W154-I159 HydrophobicContact CE3-CG2 4.31Å; W154-I159 HydrophobicContact CZ3-CG2 4.5Å; L156-I159 HydrophobicContact CB-CD1 4.03Å; L156-I159 HydrophobicContact CB-CG1 4.01Å; L156-I159 HydrophobicContact CD1-CD1 4.07Å; L156-I159 PolarHBondContact O-N 2.8Å; L156-I159 VanDerWaalsContact O-N 3.09Å; I159-N161 VanDerWaalsContact C-N 3.27Å; I159-N161 PolarHBondContact O-N 3.19Å; I159-A162 PolarHBondContact O-N 2.66Å; I159-Y163 VanDerWaalsContact O-CB 3.3Å; I159-Y163 WeakPolarHBondContact O-CB 3.43Å; I159-Y163 PolarHBondContact O-N 3.12Å
160	K	51.8	Low	47.2	Very low	107 Å²	107	107.1 Å²	107.1	47%	0.465	54%	0.543	S	S	.	.	H	α-helix	trans	-57.4	-43.2	172.5	-178.6	179.6	177.4	-179.1	0	110.9	W154 L156 P157 N164	W154-K160 HydrophobicContact CB-CB 4.13Å; W154-K160 HydrophobicContact CD2-CB 4.4Å; W154-K160 HydrophobicContact CG-CB 4.12Å; W154-K160 HydrophobicContact CG-CD 4.5Å; W154-K160 HydrophobicContact CG-CG 4.39Å; L156-K160 PolarHBondContact O-N 2.79Å; P157-K160 PolarHBondContact O-N 3.32Å; K160-N164 WeakPolarHBondContact O-CB 3.25Å; K160-N164 PolarHBondContact O-N 3.07Å; K160-N164 PolarHBondContact O-ND2 3.48Å
161	N	63.3	Low	48.1	Very low	99 Å²	99	103.8 Å²	103.8	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-69.5	-43.8	-179.6	-148.9	26.8	0	0	0	111.9	P157 A158 I159 Y163 N164 I165	P157-N161 WeakPolarHBondContact O-CB 3.31Å; P157-N161 PolarHBondContact O-N 3.43Å; A158-N161 PolarHBondContact O-N 3.3Å; I159-N161 VanDerWaalsContact C-N 3.27Å; I159-N161 PolarHBondContact O-N 3.19Å; N161-Y163 VanDerWaalsContact C-N 3.34Å; N161-Y163 PolarHBondContact O-N 3.1Å; N161-N164 PolarHBondContact O-N 3.03Å; N161-I165 VanDerWaalsContact O-CG1 3.25Å; N161-I165 WeakPolarHBondContact O-CG1 2.96Å; N161-I165 PolarHBondContact O-N 2.87Å
162	A	50.2	Low	48.8	Very low	57 Å²	57	103 Å²	103	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-41.1	175.8	0	0	0	0	0	111.9	A158 I159 I165 W166	A158-A162 WeakPolarHBondContact O-CB 3.47Å; A158-A162 PolarHBondContact O-N 3.14Å; I159-A162 PolarHBondContact O-N 2.66Å; A162-I165 PolarHBondContact O-N 3.13Å; A162-W166 VanDerWaalsContact O-CB 3.27Å; A162-W166 WeakPolarHBondContact O-CB 3.16Å; A162-W166 PolarHBondContact O-N 3.38Å
163	Y	49	Very low	49.7	Very low	102 Å²	102	101 Å²	101	40%	0.4	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-42	174	-179.6	-103.7	0	0	0	112.1	W154 I159 N161 W166 I167	W154-Y163 AromaticContact CH2-CD1 3.94Å; W154-Y163 HydrophobicContact CH2-CD1 3.94Å; W154-Y163 HydrophobicContact CH2-CE1 4.15Å; W154-Y163 HydrophobicContact CH2-CG 4.17Å; W154-Y163 HydrophobicContact CZ2-CD1 4.36Å; W154-Y163 HydrophobicContact CZ2-CE1 4.44Å; I159-Y163 VanDerWaalsContact O-CB 3.3Å; I159-Y163 WeakPolarHBondContact O-CB 3.43Å; I159-Y163 PolarHBondContact O-N 3.12Å; N161-Y163 VanDerWaalsContact C-N 3.34Å; N161-Y163 PolarHBondContact O-N 3.1Å; Y163-W166 PolarHBondContact O-N 3.34Å; Y163-I167 HydrophobicContact CD1-CD1 4.08Å; Y163-I167 HydrophobicContact CE1-CD1 3.35Å; Y163-I167 HydrophobicContact CE1-CG1 4.2Å; Y163-I167 HydrophobicContact CE2-CD1 4.16Å; Y163-I167 HydrophobicContact CE2-CG1 4.37Å; Y163-I167 VanDerWaalsContact CZ-CD1 3.41Å; Y163-I167 PolarHBondContact O-N 2.98Å; Y163-I167 WeakPolarHBondContact OH-CD1 3.4Å
164	N	60.3	Low	49.8	Very low	72 Å²	72	97 Å²	97	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-42.2	175.6	-72	-19.2	0	0	0	112.1	K160 N161 Q168	K160-N164 WeakPolarHBondContact O-CB 3.25Å; K160-N164 PolarHBondContact O-N 3.07Å; K160-N164 PolarHBondContact O-ND2 3.48Å; N161-N164 PolarHBondContact O-N 3.03Å; N164-Q168 WeakPolarHBondContact O-CG 3.46Å; N164-Q168 PolarHBondContact O-N 3.23Å
165	I	60.9	Low	50.1	Low	73 Å²	73	94.4 Å²	94.4	37%	0.374	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-44.7	174.1	-67.5	164.7	0	0	0	109.8	N161 A162 I167 Q168 E169	N161-I165 VanDerWaalsContact O-CG1 3.25Å; N161-I165 WeakPolarHBondContact O-CG1 2.96Å; N161-I165 PolarHBondContact O-N 2.87Å; A162-I165 PolarHBondContact O-N 3.13Å; I165-I167 PolarHBondContact O-N 3.33Å; I165-Q168 CarbonylContact O-C 3.58Å; I165-Q168 WeakPolarHBondContact O-CA 3.49Å; I165-Q168 WeakPolarHBondContact O-CB 3.44Å; I165-Q168 PolarHBondContact O-N 2.84Å; I165-E169 HydrophobicContact CG2-CG 4.32Å; I165-E169 PolarHBondContact O-N 3.48Å
166	W	51	Low	49.8	Very low	130 Å²	130	92.7 Å²	92.7	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-41.2	180	-176	79.7	0	0	0	112.6	A162 Y163 Q168 E169 N170	A162-W166 VanDerWaalsContact O-CB 3.27Å; A162-W166 WeakPolarHBondContact O-CB 3.16Å; A162-W166 PolarHBondContact O-N 3.38Å; Y163-W166 PolarHBondContact O-N 3.34Å; W166-Q168 VanDerWaalsContact C-N 3.31Å; W166-E169 PolarHBondContact O-N 2.99Å; W166-N170 HydrophobicContact CZ2-CB 4.45Å; W166-N170 PolarHBondContact NE1-ND2 3.07Å; W166-N170 WeakPolarHBondContact O-CB 3.5Å; W166-N170 PolarHBondContact O-N 3.26Å; W166-N170 PolarHBondContact O-ND2 3.49Å; W166-N170 VanDerWaalsContact O-ND2 3.16Å
167	I	55	Low	49.8	Very low	73 Å²	73	98.2 Å²	98.2	37%	0.374	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-37	172	-75.6	-170.8	0	0	0	111.5	Y163 I165 N170	Y163-I167 HydrophobicContact CD1-CD1 4.08Å; Y163-I167 HydrophobicContact CE1-CD1 3.35Å; Y163-I167 HydrophobicContact CE1-CG1 4.2Å; Y163-I167 HydrophobicContact CE2-CD1 4.16Å; Y163-I167 HydrophobicContact CE2-CG1 4.37Å; Y163-I167 VanDerWaalsContact CZ-CD1 3.41Å; Y163-I167 PolarHBondContact O-N 2.98Å; Y163-I167 WeakPolarHBondContact OH-CD1 3.4Å; I165-I167 PolarHBondContact O-N 3.33Å; I167-N170 CarbonylContact O-C 3.59Å
168	Q	54.9	Low	48.9	Very low	155 Å²	155	95.4 Å²	95.4	72%	0.724	51%	0.511	S	S	*	.	H	α-helix	trans	-67.1	-40	175.6	-81.9	-177.4	-21.8	0	0	112.3	N164 I165 W166	N164-Q168 WeakPolarHBondContact O-CG 3.46Å; N164-Q168 PolarHBondContact O-N 3.23Å; I165-Q168 CarbonylContact O-C 3.58Å; I165-Q168 WeakPolarHBondContact O-CA 3.49Å; I165-Q168 WeakPolarHBondContact O-CB 3.44Å; I165-Q168 PolarHBondContact O-N 2.84Å; W166-Q168 VanDerWaalsContact C-N 3.31Å
169	E	52.2	Low	48.1	Very low	143 Å²	143	97.2 Å²	97.2	67%	0.668	51%	0.508	S	S	*	.	H	α-helix	trans	-76.7	-30.8	179.4	-72.3	-171.6	165.8	0	0	112.8	I165 W166 P171	I165-E169 HydrophobicContact CG2-CG 4.32Å; I165-E169 PolarHBondContact O-N 3.48Å; W166-E169 PolarHBondContact O-N 2.99Å; E169-P171 VanDerWaalsContact C-CD 3.41Å; E169-P171 WeakPolarHBondContact O-CD 3.35Å
170	N	42.7	Very low	48.1	Very low	82 Å²	82	101.1 Å²	101.1	44%	0.439	52%	0.522	S	S	.	.	S	Bend	trans	-123.7	66.7	-176.5	-56.7	-86	0	0	0	110.6	W166 I167	W166-N170 HydrophobicContact CZ2-CB 4.45Å; W166-N170 PolarHBondContact NE1-ND2 3.07Å; W166-N170 WeakPolarHBondContact O-CB 3.5Å; W166-N170 PolarHBondContact O-N 3.26Å; W166-N170 PolarHBondContact O-ND2 3.49Å; W166-N170 VanDerWaalsContact O-ND2 3.16Å; I167-N170 CarbonylContact O-C 3.59Å
171	P	50.4	Low	47.7	Very low	58 Å²	58	101.4 Å²	101.4	38%	0.377	52%	0.521	S	S	.	.			trans	-62	141.7	175.9	26.7	-33.1	0	0	0	109.4	E169 E173 Y181	E169-P171 VanDerWaalsContact C-CD 3.41Å; E169-P171 WeakPolarHBondContact O-CD 3.35Å; P171-E173 PolarHBondContact O-N 3.31Å; P171-Y181 HydrophobicContact CB-CD1 4.44Å; P171-Y181 HydrophobicContact CB-CE1 4.2Å
172	P	48.3	Very low	46.7	Very low	79 Å²	79	104.5 Å²	104.5	51%	0.513	53%	0.532	S	S	.	.			trans	-59.8	135.7	178.4	25.9	-33.9	0	0	0	109.8	V174 Y181	P172-V174 WeakPolarHBondContact CB-O 3.36Å; P172-V174 PolarHBondContact O-N 2.81Å; P172-Y181 WeakPolarHBondContact O-CB 3.36Å
173	E	53.1	Low	46.3	Very low	157 Å²	157	104.2 Å²	104.2	73%	0.734	53%	0.527	S	S	*	.	S	Bend	trans	-56.5	-21.7	178.4	-71	-173.7	165.4	0	0	112.8	P171 K180 Y181	P171-E173 PolarHBondContact O-N 3.31Å; E173-K180 CarbonylContact O-C 3.57Å; E173-K180 VanDerWaalsContact O-CA 3.25Å; E173-K180 WeakPolarHBondContact O-CA 3.42Å; E173-Y181 PolarHBondContact O-N 2.96Å
174	V	40.2	Very low	45.6	Very low	68 Å²	68	101.9 Å²	101.9	41%	0.412	52%	0.523	S	S	.	.	B	Isolated β-bridge	trans	-133	135.3	-178	-99	0	0	0	0	109.7	P172 G178 M179	P172-V174 WeakPolarHBondContact CB-O 3.36Å; P172-V174 PolarHBondContact O-N 2.81Å; V174-G178 VanDerWaalsContact CG1-O 3.23Å; V174-G178 WeakPolarHBondContact CG1-O 3.4Å; V174-M179 CarbonylContact C-O 3.52Å; V174-M179 VanDerWaalsContact CA-O 3.22Å; V174-M179 WeakPolarHBondContact CA-O 3.44Å
175	D	44.9	Very low	44.4	Very low	47 Å²	47	106 Å²	106	25%	0.251	54%	0.538	S	S	.	.			trans	-71.5	-179.1	173.3	67.7	10.7	0	0	0	112.4	Y177 G178 M179	D175-Y177 PolarHBondContact O-N 2.97Å; D175-Y177 WeakPolarHBondContact OD1-CA 3.22Å; D175-Y177 WeakPolarHBondContact OD1-CB 3.47Å; D175-Y177 PolarHBondContact OD1-N 3.39Å; D175-G178 PolarHBondContact O-N 3.25Å; D175-G178 PolarHBondContact OD1-N 3.48Å; D175-G178 VanDerWaalsContact OD1-N 3.13Å; D175-M179 PolarHBondContact N-O 3.17Å; D175-M179 PolarHBondContact OD1-N 2.67Å
176	A	35.8	Very low	43.3	Very low	104 Å²	104	110.6 Å²	110.6	86%	0.86	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-15.5	178.8	0	0	0	0	0	114.1
177	Y	37.6	Very low	42.5	Very low	207 Å²	207	108.1 Å²	108.1	81%	0.812	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	0.3	177	-57.3	-74.5	0	0	0	112.7	D175	D175-Y177 PolarHBondContact O-N 2.97Å; D175-Y177 WeakPolarHBondContact OD1-CA 3.22Å; D175-Y177 WeakPolarHBondContact OD1-CB 3.47Å; D175-Y177 PolarHBondContact OD1-N 3.39Å
178	G	34.5	Very low	41.4	Very low	46 Å²	46	110.1 Å²	110.1	47%	0.474	57%	0.566	S	S	.	*	S	Bend	trans	78.1	19.1	-179.6	0	0	0	0	0	113.8	V174 D175	V174-G178 VanDerWaalsContact CG1-O 3.23Å; V174-G178 WeakPolarHBondContact CG1-O 3.4Å; D175-G178 PolarHBondContact O-N 3.25Å; D175-G178 PolarHBondContact OD1-N 3.48Å; D175-G178 VanDerWaalsContact OD1-N 3.13Å
179	M	33.2	Very low	40.3	Very low	108 Å²	108	107.4 Å²	107.4	53%	0.532	56%	0.564	S	S	.	*			trans	-94.8	137.4	177.7	-65	-68.2	-82.1	0	0	110.6	V174 D175 Y181	V174-M179 CarbonylContact C-O 3.52Å; V174-M179 VanDerWaalsContact CA-O 3.22Å; V174-M179 WeakPolarHBondContact CA-O 3.44Å; D175-M179 PolarHBondContact N-O 3.17Å; D175-M179 PolarHBondContact OD1-N 2.67Å; M179-Y181 PolarHBondContact O-N 2.88Å
180	K	41.7	Very low	39.2	Very low	156 Å²	156	104.9 Å²	104.9	68%	0.678	56%	0.562	S	S	*	*	B	Isolated β-bridge	trans	-55.3	129.5	-179.7	-87.1	-171.3	173.8	-169.5	0	110.1	E173 E182 S183	E173-K180 CarbonylContact O-C 3.57Å; E173-K180 VanDerWaalsContact O-CA 3.25Å; E173-K180 WeakPolarHBondContact O-CA 3.42Å; K180-E182 PolarHBondContact O-N 3.37Å; K180-E182 VanDerWaalsContact O-N 3.09Å; K180-S183 VanDerWaalsContact O-CB 3.26Å; K180-S183 WeakPolarHBondContact O-CB 3.47Å; K180-S183 PolarHBondContact O-N 3.08Å; K180-S183 PolarHBondContact O-OG 2.89Å
181	Y	42.8	Very low	38.5	Very low	113 Å²	113	110.8 Å²	110.8	44%	0.443	58%	0.58	S	S	.	*	H	α-helix	trans	-56.5	-33.1	-170.9	-168.4	-100.1	0	0	0	113.6	P171 P172 E173 M179 S183 V184	P171-Y181 HydrophobicContact CB-CD1 4.44Å; P171-Y181 HydrophobicContact CB-CE1 4.2Å; P172-Y181 WeakPolarHBondContact O-CB 3.36Å; E173-Y181 PolarHBondContact O-N 2.96Å; M179-Y181 PolarHBondContact O-N 2.88Å; Y181-S183 VanDerWaalsContact C-N 3.26Å; Y181-S183 PolarHBondContact O-N 3.4Å; Y181-V184 PolarHBondContact O-N 3.31Å
182	E	42.8	Very low	37.3	Very low	164 Å²	164	111 Å²	111	77%	0.766	59%	0.592	S	S	*	*	H	α-helix	trans	-67.3	-21.4	176.9	-68.9	-171.3	155.4	0	0	114.6	K180 V184 K185	K180-E182 PolarHBondContact O-N 3.37Å; K180-E182 VanDerWaalsContact O-N 3.09Å; E182-V184 PolarHBondContact O-N 2.95Å; E182-K185 PolarHBondContact O-N 2.99Å
183	S	40.2	Very low	36.2	Very low	51 Å²	51	115.5 Å²	115.5	36%	0.357	61%	0.611	S	S	.	*	H	α-helix	trans	-61.4	-35.9	178.8	-33.7	0	0	0	0	111.1	K180 Y181 K186 T187	K180-S183 VanDerWaalsContact O-CB 3.26Å; K180-S183 WeakPolarHBondContact O-CB 3.47Å; K180-S183 PolarHBondContact O-N 3.08Å; K180-S183 PolarHBondContact O-OG 2.89Å; Y181-S183 VanDerWaalsContact C-N 3.26Å; Y181-S183 PolarHBondContact O-N 3.4Å; S183-K186 PolarHBondContact O-N 3.08Å; S183-T187 PolarHBondContact O-N 3.2Å
184	V	35	Very low	34.9	Very low	54 Å²	54	116.5 Å²	116.5	33%	0.327	62%	0.616	S	S	.	*	H	α-helix	trans	-80.6	-29.7	-174.2	-176	0	0	0	0	111.9	Y181 E182 K186 T187 N188	Y181-V184 PolarHBondContact O-N 3.31Å; E182-V184 PolarHBondContact O-N 2.95Å; V184-K186 PolarHBondContact O-N 3.39Å; V184-T187 WeakPolarHBondContact CA-OG1 3.45Å; V184-T187 PolarHBondContact O-N 3.09Å; V184-T187 PolarHBondContact O-OG1 3.3Å; V184-T187 VanDerWaalsContact O-OG1 3.04Å; V184-N188 WeakPolarHBondContact O-CB 3.48Å; V184-N188 PolarHBondContact O-N 3.04Å
185	K	36.1	Very low	34.3	Very low	158 Å²	158	121.4 Å²	121.4	69%	0.687	64%	0.638	S	S	*	*	H	α-helix	trans	-63	-32.8	172	-89.8	-172.4	177.5	177.9	0	112	E182 S189	E182-K185 PolarHBondContact O-N 2.99Å; K185-S189 PolarHBondContact O-N 2.99Å
186	K	36.2	Very low	33.3	Very low	169 Å²	169	124.5 Å²	124.5	74%	0.735	67%	0.67	S	S	*	*	H	α-helix	trans	-73.6	-30.6	174.6	-83.7	-177	176.2	175.4	0	113.5	S183 V184	S183-K186 PolarHBondContact O-N 3.08Å; V184-K186 PolarHBondContact O-N 3.39Å
187	T	34.6	Very low	32.7	Very low	79 Å²	79	122.8 Å²	122.8	49%	0.485	66%	0.662	S	S	.	*	H	α-helix	trans	-80.6	-30.6	176.6	51.7	0	0	0	0	112.5	S183 V184 S190	S183-T187 PolarHBondContact O-N 3.2Å; V184-T187 WeakPolarHBondContact CA-OG1 3.45Å; V184-T187 PolarHBondContact O-N 3.09Å; V184-T187 PolarHBondContact O-OG1 3.3Å; V184-T187 VanDerWaalsContact O-OG1 3.04Å; T187-S190 PolarHBondContact O-N 3.38Å; T187-S190 PolarHBondContact O-OG 3.38Å
188	N	32.1	Very low	32.1	Very low	114 Å²	114	117.1 Å²	117.1	61%	0.61	66%	0.658	S	S	*	*	H	α-helix	trans	-82.2	-16.1	178.9	-73.8	-0.5	0	0	0	113.9	V184 S190	V184-N188 WeakPolarHBondContact O-CB 3.48Å; V184-N188 PolarHBondContact O-N 3.04Å; N188-S190 VanDerWaalsContact C-N 3.3Å
189	S	31	Very low	31.5	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-11.1	171	80.4	0	0	0	0	113.7	K185	K185-S189 PolarHBondContact O-N 2.99Å
190	S	31	Very low	31.1	Very low	89 Å²	89	127.2 Å²	127.2	62%	0.622	69%	0.692	S	S	*	*	S	Bend	trans	-90.8	-10.6	174.6	47	0	0	0	0	114.2	T187 N188	T187-S190 PolarHBondContact O-N 3.38Å; T187-S190 PolarHBondContact O-OG 3.38Å; N188-S190 VanDerWaalsContact C-N 3.3Å
191	Y	25.9	Very low	30.2	Very low	207 Å²	207	125.9 Å²	125.9	81%	0.812	70%	0.699	S	S	*	*	S	Bend	trans	-105.8	76.2	170.6	-101.1	-90.8	0	0	0	109.5	L193	Y191-L193 PolarHBondContact O-N 3.22Å; Y191-L193 VanDerWaalsContact O-N 3.14Å
192	G	25.9	Very low	29.4	Very low	61 Å²	61	126.8 Å²	126.8	63%	0.629	72%	0.716	S	S	*	*			trans	-60.4	109.7	161.6	0	0	0	0	0	109.8	E194	G192-E194 PolarHBondContact O-N 3.17Å
193	L	25.1	Very low	28.5	Very low	175 Å²	175	125 Å²	125	92%	0.916	72%	0.719	S	S	*	*				46.2	47.7	112.2	-119.2	145.4	0	0	0	118.4	Y191	Y191-L193 PolarHBondContact O-N 3.22Å; Y191-L193 VanDerWaalsContact O-N 3.14Å
194	E	26.2	Very low	27.7	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	75%	0.748	S	S	*	*			trans	-141.3	98.1	152.9	-66.8	-175.3	178.4	0	0	105.2	G192	G192-E194 PolarHBondContact O-N 3.17Å
195	I	27.6	Very low	27.1	Very low	172 Å²	172	137 Å²	137	88%	0.882	77%	0.767	S	S	*	*				-169.6	97	97.1	-74.5	142.4	0	0	0	105.5
196	A	23.7	Very low	26.5	Very low	112 Å²	112	134.8 Å²	134.8	93%	0.926	77%	0.771	S	S	*	*			trans	-115.7	108.5	161.6	0	0	0	0	0	106.1
197	G	23	Very low	26.1	Very low	67 Å²	67	133 Å²	133	69%	0.691	77%	0.774	S	S	*	*			trans	170.7	91.8	-180	0	0	0	0	0	114.5
198	A	25	Very low	25.5	Very low	88 Å²	88	137.9 Å²	137.9	73%	0.727	79%	0.789	S	S	*	*			trans	63.2	94.5	144.4	0	0	0	0	0	118.8
199	Y	23.2	Very low	25.2	Very low	240 Å²	240	143.6 Å²	143.6	94%	0.941	80%	0.802	S	S	*	*			trans	-145.2	85.3	136.9	-95.9	-78.5	0	0	0	109.3
200	T	24.4	Very low	24.7	Very low	127 Å²	127	147.4 Å²	147.4	78%	0.779	81%	0.806	S	S	*	*			trans	-76.9	121.8	163.8	36.7	0	0	0	0	109.2
201	P	23.3	Very low	24.5	Very low	127 Å²	127	151.8 Å²	151.8	83%	0.825	82%	0.817	S	S	*	*			trans	-88	115.4	-178.2	32.1	-28.9	0	0	0	110.6
202	T	24.2	Very low	24.3	Very low	132 Å²	132	147.1 Å²	147.1	81%	0.81	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-93.5	130.9	168.7	39.4	0	0	0	0	111.3
203	P	25	Very low	24.3	Very low	127 Å²	127	149.6 Å²	149.6	83%	0.825	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84.7	126.1	-176.4	30.7	-27.4	0	0	0	111.4
204	R	23.4	Very low	24.2	Very low	253 Å²	253	150.9 Å²	150.9	96%	0.955	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-97.6	117.7	169.8	-88.4	-177.4	172.5	162.8	-1.6	110.3
205	S	22.5	Very low	24.1	Very low	104 Å²	104	148.6 Å²	148.6	73%	0.727	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-82.1	162.5	167.6	54	0	0	0	0	112.2
206	S	23	Very low	24	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	82%	0.819	S	S	*	*			trans	80.7	126.5	179.5	81.9	0	0	0	0	112.8
207	V	28.1	Very low	23.9	Very low	133 Å²	133	148.2 Å²	148.2	81%	0.806	81%	0.814	S	S	*	*				-151.5	140.2	53	169	0	0	0	0	110.5
208	F	21.5	Very low	23.9	Very low	180 Å²	180	149.9 Å²	149.9	79%	0.789	81%	0.811	S	S	*	*			trans	-53.7	133.1	170.5	-82.7	-99.5	0	0	0	113.1
209	R	25.5	Very low	23.9	Very low	235 Å²	235	153 Å²	153	89%	0.887	82%	0.815	S	S	*	*			trans	-139.1	93	147.9	-143.8	174	-162.9	164.3	3.8	110
210	K	21.7	Very low	23.8	Very low	179 Å²	179	148.8 Å²	148.8	78%	0.778	81%	0.809	S	S	*	*			trans	-70.8	119.8	163.3	-80.2	175.4	172.8	175.1	0	107.8
211	Q	26.8	Very low	23.9	Very low	180 Å²	180	151.7 Å²	151.7	84%	0.841	81%	0.814	S	S	*	*			trans	-126.1	117.8	149.8	-83.5	-169.8	-7.7	0	0	109.1
212	S	21.6	Very low	23.9	Very low	109 Å²	109	151.3 Å²	151.3	76%	0.762	81%	0.814	S	S	*	*			trans	-67.9	141.5	168.1	50.7	0	0	0	0	111.4
213	S	26.1	Very low	24	Very low	114 Å²	114	152.9 Å²	152.9	80%	0.797	81%	0.814	S	S	*	*				172.5	113	121.9	52.6	0	0	0	0	111.8
214	K	22.8	Very low	23.8	Very low	202 Å²	202	152.4 Å²	152.4	88%	0.878	81%	0.813	S	S	*	*			trans	38.6	128.9	143	-76.3	178.3	174.5	176.4	0	121.7
215	P	23.2	Very low	23.8	Very low	129 Å²	129	146.4 Å²	146.4	84%	0.838	80%	0.799	S	S	*	*			trans	-86.1	137.6	164.9	34.8	-28.6	0	0	0	111.2
216	S	26.9	Very low	23.8	Very low	121 Å²	121	149.2 Å²	149.2	85%	0.846	80%	0.8	S	S	*	*			trans	-111.5	133.9	171.4	54	0	0	0	0	111.3
217	L	21.7	Very low	23.7	Very low	154 Å²	154	149.8 Å²	149.8	81%	0.806	80%	0.799	S	S	*	*			trans	-53.7	146.4	178.7	-105.3	77.8	0	0	0	115.6
218	T	22.4	Very low	23.6	Very low	103 Å²	103	152.5 Å²	152.5	63%	0.632	80%	0.8	S	S	*	*			trans	23.3	122.5	133.5	63	0	0	0	0	119.4
219	N	23.9	Very low	23.7	Very low	154 Å²	154	150 Å²	150	82%	0.824	80%	0.799	S	S	*	*				179.7	149	108.1	-94.2	-17.8	0	0	0	112.8
220	N	22.2	Very low	23.7	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	79%	0.794	S	S	*	*			trans	-51.7	141.5	172.8	-63.3	-39.5	0	0	0	112.6
221	E	26.4	Very low	23.9	Very low	188 Å²	188	142.2 Å²	142.2	88%	0.879	80%	0.796	S	S	*	*			trans	-158	122.6	139.3	-113.1	167.4	-154.3	0	0	110.8
222	S	22.8	Very low	23.8	Very low	118 Å²	118	141.7 Å²	141.7	83%	0.825	79%	0.793	S	S	*	*			trans	-71.1	116.2	174.1	46.1	0	0	0	0	110.5
223	M	26.1	Very low	24	Very low	166 Å²	166	148.7 Å²	148.7	82%	0.818	80%	0.803	S	S	*	*			trans	-99.3	103.6	169.5	-84.7	-107.2	-89.9	0	0	110.1	I225	M223-I225 HydrophobicContact CE-CD1 4.15Å; M223-I225 HydrophobicContact SD-CD1 4Å
224	S	20.6	Very low	23.8	Very low	116 Å²	116	149.7 Å²	149.7	81%	0.811	80%	0.799	S	S	*	*			trans	-81.7	111.2	164.1	52.7	0	0	0	0	109.4
225	I	23.2	Very low	23.9	Very low	128 Å²	128	144.3 Å²	144.3	66%	0.656	79%	0.787	S	S	*	*			trans	-140.2	121.2	170.3	-63	-178.6	0	0	0	111.2	M223	M223-I225 HydrophobicContact CE-CD1 4.15Å; M223-I225 HydrophobicContact SD-CD1 4Å
226	H	23.2	Very low	24.1	Very low	162 Å²	162	145.1 Å²	145.1	75%	0.75	79%	0.785	S	S	*	*			trans	64.8	99	155	-99.6	-68.6	0	0	0	122.2
227	V	21.8	Very low	24.2	Very low	123 Å²	123	146.3 Å²	146.3	75%	0.745	78%	0.781	S	S	*	*			trans	-69.8	132	143.4	175.9	0	0	0	0	108.8	T229	V227-T229 HydrophobicContact CG1-CG2 4.27Å
228	K	24.3	Very low	24.3	Very low	190 Å²	190	146.2 Å²	146.2	83%	0.826	78%	0.778	S	S	*	*			trans	-122.3	107	164.4	-97.4	-177.4	176.3	177.6	0	108.2
229	T	24.6	Very low	24.4	Very low	127 Å²	127	147.6 Å²	147.6	78%	0.779	78%	0.778	S	S	*	*			trans	-87.9	129.6	167.9	35.9	0	0	0	0	110.2	V227	V227-T229 HydrophobicContact CG1-CG2 4.27Å
230	P	26.4	Very low	24.4	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	77%	0.771	S	S	*	*			trans	-99.1	108.8	155.7	10.6	9.4	0	0	0	109.9
231	T	25.4	Very low	24.7	Very low	134 Å²	134	147.2 Å²	147.2	82%	0.822	78%	0.776	S	S	*	*			trans	20	124.7	139.4	-0.2	0	0	0	0	121.5
232	E	24.5	Very low	24.5	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	77%	0.773	S	S	*	*			trans	-44.2	142.5	159.2	-63.7	161.3	150.3	0	0	114.9
233	R	25.2	Very low	24.7	Very low	255 Å²	255	146.7 Å²	146.7	96%	0.962	77%	0.773	S	S	*	*			trans	-121.9	111.3	146.9	-97.3	-174.4	179.4	174.9	0.2	109.2
234	N	23.3	Very low	24.7	Very low	136 Å²	136	149.7 Å²	149.7	73%	0.727	78%	0.776	S	S	*	*			trans	-52.4	132.1	168.2	-91.3	-20.3	0	0	0	112.7
235	S	23.1	Very low	24.8	Very low	89 Å²	89	148.8 Å²	148.8	62%	0.622	78%	0.775	S	S	*	*				60.9	122.1	103	81.5	0	0	0	0	115.1
236	N	27.5	Very low	24.9	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	78%	0.776	S	S	*	*			trans	-174.3	146.3	136.1	-86.7	-15.9	0	0	0	111.7
237	D	29.4	Very low	25.1	Very low	145 Å²	145	147.3 Å²	147.3	78%	0.775	78%	0.782	S	S	*	*			trans	88.1	84.3	157.5	-54.8	-20.6	0	0	0	120.6
238	M	23.1	Very low	25.2	Very low	152 Å²	152	147.7 Å²	147.7	75%	0.749	78%	0.784	S	S	*	*				6.9	146.4	106.5	-71	-158.5	121.3	0	0	116.2
239	Q	25.3	Very low	25.2	Very low	132 Å²	132	150.3 Å²	150.3	62%	0.617	79%	0.789	S	S	*	*			cis	179.1	161.7	25.8	-124.9	172.4	-0.8	0	0	107.5
240	H	24.6	Very low	25	Very low	149 Å²	149	155 Å²	155	69%	0.69	79%	0.792	S	S	*	*			trans	64.6	108	152.8	-64.7	-57.9	0	0	0	120.8
241	T	28.1	Very low	24.8	Very low	148 Å²	148	156.6 Å²	156.6	91%	0.908	79%	0.793	S	S	*	*				-168.8	125.6	97	24.5	0	0	0	0	109.9
242	S	22.2	Very low	24.9	Very low	116 Å²	116	160 Å²	160	81%	0.811	80%	0.796	S	S	*	*			trans	-101.9	121.2	175	146	0	0	0	0	106.7
243	E	27.1	Very low	24.7	Very low	179 Å²	179	162.4 Å²	162.4	84%	0.836	80%	0.798	S	S	*	*			trans	-149	116.8	158.7	-109.2	179.6	-163.8	0	0	111.9
244	R	24.9	Very low	24.8	Very low	230 Å²	230	157 Å²	157	87%	0.868	79%	0.789	S	S	*	*			trans	80.6	86.4	141	-121	168.4	-174.3	158.6	0.6	120.6
245	A	22.8	Very low	25.1	Very low	97 Å²	97	158.2 Å²	158.2	80%	0.802	80%	0.795	S	S	*	*			trans	-85	163	133.1	0	0	0	0	0	108.5
246	S	26.5	Very low	25.1	Very low	96 Å²	96	159.7 Å²	159.7	67%	0.671	81%	0.805	S	S	*	*			cis	-154.8	156.3	-4.6	56.1	0	0	0	0	106.6
247	N	27.1	Very low	25.2	Very low	163 Å²	163	158.3 Å²	158.3	87%	0.872	80%	0.804	S	S	*	*			trans	-149.9	90.6	156.8	-94.1	-38.7	0	0	0	110
248	V	22.9	Very low	25.2	Very low	131 Å²	131	156.4 Å²	156.4	79%	0.794	80%	0.799	S	S	*	*			trans	-77.7	111	160.4	174.1	0	0	0	0	106.8
249	R	25	Very low	25	Very low	245 Å²	245	158.1 Å²	158.1	93%	0.925	80%	0.803	S	S	*	*			trans	-121.6	104.4	159	-95.9	-173.6	-172.5	172.3	3.8	109.2
250	R	21.2	Very low	25	Very low	224 Å²	224	159.9 Å²	159.9	85%	0.845	82%	0.815	S	S	*	*			trans	-94.5	146.6	165	-128.2	-178	-164.6	-176.9	5.1	107.4
251	I	22.2	Very low	24.9	Very low	153 Å²	153	159.9 Å²	159.9	79%	0.785	82%	0.819	S	S	*	*			trans	84.1	106.9	161.1	-50.1	155.1	0	0	0	116.1
252	K	27.3	Very low	24.8	Very low	205 Å²	205	159 Å²	159	89%	0.891	81%	0.813	S	S	*	*				-145.6	119.1	119.6	-82.1	-159	176.7	-178	0	109.5
253	R	21	Very low	24.7	Very low	219 Å²	219	157.9 Å²	157.9	83%	0.826	81%	0.805	S	S	*	*			trans	-74.1	172	152.9	-80.5	179.9	179.1	163.8	-0.7	107.9
254	D	26.6	Very low	24.6	Very low	143 Å²	143	156.7 Å²	156.7	77%	0.765	81%	0.805	S	S	*	*			trans	100.7	98.7	166.9	-48.6	-26.2	0	0	0	113.5
255	N	29.9	Very low	24.5	Very low	161 Å²	161	151 Å²	151	86%	0.861	80%	0.8	S	S	*	*				-178.2	98.9	118.7	-83.6	-19	0	0	0	109.5
256	S	22.3	Very low	24.9	Very low	119 Å²	119	152 Å²	152	83%	0.832	80%	0.799	S	S	*	*			trans	-123.8	118.3	153.5	57	0	0	0	0	107.9
257	P	30.4	Very low	24.8	Very low	118 Å²	118	152.7 Å²	152.7	77%	0.766	80%	0.803	S	S	*	*			trans	-128.7	168.9	142	29.7	-13	0	0	0	111.8
258	P	27.8	Very low	24.5	Very low	104 Å²	104	154.2 Å²	154.2	68%	0.675	81%	0.805	S	S	*	*			trans	-130.6	-178	-142	42.9	-27.2	0	0	0	114.9
259	K	20.9	Very low	24.7	Very low	189 Å²	189	153.8 Å²	153.8	82%	0.822	81%	0.808	S	S	*	*			trans	62.2	112.2	145.1	-75.8	168	-178.9	-175.9	0	119.8
260	I	25.2	Very low	24.6	Very low	169 Å²	169	147.4 Å²	147.4	87%	0.867	80%	0.801	S	S	*	*			trans	-139.8	97.7	139.1	-57.8	178.6	0	0	0	104.2
261	L	21	Very low	24.6	Very low	148 Å²	148	148.4 Å²	148.4	78%	0.775	81%	0.805	S	S	*	*				62.5	112.4	76.3	-137.3	149.8	0	0	0	112.7
262	V	26.5	Very low	24.6	Very low	131 Å²	131	146.2 Å²	146.2	79%	0.794	80%	0.803	S	S	*	*			trans	167.2	107.4	133.9	163.4	0	0	0	0	108.1
263	S	19.7	Very low	24.4	Very low	91 Å²	91	142.4 Å²	142.4	64%	0.636	80%	0.797	S	S	*	*			trans	-74.8	147.2	154.5	49.6	0	0	0	0	109.4
264	N	26.3	Very low	24.5	Very low	155 Å²	155	140.8 Å²	140.8	83%	0.829	80%	0.799	S	S	*	*			trans	170.2	124	133.5	-80.7	-11.5	0	0	0	111
265	S	22.4	Very low	24.4	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	81%	0.805	S	S	*	*			trans	-67.9	-176.2	156.4	53.1	0	0	0	0	111.3
266	P	30.1	Very low	24	Very low	119 Å²	119	143.4 Å²	143.4	77%	0.773	80%	0.802	S	S	*	*			cis	-135.9	170.8	-11.2	33.8	-13.5	0	0	0	114.9
267	S	24.4	Very low	24	Very low	110 Å²	110	146 Å²	146	77%	0.769	81%	0.806	S	S	*	*			trans	-164	110.7	151.4	50.6	0	0	0	0	109.5
268	E	22.5	Very low	23.7	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	80%	0.797	S	S	*	*				50.1	102.3	99.1	-72.4	-172.8	169.7	0	0	115.1
269	S	25.6	Very low	23.4	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	81%	0.808	S	S	*	*				-165.7	137.2	114.3	73.5	0	0	0	0	112.3
270	S	22.9	Very low	23.4	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	81%	0.809	S	S	*	*			trans	-60	137.1	177.4	41.3	0	0	0	0	115.7
271	R	21.7	Very low	23.4	Very low	246 Å²	246	147.6 Å²	147.6	93%	0.928	81%	0.81	S	S	*	*			trans	-149.7	100.7	137.1	-145.9	171.2	-172.6	174	1.7	111.1
272	S	21.7	Very low	23.5	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	81%	0.807	S	S	*	*			trans	-93.5	128.9	167.9	56.8	0	0	0	0	110.5
273	T	24.6	Very low	23.4	Very low	124 Å²	124	147 Å²	147	76%	0.761	81%	0.811	S	S	*	*			trans	-148.6	104.6	156.7	42	0	0	0	0	110
274	Q	22.7	Very low	23.4	Very low	186 Å²	186	152.7 Å²	152.7	87%	0.869	82%	0.823	S	S	*	*			trans	40.1	116.2	133.6	-68.5	175.4	-13.5	0	0	120.7
275	K	23.7	Very low	23.4	Very low	207 Å²	207	153.3 Å²	153.3	90%	0.9	82%	0.821	S	S	*	*				175.5	101.9	116.1	-99.9	174	176.3	178	0	108.3
276	L	22.4	Very low	23.4	Very low	151 Å²	151	152.4 Å²	152.4	79%	0.791	82%	0.815	S	S	*	*				92.3	75.2	87.4	-156.7	88	0	0	0	111.4
277	D	22	Very low	23.1	Very low	173 Å²	173	154.6 Å²	154.6	93%	0.925	82%	0.819	S	S	*	*			trans	-89.1	110.7	154.9	-83.8	-40.4	0	0	0	107.8
278	S	23.1	Very low	23	Very low	83 Å²	83	154.3 Å²	154.3	58%	0.58	82%	0.815	S	S	*	*			trans	-161.7	111.7	165.7	58.5	0	0	0	0	108.5
279	L	23.1	Very low	23	Very low	172 Å²	172	154.8 Å²	154.8	90%	0.901	81%	0.814	S	S	*	*			trans	177.1	65	147.9	-92.6	166.8	0	0	0	108.4
280	K	20.9	Very low	23	Very low	195 Å²	195	153 Å²	153	85%	0.848	80%	0.802	S	S	*	*	S	Bend	trans	-134.6	137.1	152.7	-96.1	-179.3	176.4	175	0	105.6
281	D	23.9	Very low	23.1	Very low	165 Å²	165	153.6 Å²	153.6	88%	0.882	80%	0.803	S	S	*	*			trans	90.3	81.4	177.6	-53.5	-22.1	0	0	0	116.5
282	S	23.7	Very low	23.3	Very low	101 Å²	101	149.5 Å²	149.5	71%	0.706	80%	0.8	S	S	*	*			trans	-153	103.3	147.8	44.4	0	0	0	0	109.6
283	L	23.9	Very low	23.3	Very low	166 Å²	166	153.4 Å²	153.4	87%	0.869	80%	0.803	S	S	*	*			trans	155.3	71.8	145.7	-81.1	163.4	0	0	0	109.6
284	K	20.6	Very low	23.3	Very low	209 Å²	209	155.6 Å²	155.6	91%	0.909	81%	0.805	S	S	*	*			trans	-124.4	94.6	150.4	-84.1	-174.8	177.3	177.5	0	106.6
285	H	25.6	Very low	23.4	Very low	169 Å²	169	152.6 Å²	152.6	78%	0.782	79%	0.794	S	S	*	*			trans	-122.9	111.9	166.5	-92.5	-66.7	0	0	0	108.6
286	S	22.6	Very low	23.3	Very low	91 Å²	91	151.4 Å²	151.4	64%	0.636	79%	0.792	S	S	*	*			trans	42.3	113.5	130.9	57.5	0	0	0	0	119.6
287	L	23.4	Very low	23.4	Very low	164 Å²	164	149.4 Å²	149.4	86%	0.859	79%	0.791	S	S	*	*				175.6	127	104.9	-94.8	152.9	0	0	0	111.1
288	P	23	Very low	23.4	Very low	105 Å²	105	146 Å²	146	68%	0.682	78%	0.781	S	S	*	*			trans	-102.9	151.5	170.5	37.4	-28.3	0	0	0	111.4
289	F	22.8	Very low	23.3	Very low	203 Å²	203	147.3 Å²	147.3	89%	0.89	79%	0.79	S	S	*	*			trans	155.6	138.9	161	-94.1	-71.2	0	0	0	106
290	S	23.8	Very low	23.4	Very low	86 Å²	86	144 Å²	144	60%	0.601	79%	0.787	S	S	*	*			cis	-167.6	154.4	-13.2	19.7	0	0	0	0	104.9
291	P	25.1	Very low	23.5	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	79%	0.79	S	S	*	*			trans	-92.5	115	-175.1	33.1	-26.7	0	0	0	111.5
292	D	26.9	Very low	23.6	Very low	161 Å²	161	137.2 Å²	137.2	86%	0.861	78%	0.783	S	S	*	*			trans	-84.1	115.1	167.2	-72.5	-30	0	0	0	109.8
293	K	22.1	Very low	23.7	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	79%	0.793	S	S	*	*			trans	-70.3	146.2	154	-68.8	176.1	173.3	179.8	0	107.4
294	E	25	Very low	23.6	Very low	169 Å²	169	143 Å²	143	79%	0.79	79%	0.791	S	S	*	*				173.3	133.1	125.1	-94.9	177.2	-163.2	0	0	113.2
295	N	24.1	Very low	23.8	Very low	123 Å²	123	138.9 Å²	138.9	66%	0.658	79%	0.788	S	S	*	*			trans	71.5	101.3	134.7	-57.9	-18.8	0	0	0	121.4
296	E	21.8	Very low	23.6	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	79%	0.785	S	S	*	*				23.7	124.8	114.2	-63.4	-176.4	165.9	0	0	119.1
297	S	24.1	Very low	23.6	Very low	109 Å²	109	142.2 Å²	142.2	76%	0.762	80%	0.795	S	S	*	*			trans	175.9	104.4	138.6	32.6	0	0	0	0	108.4
298	S	21.7	Very low	23.6	Very low	102 Å²	102	143.9 Å²	143.9	71%	0.713	79%	0.792	S	S	*	*				80	108.6	93.2	73.6	0	0	0	0	114.4
299	S	21.6	Very low	23.5	Very low	111 Å²	111	145.5 Å²	145.5	78%	0.776	80%	0.799	S	S	*	*			trans	47.9	114.3	133.3	63.5	0	0	0	0	119.7
300	A	25.7	Very low	23.6	Very low	102 Å²	102	143 Å²	143	84%	0.843	80%	0.795	S	S	*	*			trans	-142.6	107.7	139.3	0	0	0	0	0	109.7
301	T	22.9	Very low	23.7	Very low	147 Å²	147	144.4 Å²	144.4	90%	0.902	80%	0.801	S	S	*	*			trans	-60.8	141	167.5	35.2	0	0	0	0	111.1
302	G	25	Very low	23.6	Very low	71 Å²	71	144.1 Å²	144.1	73%	0.732	80%	0.797	S	S	*	*			trans	-164.3	77.6	-178.2	0	0	0	0	0	115
303	K	26.1	Very low	23.7	Very low	210 Å²	210	143.5 Å²	143.5	91%	0.913	79%	0.794	S	S	*	*			trans	68.6	105.9	147.3	-64.3	-177.4	178.6	178.3	0	120
304	E	21.3	Very low	23.7	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	80%	0.797	S	S	*	*			trans	-39.9	144	149.5	-55.1	172.3	138.6	0	0	114.9
305	S	25.3	Very low	23.6	Very low	123 Å²	123	146.2 Å²	146.2	86%	0.86	81%	0.805	S	S	*	*			trans	-152.3	120.8	135.1	38.7	0	0	0	0	110.2
306	K	21.7	Very low	23.6	Very low	162 Å²	162	148.1 Å²	148.1	70%	0.704	81%	0.81	S	S	*	*			trans	-75.3	136.3	179.7	-72.6	162.5	171.4	164.1	0	110.4
307	I	22.2	Very low	23.9	Very low	169 Å²	169	146.8 Å²	146.8	87%	0.867	81%	0.806	S	S	*	*			trans	-131.7	126.4	150	-61.2	-178.6	0	0	0	108.1
308	Y	22.4	Very low	23.9	Very low	198 Å²	198	147.4 Å²	147.4	78%	0.776	81%	0.808	S	S	*	*			trans	-72.6	140.4	-171.5	-82.8	-102.4	0	0	0	112.8
309	V	22.8	Very low	23.8	Very low	139 Å²	139	147.1 Å²	147.1	84%	0.842	81%	0.806	S	S	*	*			trans	-112.7	119.2	163.1	177.8	0	0	0	0	107.5
310	L	23.9	Very low	23.7	Very low	152 Å²	152	150.3 Å²	150.3	80%	0.796	81%	0.806	S	S	*	*			trans	-86.2	130	177.8	-112.7	131.1	0	0	0	110.5
311	P	25.3	Very low	23.7	Very low	114 Å²	114	153.6 Å²	153.6	74%	0.74	80%	0.804	S	S	*	*			trans	-108.4	117.5	176.2	34.2	-24	0	0	0	112.4
312	T	24.6	Very low	23.8	Very low	116 Å²	116	154 Å²	154	71%	0.712	80%	0.799	S	S	*	*			trans	-158	139.6	164.7	49.5	0	0	0	0	105.7
313	N	28.1	Very low	23.6	Very low	149 Å²	149	158.9 Å²	158.9	80%	0.797	81%	0.807	S	S	*	*			cis	-149	143.2	21.7	-86	-45.6	0	0	0	110
314	R	22.7	Very low	23.5	Very low	233 Å²	233	153.9 Å²	153.9	88%	0.879	80%	0.798	S	S	*	*			trans	-76	134	164.1	-67.3	172.3	172	177.3	-3.7	108.7
315	L	23.2	Very low	23.6	Very low	182 Å²	182	152 Å²	152	95%	0.953	80%	0.799	S	S	*	*			trans	-121.4	113.7	158.3	-99.6	158.9	0	0	0	108
316	H	23.8	Very low	23.6	Very low	163 Å²	163	149.5 Å²	149.5	76%	0.755	79%	0.792	S	S	*	*			trans	-100.1	142.9	-170.8	-132.7	-86	0	0	0	109.6
317	I	27.1	Very low	23.7	Very low	153 Å²	153	148.3 Å²	148.3	79%	0.785	80%	0.798	S	S	*	*			trans	-59.3	144.7	177.3	-57.9	152.3	0	0	0	111.2
318	P	23.7	Very low	23.6	Very low	122 Å²	122	148.8 Å²	148.8	79%	0.792	80%	0.802	S	S	*	*				-150.5	161.9	109.9	33.9	-13.1	0	0	0	117
319	S	19.9	Very low	23.6	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	80%	0.8	S	S	*	*			trans	-77.5	157.7	-178.6	45.7	0	0	0	0	115.5
320	K	20.7	Very low	23.6	Very low	178 Å²	178	146.2 Å²	146.2	77%	0.774	80%	0.8	S	S	*	*			trans	132.5	141.3	140.5	-73.5	176.4	177.1	179.2	0	114.7
321	H	25.4	Very low	23.4	Very low	172 Å²	172	146.1 Å²	146.1	80%	0.796	80%	0.799	S	S	*	*			trans	73.9	115.9	176.9	-55.5	-80.2	0	0	0	113
322	I	25.2	Very low	23.1	Very low	156 Å²	156	146.4 Å²	146.4	80%	0.8	80%	0.802	S	S	*	*				-154.1	124.7	65.9	-75.6	148.9	0	0	0	109.1
323	L	20.5	Very low	23.1	Very low	172 Å²	172	146.7 Å²	146.7	90%	0.901	80%	0.798	S	S	*	*			trans	-74.7	118	157.5	-86.1	138.2	0	0	0	107.3
324	S	24.2	Very low	22.7	Very low	105 Å²	105	143.1 Å²	143.1	73%	0.734	80%	0.797	S	S	*	*			trans	-126.6	105.2	154.8	77.1	0	0	0	0	109	G326	S324-G326 PolarHBondContact O-N 3.04Å
325	T	23	Very low	22.7	Very low	139 Å²	139	139.6 Å²	139.6	85%	0.853	79%	0.794	S	S	*	*			trans	-56	109	161.9	44.1	0	0	0	0	109.5
326	G	24.7	Very low	22.6	Very low	69 Å²	69	138 Å²	138	71%	0.711	79%	0.787	S	S	*	*			trans	-129.9	106.1	172.1	0	0	0	0	0	108.5	S324	S324-G326 PolarHBondContact O-N 3.04Å
327	V	23.8	Very low	22.5	Very low	137 Å²	137	136.5 Å²	136.5	83%	0.83	79%	0.792	S	S	*	*			trans	-60.2	131.9	-174.9	172.9	0	0	0	0	111.1	S329	V327-S329 PolarHBondContact O-N 3.03Å; V327-S329 VanDerWaalsContact O-N 3.07Å
328	L	20.5	Very low	22.3	Very low	180 Å²	180	132.2 Å²	132.2	94%	0.942	79%	0.785	S	S	*	*			trans	-60.6	96.8	165.6	-83.7	145.1	0	0	0	109.9
329	S	23.1	Very low	22.3	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	79%	0.791	S	S	*	*			trans	-98	122.6	161.6	57.1	0	0	0	0	109.6	V327 L331	V327-S329 PolarHBondContact O-N 3.03Å; V327-S329 VanDerWaalsContact O-N 3.07Å; S329-L331 PolarHBondContact O-N 3.27Å
330	Q	21.3	Very low	22.3	Very low	177 Å²	177	135.3 Å²	135.3	83%	0.827	80%	0.795	S	S	*	*			trans	-33.7	123.8	170.7	-75.4	143.4	-50.3	0	0	113.8
331	L	20.9	Very low	22.4	Very low	150 Å²	150	135 Å²	135	79%	0.785	80%	0.796	S	S	*	*			trans	-127.5	81.6	151.6	-143.8	93.2	0	0	0	108	S329 I333	S329-L331 PolarHBondContact O-N 3.27Å; L331-I333 VanDerWaalsContact C-N 3.32Å; L331-I333 HydrophobicContact CD2-CD1 3.82Å; L331-I333 HydrophobicContact CD2-CG1 3.73Å; L331-I333 HydrophobicContact CG-CG1 4.3Å; L331-I333 PolarHBondContact O-N 3.06Å
332	C	19.7	Very low	22.3	Very low	120 Å²	120	135 Å²	135	81%	0.811	80%	0.801	S	S	*	*			trans	-69.2	90.6	164.8	-67.4	0	0	0	0	108	G334	C332-G334 PolarHBondContact O-N 3.1Å
333	I	23.5	Very low	22.2	Very low	121 Å²	121	133.9 Å²	133.9	62%	0.621	80%	0.802	S	S	*	*			trans	-79.9	99.3	165.5	-54	-179.9	0	0	0	106.7	L331 L335	L331-I333 VanDerWaalsContact C-N 3.32Å; L331-I333 HydrophobicContact CD2-CD1 3.82Å; L331-I333 HydrophobicContact CD2-CG1 3.73Å; L331-I333 HydrophobicContact CG-CG1 4.3Å; L331-I333 PolarHBondContact O-N 3.06Å; I333-L335 HydrophobicContact CG2-CD1 4.43Å; I333-L335 HydrophobicContact CG2-CG 3.92Å; I333-L335 PolarHBondContact O-N 3.14Å; I333-L335 VanDerWaalsContact O-N 3.07Å
334	G	19.7	Very low	22.5	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	80%	0.799	S	S	*	*			trans	-64.5	98.7	161.3	0	0	0	0	0	109.1	C332 N336	C332-G334 PolarHBondContact O-N 3.1Å; G334-N336 PolarHBondContact O-N 3.47Å
335	L	23	Very low	22.5	Very low	158 Å²	158	141.6 Å²	141.6	83%	0.827	80%	0.804	S	S	*	*			trans	-88	104	166.6	-81.7	162.9	0	0	0	108.3	I333	I333-L335 HydrophobicContact CG2-CD1 4.43Å; I333-L335 HydrophobicContact CG2-CG 3.92Å; I333-L335 PolarHBondContact O-N 3.14Å; I333-L335 VanDerWaalsContact O-N 3.07Å
336	N	21.2	Very low	22.7	Very low	150 Å²	150	143 Å²	143	80%	0.802	80%	0.801	S	S	*	*			trans	-47.5	139.4	170.9	-99	-38.9	0	0	0	112.2	G334 G338	G334-N336 PolarHBondContact O-N 3.47Å; N336-G338 PolarHBondContact O-N 3.41Å; N336-G338 VanDerWaalsContact O-N 3.08Å
337	P	21.8	Very low	22.7	Very low	131 Å²	131	144.3 Å²	144.3	85%	0.851	80%	0.797	S	S	*	*	S	Bend	trans	-74.7	97.5	171.4	30.7	-30.1	0	0	0	109.1
338	G	21.7	Very low	22.8	Very low	62 Å²	62	146.8 Å²	146.8	64%	0.639	80%	0.797	S	S	*	*			trans	-155.3	57.9	-177.8	0	0	0	0	0	112.5	N336	N336-G338 PolarHBondContact O-N 3.41Å; N336-G338 VanDerWaalsContact O-N 3.08Å
339	L	23.9	Very low	23.2	Very low	174 Å²	174	144.3 Å²	144.3	91%	0.911	78%	0.783	S	S	*	*			trans	-136.9	87.6	161.6	-101.9	114.2	0	0	0	110.4	H341	L339-H341 PolarHBondContact O-N 3.24Å
340	S	20.6	Very low	23.2	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	77%	0.772	S	S	*	*			trans	-73.6	84.1	166.5	52	0	0	0	0	110.5
341	H	23.2	Very low	23.4	Very low	172 Å²	172	143 Å²	143	80%	0.796	77%	0.766	S	S	*	*			trans	-160.4	63.7	165.1	-96.6	-62.6	0	0	0	111.6	L339	L339-H341 PolarHBondContact O-N 3.24Å
342	L	23.6	Very low	23.6	Very low	170 Å²	170	143.7 Å²	143.7	89%	0.89	76%	0.763	S	S	*	*			trans	-151	40.1	169.2	-105.1	149	0	0	0	111.7
343	T	22.6	Very low	23.9	Very low	133 Å²	133	143 Å²	143	82%	0.816	75%	0.751	S	S	*	*			trans	-98.5	77.1	170.1	49.2	0	0	0	0	109.8
344	R	26	Very low	23.9	Very low	223 Å²	223	142.6 Å²	142.6	84%	0.842	75%	0.75	S	S	*	*	S	Bend	trans	-158.1	0.7	163.5	-122.7	178.9	-105.2	-165.3	-2.6	118.9
345	Y	25.1	Very low	24.1	Very low	217 Å²	217	144.2 Å²	144.2	85%	0.851	74%	0.744	S	S	*	*			trans	-129.8	65.9	-178.2	-74.5	-82.5	0	0	0	113.5
346	Q	26.6	Very low	24.1	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	74%	0.738	S	S	*	*			trans	-141.8	19.4	166.1	-87.6	-146.9	-33	0	0	118.4
347	P	25.3	Very low	24.3	Very low	97 Å²	97	139.8 Å²	139.8	63%	0.63	73%	0.729	S	S	*	*	S	Bend	trans	-83.6	-22.8	162.7	-11.9	28.6	0	0	0	114.4	I349 L350	P347-I349 PolarHBondContact O-N 3.41Å; P347-L350 PolarHBondContact O-N 3.22Å
348	F	26.3	Very low	24.3	Very low	188 Å²	188	138.8 Å²	138.8	83%	0.825	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-24.1	-167.3	-101.8	-84.4	0	0	0	115.7
349	I	27.3	Very low	24.3	Very low	129 Å²	129	142.2 Å²	142.2	66%	0.662	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-19.4	176.8	-65.9	173.5	0	0	0	111.4	P347	P347-I349 PolarHBondContact O-N 3.41Å
350	L	24.8	Very low	24.3	Very low	96 Å²	96	141.8 Å²	141.8	50%	0.503	72%	0.715	S	S	.	*	H	α-helix	trans	-77.7	-24.6	-177.8	-142.2	77.7	0	0	0	113.1	P347 F352 L353 N354	P347-L350 PolarHBondContact O-N 3.22Å; L350-F352 VanDerWaalsContact C-N 3.3Å; L350-F352 PolarHBondContact O-N 3.12Å; L350-L353 PolarHBondContact O-N 3.37Å; L350-N354 WeakPolarHBondContact O-CB 2.9Å; L350-N354 PolarHBondContact O-N 3.11Å; L350-N354 PolarHBondContact O-ND2 2.93Å
351	F	24.9	Very low	24.4	Very low	160 Å²	160	141.5 Å²	141.5	70%	0.702	71%	0.71	S	S	*	*	H	α-helix	trans	-67.4	-31	178.7	-159	-96.4	0	0	0	112.5
352	F	24	Very low	24.5	Very low	164 Å²	164	143.7 Å²	143.7	72%	0.719	71%	0.711	S	S	*	*	H	α-helix	trans	-78.8	-19	175	-94.2	-79.9	0	0	0	114	L350	L350-F352 VanDerWaalsContact C-N 3.3Å; L350-F352 PolarHBondContact O-N 3.12Å
353	L	26.3	Very low	24.8	Very low	106 Å²	106	141.9 Å²	141.9	56%	0.555	69%	0.694	S	S	*	*	H	α-helix	trans	-92.6	-27.1	177	-82.1	156.4	0	0	0	113	L350 V355 S356	L350-L353 PolarHBondContact O-N 3.37Å; L353-V355 VanDerWaalsContact C-N 3.33Å; L353-V355 PolarHBondContact O-N 2.76Å; L353-S356 PolarHBondContact O-N 2.97Å
354	N	23.6	Very low	25.3	Very low	111 Å²	111	136.5 Å²	136.5	59%	0.594	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-7.8	-172.3	-85.1	-23.1	0	0	0	116	L350	L350-N354 WeakPolarHBondContact O-CB 2.9Å; L350-N354 PolarHBondContact O-N 3.11Å; L350-N354 PolarHBondContact O-ND2 2.93Å
355	V	23.6	Very low	25.7	Very low	110 Å²	110	132.2 Å²	132.2	67%	0.667	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-12.5	175	-176.4	0	0	0	0	112.2	L353 L357	L353-V355 VanDerWaalsContact C-N 3.33Å; L353-V355 PolarHBondContact O-N 2.76Å; V355-L357 PolarHBondContact O-N 2.75Å
356	S	23.3	Very low	26.2	Very low	98 Å²	98	124.1 Å²	124.1	69%	0.685	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	3.1	-173.2	-61.5	0	0	0	0	115.9	L353	L353-S356 PolarHBondContact O-N 2.97Å
357	L	25.2	Very low	27.2	Very low	117 Å²	117	117.3 Å²	117.3	61%	0.613	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	5.5	-174.3	-82	164.2	0	0	0	115.8	V355 I1403	V355-L357 PolarHBondContact O-N 2.75Å; L357-I1403 HydrophobicContact CB-CG2 4.5Å; L357-I1403 HydrophobicContact CD1-CG2 4.24Å
358	V	22.4	Very low	28.3	Very low	109 Å²	109	118.7 Å²	118.7	66%	0.661	59%	0.587	S	S	*	*	S	Bend	trans	-122.8	103.3	175.6	-168.1	0	0	0	0	109.6
359	N	21.5	Very low	29.6	Very low	135 Å²	135	111.6 Å²	111.6	72%	0.722	56%	0.557	S	S	*	*	S	Bend	trans	78.4	140.8	170.6	-57	-27.5	0	0	0	117.2
360	F	23.3	Very low	30.8	Very low	165 Å²	165	108.1 Å²	108.1	72%	0.724	54%	0.539	S	S	*	.			trans	102.4	118.9	169.6	-59.1	-76.1	0	0	0	118	R362	F360-R362 PolarHBondContact O-N 2.85Å
361	P	22.6	Very low	32.1	Very low	104 Å²	104	105.5 Å²	105.5	68%	0.675	52%	0.523	S	S	*	.			trans	-70	101.4	-177.6	27.6	-32.2	0	0	0	111.9	Y363	P361-Y363 VanDerWaalsContact C-N 3.33Å; P361-Y363 WeakPolarHBondContact O-CD2 3.31Å; P361-Y363 PolarHBondContact O-N 3.39Å
362	R	25.6	Very low	33.3	Very low	218 Å²	218	100.7 Å²	100.7	82%	0.823	51%	0.509	S	S	*	.	S	Bend	trans	19.3	45.5	143.4	-67.3	-168.3	178	-178.3	0.1	120.5	F360	F360-R362 PolarHBondContact O-N 2.85Å
363	Y	31.4	Very low	34.6	Very low	132 Å²	132	95.9 Å²	95.9	52%	0.518	50%	0.496	S	S	.	.	S	Bend	trans	-123.7	1.1	173.9	-74.8	-69.7	0	0	0	117.2	P361 T492	P361-Y363 VanDerWaalsContact C-N 3.33Å; P361-Y363 WeakPolarHBondContact O-CD2 3.31Å; P361-Y363 PolarHBondContact O-N 3.39Å; Y363-T492 WeakPolarHBondContact O-CB 3.46Å; Y363-T492 WeakPolarHBondContact O-CG2 3.36Å; Y363-T492 PolarHBondContact O-OG1 3.03Å
364	C	32	Very low	35.8	Very low	20 Å²	20	91.3 Å²	91.3	14%	0.135	47%	0.472	C	S	.	.			trans	-143.7	110.3	162.1	-76.8	0	0	0	0	107.6	T492 T564	C364-T492 WeakPolarHBondContact SG-CG2 3.29Å; C364-T564 WeakPolarHBondContact O-CG2 3.42Å
365	E	34.5	Very low	37	Very low	133 Å²	133	88.7 Å²	88.7	62%	0.621	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-59.2	139.2	155.8	-88.6	-179.2	161.6	0	0	107.3	Q367	E365-Q367 PolarHBondContact O-N 3.48Å; E365-Q367 VanDerWaalsContact O-N 3.13Å
366	P	36.4	Very low	38.2	Very low	47 Å²	47	85.6 Å²	85.6	31%	0.305	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-56.5	125	175.5	22.1	-30.5	0	0	0	109.2	Y368 Y562	P366-Y368 HydrophobicContact CB-CE1 4.46Å; P366-Y368 HydrophobicContact CB-CE2 3.77Å; P366-Y368 WeakPolarHBondContact CB-OH 3.3Å; P366-Y368 HydrophobicContact CG-CE2 3.81Å; P366-Y368 WeakPolarHBondContact CG-OH 3.33Å; P366-Y368 WeakPolarHBondContact O-CD2 2.81Å; P366-Y368 WeakPolarHBondContact O-CE2 3.34Å; P366-Y562 CarbonylContact C-O 3.58Å; P366-Y562 WeakPolarHBondContact CA-O 3.45Å
367	Q	47.3	Very low	39	Very low	24 Å²	24	83.5 Å²	83.5	11%	0.112	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125.5	-177.3	-65	-176.9	8.6	0	0	108.6	E365 T492 N495 S561 Y562	E365-Q367 PolarHBondContact O-N 3.48Å; E365-Q367 VanDerWaalsContact O-N 3.13Å; Q367-T492 PolarHBondContact NE2-O 3.32Å; Q367-N495 PolarHBondContact OE1-ND2 2.94Å; Q367-S561 CarbonylContact O-C 3.58Å; Q367-S561 VanDerWaalsContact O-CA 3.29Å; Q367-S561 WeakPolarHBondContact O-CA 3.15Å; Q367-Y562 PolarHBondContact N-O 3.22Å; Q367-Y562 PolarHBondContact O-N 2.77Å
368	Y	47.5	Very low	39.7	Very low	127 Å²	127	80.8 Å²	80.8	50%	0.498	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.4	179.2	-57	-76	0	0	0	109.2	P366 P558 V560	P366-Y368 HydrophobicContact CB-CE1 4.46Å; P366-Y368 HydrophobicContact CB-CE2 3.77Å; P366-Y368 WeakPolarHBondContact CB-OH 3.3Å; P366-Y368 HydrophobicContact CG-CE2 3.81Å; P366-Y368 WeakPolarHBondContact CG-OH 3.33Å; P366-Y368 WeakPolarHBondContact O-CD2 2.81Å; P366-Y368 WeakPolarHBondContact O-CE2 3.34Å; Y368-P558 HydrophobicContact CD1-CB 3.66Å; Y368-P558 HydrophobicContact CD1-CG 3.71Å; Y368-P558 HydrophobicContact CE1-CG 4.28Å; Y368-P558 HydrophobicContact CG-CB 4.2Å; Y368-V560 WeakPolarHBondContact CA-O 3.46Å
369	I	54.9	Low	40.8	Very low	39 Å²	39	80.6 Å²	80.6	20%	0.2	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	109	169.2	-52.9	177	0	0	0	106.5	L374 F437 W559 V560	I369-L374 HydrophobicContact CG2-CD1 3.54Å; I369-L374 HydrophobicContact CG2-CD2 4.16Å; I369-L374 HydrophobicContact CG2-CG 3.63Å; I369-F437 HydrophobicContact CD1-CE1 4.21Å; I369-F437 HydrophobicContact CD1-CZ 3.76Å; I369-W559 WeakPolarHBondContact O-CB 3.47Å; I369-W559 PolarHBondContact O-N 3.45Å; I369-V560 HydrophobicContact CB-CB 4.17Å; I369-V560 HydrophobicContact CD1-CB 4.42Å; I369-V560 HydrophobicContact CG1-CB 4.47Å; I369-V560 PolarHBondContact N-O 3.29Å; I369-V560 PolarHBondContact O-N 3.36Å
370	L	51.8	Low	41.3	Very low	55 Å²	55	77.9 Å²	77.9	29%	0.288	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	147.8	171.8	-68.5	167.7	0	0	0	109.6	S372 S373 S556	L370-S372 VanDerWaalsContact C-N 3.29Å; L370-S372 PolarHBondContact O-N 3.04Å; L370-S373 WeakPolarHBondContact O-CB 3.34Å; L370-S373 PolarHBondContact O-N 3.35Å; L370-S556 WeakPolarHBondContact CD2-O 3.12Å
371	Y	51.9	Low	41.9	Very low	42 Å²	42	75.6 Å²	75.6	17%	0.165	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-40.5	178.3	-169.5	-109	0	0	0	112.3	S373 L374 L375 W559 E885	Y371-S373 VanDerWaalsContact C-N 3.31Å; Y371-S373 PolarHBondContact O-N 2.8Å; Y371-L374 WeakPolarHBondContact O-CB 3.18Å; Y371-L374 PolarHBondContact O-N 3.18Å; Y371-L374 VanDerWaalsContact O-N 3.08Å; Y371-L375 HydrophobicContact CD1-CD1 3.62Å; Y371-L375 HydrophobicContact CD1-CG 4.27Å; Y371-L375 HydrophobicContact CE1-CD1 3.33Å; Y371-L375 HydrophobicContact CE1-CD2 4.47Å; Y371-L375 HydrophobicContact CE1-CG 3.8Å; Y371-L375 PolarHBondContact O-N 3.4Å; Y371-W559 HydrophobicContact CD2-CD2 4.01Å; Y371-W559 HydrophobicContact CD2-CG 4.06Å; Y371-E885 WeakPolarHBondContact CE1-OE2 3.42Å; Y371-E885 WeakPolarHBondContact OH-CB 3.39Å; Y371-E885 WeakPolarHBondContact OH-CG 3.34Å; Y371-E885 PolarHBondContact OH-OE2 3.07Å
372	S	50.8	Low	42.3	Very low	58 Å²	58	76.5 Å²	76.5	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-57.9	-39.5	175.4	51.5	0	0	0	0	113.2	L370 L374 L375 N376	L370-S372 VanDerWaalsContact C-N 3.29Å; L370-S372 PolarHBondContact O-N 3.04Å; S372-L374 PolarHBondContact O-N 3.27Å; S372-L375 PolarHBondContact O-N 3.08Å; S372-N376 PolarHBondContact O-N 3.2Å; S372-N376 VanDerWaalsContact O-N 3.07Å; S372-N376 PolarHBondContact O-ND2 3.2Å; S372-N376 PolarHBondContact O-OD1 3.23Å
373	S	51.2	Low	42.2	Very low	63 Å²	63	71.6 Å²	71.6	44%	0.441	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-29.8	177.5	-55.8	0	0	0	0	112.9	L370 Y371	L370-S373 WeakPolarHBondContact O-CB 3.34Å; L370-S373 PolarHBondContact O-N 3.35Å; Y371-S373 VanDerWaalsContact C-N 3.31Å; Y371-S373 PolarHBondContact O-N 2.8Å
374	L	50.3	Low	42.1	Very low	10 Å²	10	69.2 Å²	69.2	5%	0.052	35%	0.353	C	S	.	.	H	α-helix	trans	-84.6	-38.3	179.1	-73.8	163.8	0	0	0	112.3	I369 Y371 S372 N376 L377 L435 W559	I369-L374 HydrophobicContact CG2-CD1 3.54Å; I369-L374 HydrophobicContact CG2-CD2 4.16Å; I369-L374 HydrophobicContact CG2-CG 3.63Å; Y371-L374 WeakPolarHBondContact O-CB 3.18Å; Y371-L374 PolarHBondContact O-N 3.18Å; Y371-L374 VanDerWaalsContact O-N 3.08Å; S372-L374 PolarHBondContact O-N 3.27Å; L374-N376 PolarHBondContact O-N 3.36Å; L374-L377 HydrophobicContact CD2-CD1 4.06Å; L374-L377 VanDerWaalsContact O-CB 3.31Å; L374-L377 WeakPolarHBondContact O-CB 3.45Å; L374-L377 PolarHBondContact O-N 3.23Å; L374-L435 HydrophobicContact CD2-CD1 3.21Å; L374-W559 HydrophobicContact CD1-CD2 4.31Å; L374-W559 HydrophobicContact CD1-CE3 3.14Å; L374-W559 HydrophobicContact CD1-CH2 4.42Å; L374-W559 HydrophobicContact CD1-CZ3 3.23Å
375	L	49.5	Very low	41.7	Very low	56 Å²	56	76.8 Å²	76.8	29%	0.293	38%	0.378	S	S	.	.	H	α-helix	trans	-56.5	-37.6	170	-86.5	166.8	0	0	0	111.3	Y371 S372 L377 K378	Y371-L375 HydrophobicContact CD1-CD1 3.62Å; Y371-L375 HydrophobicContact CD1-CG 4.27Å; Y371-L375 HydrophobicContact CE1-CD1 3.33Å; Y371-L375 HydrophobicContact CE1-CD2 4.47Å; Y371-L375 HydrophobicContact CE1-CG 3.8Å; Y371-L375 PolarHBondContact O-N 3.4Å; S372-L375 PolarHBondContact O-N 3.08Å; L375-L377 PolarHBondContact O-N 2.62Å; L375-K378 VanDerWaalsContact O-CB 3.31Å; L375-K378 WeakPolarHBondContact O-CB 3.3Å; L375-K378 PolarHBondContact O-N 3.01Å
376	N	48	Very low	41.2	Very low	45 Å²	45	76.5 Å²	76.5	24%	0.241	38%	0.381	C	S	.	.	H	α-helix	trans	-61.4	-24.4	175.2	-65.8	-11	0	0	0	113.2	S372 L374 K378 E379	S372-N376 PolarHBondContact O-N 3.2Å; S372-N376 VanDerWaalsContact O-N 3.07Å; S372-N376 PolarHBondContact O-ND2 3.2Å; S372-N376 PolarHBondContact O-OD1 3.23Å; L374-N376 PolarHBondContact O-N 3.36Å; N376-K378 VanDerWaalsContact C-N 3.3Å; N376-K378 PolarHBondContact O-N 2.82Å; N376-E379 PolarHBondContact O-N 3.15Å
377	L	40.9	Very low	40.6	Very low	55 Å²	55	79 Å²	79	29%	0.288	40%	0.397	S	S	.	.	H	α-helix	trans	-70.4	-24.5	173.6	-68.1	171.6	0	0	0	112.5	L374 L375 E379 F380 I433	L374-L377 HydrophobicContact CD2-CD1 4.06Å; L374-L377 VanDerWaalsContact O-CB 3.31Å; L374-L377 WeakPolarHBondContact O-CB 3.45Å; L374-L377 PolarHBondContact O-N 3.23Å; L375-L377 PolarHBondContact O-N 2.62Å; L377-E379 VanDerWaalsContact C-N 3.28Å; L377-E379 PolarHBondContact O-N 3.37Å; L377-F380 WeakPolarHBondContact O-CB 3.32Å; L377-F380 PolarHBondContact O-N 3.49Å; L377-I433 VanDerWaalsContact C-CD1 3.44Å; L377-I433 HydrophobicContact CB-CD1 3.69Å; L377-I433 WeakPolarHBondContact O-CD1 3.31Å
378	K	40.8	Very low	39.5	Very low	59 Å²	59	85.4 Å²	85.4	26%	0.257	43%	0.431	S	S	.	.	H	α-helix	trans	-64.2	-35	172	-91.3	-175.6	163.6	-176.7	0	112.1	L375 N376 F380 I433 D886	L375-K378 VanDerWaalsContact O-CB 3.31Å; L375-K378 WeakPolarHBondContact O-CB 3.3Å; L375-K378 PolarHBondContact O-N 3.01Å; N376-K378 VanDerWaalsContact C-N 3.3Å; N376-K378 PolarHBondContact O-N 2.82Å; K378-F380 PolarHBondContact O-N 2.93Å; K378-I433 HydrophobicContact CG-CD1 4.18Å; K378-D886 VanDerWaalsContact CE-OD2 3.25Å; K378-D886 WeakPolarHBondContact CE-OD2 3.48Å; K378-D886 IonicContact NZ-OD2 3.83Å; K378-D886 PolarHBondContact NZ-OD2 3.28Å
379	E	43.9	Very low	38.5	Very low	106 Å²	106	85.2 Å²	85.2	50%	0.495	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.3	179.9	-69.4	-168.6	-172.3	0	0	112.7	N376 L377 N381 Q541	N376-E379 PolarHBondContact O-N 3.15Å; L377-E379 VanDerWaalsContact C-N 3.28Å; L377-E379 PolarHBondContact O-N 3.37Å; E379-N381 VanDerWaalsContact C-N 3.29Å; E379-N381 PolarHBondContact O-N 2.84Å; E379-Q541 PolarHBondContact OE2-NE2 2.77Å
380	F	32.8	Very low	36.9	Very low	78 Å²	78	90.5 Å²	90.5	34%	0.342	47%	0.472	S	S	.	.	S	Bend	trans	-70.9	88.7	166.1	-83.1	-89.7	0	0	0	109.8	L377 K378 F382	L377-F380 WeakPolarHBondContact O-CB 3.32Å; L377-F380 PolarHBondContact O-N 3.49Å; K378-F380 PolarHBondContact O-N 2.93Å; F380-F382 VanDerWaalsContact C-N 3.34Å; F380-F382 HydrophobicContact CB-CE2 4.32Å; F380-F382 WeakPolarHBondContact O-CD2 3.23Å; F380-F382 PolarHBondContact O-N 2.67Å
381	N	34.9	Very low	35.5	Very low	116 Å²	116	98.7 Å²	98.7	62%	0.62	50%	0.499	S	S	*	.			trans	-59.8	94.5	166.1	-80.5	-41.8	0	0	0	109.8	E379 M383	E379-N381 VanDerWaalsContact C-N 3.29Å; E379-N381 PolarHBondContact O-N 2.84Å; N381-M383 VanDerWaalsContact C-N 3.26Å; N381-M383 PolarHBondContact O-N 3.17Å
382	F	31.2	Very low	34.1	Very low	123 Å²	123	105.9 Å²	105.9	54%	0.539	53%	0.531	S	S	.	.			trans	-67.8	89.7	164.5	-69.6	-82.9	0	0	0	107.4	F380 P384	F380-F382 VanDerWaalsContact C-N 3.34Å; F380-F382 HydrophobicContact CB-CE2 4.32Å; F380-F382 WeakPolarHBondContact O-CD2 3.23Å; F380-F382 PolarHBondContact O-N 2.67Å; F382-P384 WeakPolarHBondContact O-CD 3.25Å
383	M	25.3	Very low	32.6	Very low	115 Å²	115	111.7 Å²	111.7	57%	0.567	55%	0.554	S	S	*	*			trans	-74.5	108.9	173.1	-74.1	-101.8	79.7	0	0	109	N381 R385	N381-M383 VanDerWaalsContact C-N 3.26Å; N381-M383 PolarHBondContact O-N 3.17Å; M383-R385 PolarHBondContact O-N 2.79Å; M383-R385 VanDerWaalsContact O-N 3.1Å
384	P	27.4	Very low	31.2	Very low	83 Å²	83	114.9 Å²	114.9	54%	0.539	57%	0.566	S	S	.	*			trans	-66.3	109.8	161.5	27.7	-31.7	0	0	0	107.2	F382 N386	F382-P384 WeakPolarHBondContact O-CD 3.25Å; P384-N386 PolarHBondContact O-N 3.35Å; P384-N386 VanDerWaalsContact O-N 3.12Å
385	R	25.1	Very low	29.9	Very low	178 Å²	178	118.7 Å²	118.7	67%	0.672	59%	0.593	S	S	*	*			trans	-65.7	116.9	175.6	-140.2	-177.9	-155.4	-172.5	7.4	108	M383 L526	M383-R385 PolarHBondContact O-N 2.79Å; M383-R385 VanDerWaalsContact O-N 3.1Å; R385-L526 VanDerWaalsContact NH2-CD2 3.34Å
386	N	23.7	Very low	28.5	Very low	127 Å²	127	127 Å²	127	68%	0.679	62%	0.623	S	S	*	*			trans	-47.8	129	177.7	-119.9	-21.8	0	0	0	110.6	P384 L388	P384-N386 PolarHBondContact O-N 3.35Å; P384-N386 VanDerWaalsContact O-N 3.12Å; N386-L388 PolarHBondContact O-N 3.44Å
387	P	24.3	Very low	27.4	Very low	100 Å²	100	130.1 Å²	130.1	65%	0.649	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	11.7	-170.4	26.3	-33.1	0	0	0	115.6	V389	P387-V389 VanDerWaalsContact C-N 3.34Å; P387-V389 PolarHBondContact O-N 3.26Å
388	L	24.1	Very low	26.4	Very low	158 Å²	158	136 Å²	136	83%	0.827	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-1.4	-176	-72.8	172.9	0	0	0	115.2	N386 N390	N386-L388 PolarHBondContact O-N 3.44Å; L388-N390 PolarHBondContact O-N 3.12Å
389	V	25.3	Very low	25.5	Very low	123 Å²	123	140.2 Å²	140.2	75%	0.745	69%	0.692	S	S	*	*			trans	-94.1	52.2	168.8	-162.5	0	0	0	0	110.3	P387 R391	P387-V389 VanDerWaalsContact C-N 3.34Å; P387-V389 PolarHBondContact O-N 3.26Å; V389-R391 HydrophobicContact CG1-CB 4.49Å; V389-R391 PolarHBondContact O-N 2.84Å
390	N	21.7	Very low	24.4	Very low	150 Å²	150	142 Å²	142	80%	0.802	71%	0.705	S	S	*	*			trans	-75.2	63.1	156	-105.3	-13.2	0	0	0	108.1	L388 K392	L388-N390 PolarHBondContact O-N 3.12Å; N390-K392 VanDerWaalsContact C-N 3.28Å; N390-K392 PolarHBondContact O-N 3.21Å
391	R	22.4	Very low	23.9	Very low	228 Å²	228	147.5 Å²	147.5	86%	0.86	73%	0.725	S	S	*	*			trans	-71	98.4	161.2	-111.2	-174.3	-174.5	173.5	2.7	105.5	V389 M393	V389-R391 HydrophobicContact CG1-CB 4.49Å; V389-R391 PolarHBondContact O-N 2.84Å; R391-M393 PolarHBondContact O-N 3.18Å
392	K	22.4	Very low	23.3	Very low	192 Å²	192	149.8 Å²	149.8	84%	0.835	73%	0.731	S	S	*	*			trans	-34.1	96.6	171.9	-69	173.4	175.7	176	0	110.8	N390 N394	N390-K392 VanDerWaalsContact C-N 3.28Å; N390-K392 PolarHBondContact O-N 3.21Å; K392-N394 PolarHBondContact O-N 2.99Å
393	M	20.5	Very low	23.1	Very low	180 Å²	180	151.3 Å²	151.3	89%	0.887	75%	0.745	S	S	*	*			trans	-89.2	60.5	159.6	-103	-169.4	165	0	0	107.3	R391	R391-M393 PolarHBondContact O-N 3.18Å
394	N	21.1	Very low	23	Very low	131 Å²	131	154.7 Å²	154.7	70%	0.701	76%	0.757	S	S	*	*			trans	-99.7	129.7	166.2	-79.5	-5	0	0	0	107.4	K392	K392-N394 PolarHBondContact O-N 2.99Å
395	S	22	Very low	23	Very low	89 Å²	89	157.8 Å²	157.8	62%	0.622	77%	0.768	S	S	*	*			trans	59.2	91.4	162.7	61.8	0	0	0	0	118
396	Y	21.4	Very low	23	Very low	232 Å²	232	159.1 Å²	159.1	91%	0.91	78%	0.78	S	S	*	*			trans	-117.5	73.3	134.9	-85.1	-82.9	0	0	0	108.3
397	T	23.5	Very low	23	Very low	110 Å²	110	160.3 Å²	160.3	68%	0.675	79%	0.786	S	S	*	*			trans	-61.6	122.7	154.7	23.3	0	0	0	0	108.7
398	Q	21.3	Very low	23.1	Very low	177 Å²	177	163.1 Å²	163.1	83%	0.827	80%	0.795	S	S	*	*			trans	63.7	73.6	137	-150.5	169.9	19.4	0	0	116.3
399	M	20.8	Very low	23.2	Very low	148 Å²	148	163 Å²	163	73%	0.729	79%	0.794	S	S	*	*			trans	-109.7	103	160.2	-71.2	-66.7	-94	0	0	108.9	Y401	M399-Y401 HydrophobicContact CE-CD2 4.29Å; M399-Y401 HydrophobicContact CE-CE2 3.7Å; M399-Y401 HydrophobicContact SD-CE2 4.31Å
400	N	20.6	Very low	23.2	Very low	144 Å²	144	164 Å²	164	77%	0.77	80%	0.795	S	S	*	*			trans	-88.8	102.9	174.2	-162.6	18.8	0	0	0	106.5
401	Y	23.9	Very low	23.3	Very low	194 Å²	194	167.8 Å²	167.8	76%	0.761	80%	0.8	S	S	*	*			trans	-134.9	104.1	167.8	-82.7	-79.9	0	0	0	109.6	M399	M399-Y401 HydrophobicContact CE-CD2 4.29Å; M399-Y401 HydrophobicContact CE-CE2 3.7Å; M399-Y401 HydrophobicContact SD-CE2 4.31Å
402	H	21.9	Very low	23.3	Very low	163 Å²	163	163 Å²	163	76%	0.755	79%	0.792	S	S	*	*			trans	-62.9	118.7	141.9	-91.5	-92.9	0	0	0	107.3
403	D	26.3	Very low	23.5	Very low	156 Å²	156	160.2 Å²	160.2	83%	0.834	79%	0.79	S	S	*	*				174.9	146.2	118.8	-90.6	-30.1	0	0	0	110.6
404	K	23.8	Very low	23.6	Very low	186 Å²	186	158.3 Å²	158.3	81%	0.809	78%	0.782	S	S	*	*			trans	-73.1	158.9	178.7	-68.3	173.4	175.9	175.2	0	109.7
405	D	27.6	Very low	23.6	Very low	147 Å²	147	160.5 Å²	160.5	79%	0.786	79%	0.788	S	S	*	*			trans	86.7	98.9	169.9	-50.6	-27.2	0	0	0	114.4
406	F	25.4	Very low	23.7	Very low	207 Å²	207	163.3 Å²	163.3	91%	0.908	80%	0.796	S	S	*	*			trans	-171.6	94.6	131.8	-101.1	-73.9	0	0	0	107.8
407	N	22.9	Very low	23.7	Very low	151 Å²	151	157.4 Å²	157.4	81%	0.807	78%	0.784	S	S	*	*			trans	-68.8	156.2	151.8	-73.8	-34.9	0	0	0	107.7
408	D	26.9	Very low	23.7	Very low	159 Å²	159	157.9 Å²	157.9	85%	0.85	79%	0.787	S	S	*	*			trans	87.4	72.5	-179.5	-58.3	-21.7	0	0	0	116.2
409	I	25.8	Very low	23.8	Very low	156 Å²	156	156.4 Å²	156.4	80%	0.8	79%	0.785	S	S	*	*			trans	-126.2	106.5	146.5	-60.2	179.1	0	0	0	107.7	Y411	I409-Y411 PolarHBondContact O-N 2.75Å
410	D	25.5	Very low	23.9	Very low	143 Å²	143	156.6 Å²	156.6	77%	0.765	79%	0.789	S	S	*	*			trans	-49.2	119.3	172.8	-97	-43.4	0	0	0	111.8	N412	D410-N412 VanDerWaalsContact C-N 3.26Å; D410-N412 PolarHBondContact O-N 3Å
411	Y	23.6	Very low	24	Very low	230 Å²	230	157.1 Å²	157.1	90%	0.902	79%	0.792	S	S	*	*			trans	-76.5	77.1	165	-86.2	-94.2	0	0	0	109.2	I409	I409-Y411 PolarHBondContact O-N 2.75Å
412	N	22.6	Very low	23.9	Very low	129 Å²	129	155.6 Å²	155.6	69%	0.69	79%	0.793	S	S	*	*			trans	-135.3	137	168.1	-86.3	-38.4	0	0	0	110.4	D410	D410-N412 VanDerWaalsContact C-N 3.26Å; D410-N412 PolarHBondContact O-N 3Å
413	V	25.2	Very low	23.8	Very low	133 Å²	133	152.2 Å²	152.2	81%	0.806	79%	0.788	S	S	*	*			trans	78.8	104.7	178.5	-161.9	0	0	0	0	111.6
414	I	24.4	Very low	23.7	Very low	140 Å²	140	150.2 Å²	150.2	72%	0.718	78%	0.781	S	S	*	*				-138.7	104.8	78.8	-69.4	147.5	0	0	0	109.7	D416	I414-D416 HydrophobicContact CG2-CB 4.06Å; I414-D416 PolarHBondContact O-N 2.87Å
415	Q	20.8	Very low	23.8	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.822	77%	0.771	S	S	*	*			trans	-81.4	87.6	155.5	-76.3	-176.5	-13.4	0	0	107.6	T417	Q415-T417 VanDerWaalsContact C-N 3.26Å; Q415-T417 PolarHBondContact O-N 3.49Å; Q415-T417 VanDerWaalsContact O-N 3.12Å
416	D	23.5	Very low	23.7	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	78%	0.776	S	S	*	*			trans	-82.2	85.5	161.4	-84.1	-18.9	0	0	0	108.1	I414	I414-D416 HydrophobicContact CG2-CB 4.06Å; I414-D416 PolarHBondContact O-N 2.87Å
417	T	21.9	Very low	23.8	Very low	108 Å²	108	148.4 Å²	148.4	66%	0.663	77%	0.771	S	S	*	*			trans	-53.7	126	151.5	41.9	0	0	0	0	109.6	Q415	Q415-T417 VanDerWaalsContact C-N 3.26Å; Q415-T417 PolarHBondContact O-N 3.49Å; Q415-T417 VanDerWaalsContact O-N 3.12Å
418	T	23.6	Very low	24	Very low	120 Å²	120	146.9 Å²	146.9	74%	0.736	76%	0.758	S	S	*	*				165	99.9	129.5	39.6	0	0	0	0	112.3	N420	T418-N420 VanDerWaalsContact C-N 3.3Å; T418-N420 PolarHBondContact O-N 2.86Å
419	N	22.5	Very low	24.4	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	75%	0.747	S	S	*	*				41.7	31.3	114	-75.6	-1.7	0	0	0	121.7	N421	N419-N421 PolarHBondContact O-N 3.37Å
420	N	24.1	Very low	25.1	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	74%	0.736	S	S	*	*			trans	-80.9	80	156.1	-77.3	-16.8	0	0	0	109.5	T418 M422	T418-N420 VanDerWaalsContact C-N 3.3Å; T418-N420 PolarHBondContact O-N 2.86Å; N420-M422 PolarHBondContact O-N 3.23Å
421	N	22.1	Very low	26	Very low	154 Å²	154	134.6 Å²	134.6	82%	0.824	70%	0.704	S	S	*	*			trans	-56.6	74.1	151	-79.7	-20.5	0	0	0	107.8	N419 S423	N419-N421 PolarHBondContact O-N 3.37Å; N421-S423 VanDerWaalsContact C-N 3.26Å; N421-S423 PolarHBondContact O-N 3.39Å
422	M	20.8	Very low	27.3	Very low	162 Å²	162	128.1 Å²	128.1	80%	0.798	68%	0.681	S	S	*	*			trans	-68	99.2	166.4	-125.5	-162.5	-73.4	0	0	105.1	N420 V424	N420-M422 PolarHBondContact O-N 3.23Å; M422-V424 VanDerWaalsContact C-N 3.32Å; M422-V424 PolarHBondContact O-N 2.89Å
423	S	20.9	Very low	28.8	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	65%	0.649	S	S	*	*			trans	-41.4	101.8	162.7	171.4	0	0	0	0	107.4	N421 D425	N421-S423 VanDerWaalsContact C-N 3.26Å; N421-S423 PolarHBondContact O-N 3.39Å; S423-D425 PolarHBondContact O-N 3.41Å
424	V	24.8	Very low	30.5	Very low	114 Å²	114	117.4 Å²	117.4	69%	0.691	62%	0.62	S	S	*	*			trans	-69.3	94.3	167.2	178.1	0	0	0	0	103.8	M422 K426	M422-V424 VanDerWaalsContact C-N 3.32Å; M422-V424 PolarHBondContact O-N 2.89Å; V424-K426 PolarHBondContact O-N 2.89Å
425	D	24.3	Very low	32.2	Very low	110 Å²	110	110.9 Å²	110.9	59%	0.588	59%	0.587	S	S	*	*			trans	-46.3	115.1	172.7	-81.4	-28.3	0	0	0	107.6	S423 K427	S423-D425 PolarHBondContact O-N 3.41Å; D425-K427 PolarHBondContact O-N 3.18Å
426	K	26	Very low	34.2	Very low	205 Å²	205	104 Å²	104	89%	0.891	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	21.9	179.6	-72.8	-179.3	173.7	178.1	0	113.3	V424	V424-K426 PolarHBondContact O-N 2.89Å
427	K	26.9	Very low	36.2	Very low	187 Å²	187	97.5 Å²	97.5	81%	0.813	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	5.5	-172.1	-78.6	-171.2	175.1	179.5	0	115.1	D425 A429	D425-K427 PolarHBondContact O-N 3.18Å; K427-A429 PolarHBondContact O-N 3Å
428	F	28	Very low	38.1	Very low	119 Å²	119	95.8 Å²	95.8	52%	0.522	50%	0.503	S	S	.	.			trans	-86.6	37.6	172.1	-70.1	-75.7	0	0	0	113.2	D430	F428-D430 VanDerWaalsContact C-N 3.31Å; F428-D430 PolarHBondContact O-N 3.15Å
429	A	34.4	Very low	40.1	Very low	75 Å²	75	90 Å²	90	62%	0.62	47%	0.468	S	S	*	.			trans	-72.6	-21.4	-179.4	0	0	0	0	0	113.5	K427 N431	K427-A429 PolarHBondContact O-N 3Å; A429-N431 PolarHBondContact O-N 2.99Å
430	D	41.2	Very low	42.2	Very low	108 Å²	108	83.1 Å²	83.1	58%	0.578	43%	0.431	S	S	*	.			trans	-98.8	44.7	-170.6	-69	-2.4	0	0	0	113.3	F428 K432 T461	F428-D430 VanDerWaalsContact C-N 3.31Å; F428-D430 PolarHBondContact O-N 3.15Å; D430-K432 PolarHBondContact O-N 3.38Å; D430-T461 WeakPolarHBondContact O-CG2 3.28Å
431	N	44.7	Very low	43.9	Very low	18 Å²	18	76.2 Å²	76.2	10%	0.096	39%	0.394	C	S	.	.			trans	-71.8	81.9	173.1	-78	-14	0	0	0	110.2	A429 I433 T461	A429-N431 PolarHBondContact O-N 2.99Å; N431-I433 PolarHBondContact O-N 3.46Å; N431-T461 PolarHBondContact OD1-OG1 2.88Å
432	K	50.8	Low	45.5	Very low	93 Å²	93	71.5 Å²	71.5	40%	0.404	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-70.3	123.7	168.1	-72.3	-180	-178.1	174.3	0	110	D430 S459 A460 D886	D430-K432 PolarHBondContact O-N 3.38Å; K432-S459 WeakPolarHBondContact O-CA 3.29Å; K432-A460 HydrophobicContact CB-CB 3.83Å; K432-A460 PolarHBondContact O-N 3.33Å; K432-D886 CarbonylContact C-O 3.5Å; K432-D886 VanDerWaalsContact CA-O 3.29Å; K432-D886 WeakPolarHBondContact CA-O 3.39Å; K432-D886 HydrophobicContact CB-CB 4.47Å; K432-D886 WeakPolarHBondContact CE-OD1 3.41Å; K432-D886 HydrophobicContact CG-CB 3.81Å; K432-D886 WeakPolarHBondContact CG-OD1 3.4Å
433	I	54.7	Low	46.8	Very low	6 Å²	6	70.4 Å²	70.4	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.5	178.1	-58.6	177.3	0	0	0	107.9	L377 K378 N431 L435 I457 D886 V887 I888	L377-I433 VanDerWaalsContact C-CD1 3.44Å; L377-I433 HydrophobicContact CB-CD1 3.69Å; L377-I433 WeakPolarHBondContact O-CD1 3.31Å; K378-I433 HydrophobicContact CG-CD1 4.18Å; N431-I433 PolarHBondContact O-N 3.46Å; I433-L435 HydrophobicContact CG2-CD2 3.98Å; I433-L435 HydrophobicContact CG2-CG 4.16Å; I433-I457 HydrophobicContact CG2-CG2 3.98Å; I433-D886 PolarHBondContact N-O 3.41Å; I433-V887 WeakPolarHBondContact O-CA 3.29Å; I433-I888 PolarHBondContact O-N 3.33Å
434	T	59.1	Low	47.9	Very low	31 Å²	31	68.3 Å²	68.3	19%	0.19	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.7	171.2	-53.3	0	0	0	0	109	I457 T458 I888	T434-I457 WeakPolarHBondContact O-CA 3.19Å; T434-T458 WeakPolarHBondContact CB-OG1 3.43Å; T434-T458 PolarHBondContact N-O 2.84Å; T434-T458 PolarHBondContact O-N 3.43Å; T434-I888 CarbonylContact C-O 3.45Å; T434-I888 WeakPolarHBondContact CA-O 3.42Å; T434-I888 HydrophobicContact CG2-CB 4.16Å; T434-I888 HydrophobicContact CG2-CG2 4.2Å
435	L	61.5	Low	49.3	Very low	4 Å²	4	71 Å²	71	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.2	176.2	-61.7	176.5	0	0	0	109.1	L374 I433 F437 L454 I457 V887 I888 L889 T890	L374-L435 HydrophobicContact CD2-CD1 3.21Å; I433-L435 HydrophobicContact CG2-CD2 3.98Å; I433-L435 HydrophobicContact CG2-CG 4.16Å; L435-F437 HydrophobicContact CB-CD2 4.33Å; L435-F437 HydrophobicContact CB-CE2 3.85Å; L435-F437 HydrophobicContact CD1-CE2 4.38Å; L435-L454 HydrophobicContact CB-CD1 4.21Å; L435-L454 HydrophobicContact CD2-CD1 4.22Å; L435-I457 HydrophobicContact CD2-CB 4.18Å; L435-I457 HydrophobicContact CD2-CD1 4.29Å; L435-I457 HydrophobicContact CD2-CG1 3.73Å; L435-I457 HydrophobicContact CD2-CG2 3.88Å; L435-V887 HydrophobicContact CD1-CG1 4.26Å; L435-I888 PolarHBondContact N-O 3.04Å; L435-L889 WeakPolarHBondContact O-CA 3.4Å; L435-T890 PolarHBondContact O-N 3.34Å
436	L	62.5	Low	50.5	Low	32 Å²	32	75.2 Å²	75.2	17%	0.168	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	111.5	176.4	-179.7	64.9	0	0	0	110.1	Y455 Q456 T890	L436-Y455 PolarHBondContact O-N 3.49Å; L436-Q456 HydrophobicContact CB-CB 4.03Å; L436-Q456 HydrophobicContact CD2-CB 4.29Å; L436-Q456 PolarHBondContact N-O 3.38Å; L436-T890 HydrophobicContact CD1-CG2 3.47Å; L436-T890 VanDerWaalsContact CD1-CG2 3.47Å
437	F	64.4	Low	51.4	Low	12 Å²	12	70.5 Å²	70.5	5%	0.053	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	129.5	170.2	-70.4	-89	0	0	0	110.1	I369 L435 M452 K453 L454 L889 T890 I891 D892	I369-F437 HydrophobicContact CD1-CE1 4.21Å; I369-F437 HydrophobicContact CD1-CZ 3.76Å; L435-F437 HydrophobicContact CB-CD2 4.33Å; L435-F437 HydrophobicContact CB-CE2 3.85Å; L435-F437 HydrophobicContact CD1-CE2 4.38Å; F437-M452 HydrophobicContact CD1-CG 4.03Å; F437-M452 HydrophobicContact CD1-SD 4.21Å; F437-M452 HydrophobicContact CE1-CE 4.38Å; F437-K453 CarbonylContact C-O 3.55Å; F437-K453 WeakPolarHBondContact CA-O 3.46Å; F437-L454 HydrophobicContact CD1-CB 4.15Å; F437-L454 HydrophobicContact CD1-CD1 4.28Å; F437-L454 HydrophobicContact CD2-CD1 4.24Å; F437-L454 HydrophobicContact CE1-CB 3.86Å; F437-L454 HydrophobicContact CE1-CD1 3.96Å; F437-L454 HydrophobicContact CE1-CG 4.42Å; F437-L454 HydrophobicContact CE2-CD1 3.91Å; F437-L454 HydrophobicContact CG-CD1 4.43Å; F437-L454 HydrophobicContact CZ-CB 4.45Å; F437-L454 HydrophobicContact CZ-CD1 3.77Å; F437-L889 HydrophobicContact CD2-CD1 3.68Å; F437-L889 HydrophobicContact CD2-CG 4.02Å; F437-L889 HydrophobicContact CE2-CD1 3.52Å; F437-L889 HydrophobicContact CE2-CG 4.33Å; F437-T890 PolarHBondContact N-O 3.5Å; F437-I891 CarbonylContact O-C 3.58Å; F437-I891 WeakPolarHBondContact O-CA 3.45Å; F437-D892 PolarHBondContact O-N 2.82Å
438	K	62.5	Low	52.5	Low	71 Å²	71	64.7 Å²	64.7	31%	0.309	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.8	164.9	-67.2	-154.2	173.1	-171.2	0	109.5	M452 K453 Y455 D892 F894	K438-M452 WeakPolarHBondContact O-CA 3.31Å; K438-K453 PolarHBondContact N-O 3.37Å; K438-K453 PolarHBondContact O-N 2.73Å; K438-Y455 HydrophobicContact CB-CD2 3.81Å; K438-Y455 HydrophobicContact CB-CE2 4.13Å; K438-Y455 HydrophobicContact CD-CD2 3.7Å; K438-Y455 HydrophobicContact CD-CE2 3.7Å; K438-Y455 HydrophobicContact CD-CG 4.21Å; K438-Y455 HydrophobicContact CG-CD2 3.53Å; K438-Y455 HydrophobicContact CG-CE2 4Å; K438-Y455 HydrophobicContact CG-CG 4.08Å; K438-D892 WeakPolarHBondContact CE-OD2 3.43Å; K438-D892 HydrophobicContact CG-CB 4.1Å; K438-F894 HydrophobicContact CB-CE1 4.21Å
439	V	65.9	Low	53.8	Low	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.9	-177.9	-172.5	0	0	0	0	108.4	I451 M452 Y562 L568 W581 I891 D892 C893 F894	V439-I451 WeakPolarHBondContact CA-O 3.11Å; V439-M452 HydrophobicContact CG2-CB 4.49Å; V439-M452 HydrophobicContact CG2-CG 4.11Å; V439-Y562 HydrophobicContact CG1-CE2 4.5Å; V439-L568 HydrophobicContact CG2-CD2 3.91Å; V439-W581 HydrophobicContact CG1-CD2 3.91Å; V439-W581 HydrophobicContact CG1-CE3 3.57Å; V439-W581 HydrophobicContact CG1-CH2 3.8Å; V439-W581 HydrophobicContact CG1-CZ2 4.11Å; V439-W581 HydrophobicContact CG1-CZ3 3.5Å; V439-I891 HydrophobicContact CB-CG2 4.12Å; V439-I891 HydrophobicContact CG2-CG2 3.67Å; V439-D892 PolarHBondContact N-O 3.19Å; V439-C893 WeakPolarHBondContact O-CA 3.38Å; V439-F894 WeakPolarHBondContact O-CD1 3.4Å; V439-F894 WeakPolarHBondContact O-CE1 3.38Å; V439-F894 PolarHBondContact O-N 3.04Å
440	G	66	Low	54.9	Low	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.5	-142.1	-178.9	0	0	0	0	0	112.2	P450 I451	G440-P450 WeakPolarHBondContact O-CA 3.49Å; G440-I451 PolarHBondContact N-O 3.2Å; G440-I451 PolarHBondContact O-N 2.97Å
441	F	60.3	Low	55.8	Low	7 Å²	7	56 Å²	56	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.9	-173.3	-61	-76.5	0	0	0	111.5	R448 P450 W581 S583 F894 N896	F441-R448 HydrophobicContact CB-CG 4.32Å; F441-R448 HydrophobicContact CD1-CG 3.87Å; F441-R448 VanDerWaalsContact CD2-NH2 3.25Å; F441-R448 HydrophobicContact CG-CG 4.38Å; F441-P450 HydrophobicContact CE1-CB 4.43Å; F441-W581 HydrophobicContact CE2-CH2 4.33Å; F441-W581 HydrophobicContact CE2-CZ2 4.13Å; F441-W581 HydrophobicContact CZ-CH2 4.01Å; F441-W581 HydrophobicContact CZ-CZ2 4.15Å; F441-S583 VanDerWaalsContact CE1-CB 3.43Å; F441-S583 VanDerWaalsContact CZ-CB 3.48Å; F441-F894 WeakPolarHBondContact O-CE2 3.42Å; F441-N896 PolarHBondContact O-ND2 2.74Å
442	N	55.6	Low	56.5	Low	56 Å²	56	55.9 Å²	55.9	30%	0.299	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.3	166.1	-163.3	8.3	0	0	0	110.5	M449 I451	N442-M449 PolarHBondContact N-O 3.49Å; N442-M449 PolarHBondContact O-N 3.15Å; N442-I451 HydrophobicContact CB-CD1 3.22Å; N442-I451 HydrophobicContact CB-CG1 3.81Å
443	R	47.4	Very low	56.8	Low	138 Å²	138	54.8 Å²	54.8	52%	0.521	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	115.1	171.1	-109.4	-175.4	-178.7	174	-1.3	107.9	Y898	R443-Y898 HydrophobicContact CB-CE1 4.28Å; R443-Y898 WeakPolarHBondContact CB-OH 3.22Å; R443-Y898 HydrophobicContact CG-CE1 4.1Å; R443-Y898 HydrophobicContact CG-CE2 4.15Å; R443-Y898 WeakPolarHBondContact CG-OH 3.41Å; R443-Y898 PolarHBondContact N-OH 3.43Å
444	V	45.6	Very low	57	Low	48 Å²	48	57.9 Å²	57.9	29%	0.291	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	104.4	164.2	-175.8	0	0	0	0	106.7	K446 I447 L489	V444-K446 PolarHBondContact O-N 3.07Å; V444-I447 PolarHBondContact N-O 3.08Å; V444-I447 PolarHBondContact O-N 3.07Å; V444-I447 VanDerWaalsContact O-O 3.12Å; V444-L489 HydrophobicContact CG1-CD1 4.45Å
445	K	54.1	Low	56.5	Low	171 Å²	171	62.7 Å²	62.7	74%	0.743	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	-122.7	-172.2	-52.6	178.9	178.6	-175.9	0	111.2
446	K	49	Very low	56.2	Low	198 Å²	198	67.5 Å²	67.5	86%	0.861	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.6	177.1	-67	-175.5	178.8	178.4	0	113.4	V444	V444-K446 PolarHBondContact O-N 3.07Å
447	I	44.9	Very low	55.5	Low	107 Å²	107	70 Å²	70	55%	0.549	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.4	-173.1	-49.6	175	0	0	0	109.5	V444 M449	V444-I447 PolarHBondContact N-O 3.08Å; V444-I447 PolarHBondContact O-N 3.07Å; V444-I447 VanDerWaalsContact O-O 3.12Å; I447-M449 HydrophobicContact CG2-CE 3.8Å
448	R	49.6	Very low	54.8	Low	65 Å²	65	72 Å²	72	25%	0.245	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.9	174.3	-179.3	179.1	176.7	-158.1	-7	108.2	F441 S584 G660	F441-R448 HydrophobicContact CB-CG 4.32Å; F441-R448 HydrophobicContact CD1-CG 3.87Å; F441-R448 VanDerWaalsContact CD2-NH2 3.25Å; F441-R448 HydrophobicContact CG-CG 4.38Å; R448-S584 PolarHBondContact NH1-O 2.95Å; R448-G660 PolarHBondContact NH2-O 3.14Å; R448-G660 VanDerWaalsContact NH2-O 3.15Å
449	M	55.9	Low	54.2	Low	75 Å²	75	69.6 Å²	69.6	37%	0.369	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.7	178.5	-73.9	-71.5	175.4	0	0	110	N442 I447	N442-M449 PolarHBondContact N-O 3.49Å; N442-M449 PolarHBondContact O-N 3.15Å; I447-M449 HydrophobicContact CG2-CE 3.8Å
450	P	58.1	Low	53.3	Low	24 Å²	24	73 Å²	73	16%	0.156	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	141	171.1	34.8	-36.2	0	0	0	109	G440 F441 Y562	G440-P450 WeakPolarHBondContact O-CA 3.49Å; F441-P450 HydrophobicContact CE1-CB 4.43Å; P450-Y562 WeakPolarHBondContact CB-OH 3.4Å
451	I	58.5	Low	52.1	Low	21 Å²	21	75.9 Å²	75.9	11%	0.108	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.2	-177.3	-63.5	-158.5	0	0	0	110	V439 G440 N442 K453 Y562	V439-I451 WeakPolarHBondContact CA-O 3.11Å; G440-I451 PolarHBondContact N-O 3.2Å; G440-I451 PolarHBondContact O-N 2.97Å; N442-I451 HydrophobicContact CB-CD1 3.22Å; N442-I451 HydrophobicContact CB-CG1 3.81Å; I451-K453 HydrophobicContact CG2-CD 3.97Å; I451-K453 HydrophobicContact CG2-CG 3.68Å; I451-Y562 PolarHBondContact N-OH 3.12Å
452	M	60.5	Low	50.9	Low	14 Å²	14	78.4 Å²	78.4	7%	0.069	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.8	164.5	-179.7	179.7	84.1	0	0	109.2	F437 K438 V439 Y562 L568	F437-M452 HydrophobicContact CD1-CG 4.03Å; F437-M452 HydrophobicContact CD1-SD 4.21Å; F437-M452 HydrophobicContact CE1-CE 4.38Å; K438-M452 WeakPolarHBondContact O-CA 3.31Å; V439-M452 HydrophobicContact CG2-CB 4.49Å; V439-M452 HydrophobicContact CG2-CG 4.11Å; M452-Y562 HydrophobicContact CB-CD1 4.45Å; M452-Y562 HydrophobicContact CB-CD2 4.26Å; M452-Y562 HydrophobicContact CB-CE1 4.3Å; M452-Y562 HydrophobicContact CB-CE2 4.12Å; M452-Y562 HydrophobicContact CB-CG 4.4Å; M452-Y562 HydrophobicContact SD-CD2 4.23Å; M452-Y562 HydrophobicContact SD-CG 4.24Å; M452-L568 HydrophobicContact SD-CD1 3.96Å
453	K	57.3	Low	49.7	Very low	71 Å²	71	82.1 Å²	82.1	31%	0.309	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.8	177.7	-77.7	175.9	177	-175.4	0	111	F437 K438 I451 Y455	F437-K453 CarbonylContact C-O 3.55Å; F437-K453 WeakPolarHBondContact CA-O 3.46Å; K438-K453 PolarHBondContact N-O 3.37Å; K438-K453 PolarHBondContact O-N 2.73Å; I451-K453 HydrophobicContact CG2-CD 3.97Å; I451-K453 HydrophobicContact CG2-CG 3.68Å; K453-Y455 HydrophobicContact CB-CD2 4.09Å; K453-Y455 HydrophobicContact CB-CE2 4.25Å; K453-Y455 HydrophobicContact CD-CE2 4.34Å; K453-Y455 PolarHBondContact O-N 3.47Å
454	L	58.1	Low	48.8	Very low	70 Å²	70	80 Å²	80	37%	0.366	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	113	164.6	-180	64.9	0	0	0	108.2	L435 F437 I457	L435-L454 HydrophobicContact CB-CD1 4.21Å; L435-L454 HydrophobicContact CD2-CD1 4.22Å; F437-L454 HydrophobicContact CD1-CB 4.15Å; F437-L454 HydrophobicContact CD1-CD1 4.28Å; F437-L454 HydrophobicContact CD2-CD1 4.24Å; F437-L454 HydrophobicContact CE1-CB 3.86Å; F437-L454 HydrophobicContact CE1-CD1 3.96Å; F437-L454 HydrophobicContact CE1-CG 4.42Å; F437-L454 HydrophobicContact CE2-CD1 3.91Å; F437-L454 HydrophobicContact CG-CD1 4.43Å; F437-L454 HydrophobicContact CZ-CB 4.45Å; F437-L454 HydrophobicContact CZ-CD1 3.77Å; L454-I457 HydrophobicContact CD1-CG1 4.46Å; L454-I457 HydrophobicContact CD2-CD1 3.96Å; L454-I457 HydrophobicContact CD2-CG1 4.01Å; L454-I457 HydrophobicContact CG-CG1 4.41Å
455	Y	49.6	Very low	47.9	Very low	133 Å²	133	80.9 Å²	80.9	52%	0.522	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-38.1	-175.3	-113.3	-93	0	0	0	112.7	L436 K438 K453	L436-Y455 PolarHBondContact O-N 3.49Å; K438-Y455 HydrophobicContact CB-CD2 3.81Å; K438-Y455 HydrophobicContact CB-CE2 4.13Å; K438-Y455 HydrophobicContact CD-CD2 3.7Å; K438-Y455 HydrophobicContact CD-CE2 3.7Å; K438-Y455 HydrophobicContact CD-CG 4.21Å; K438-Y455 HydrophobicContact CG-CD2 3.53Å; K438-Y455 HydrophobicContact CG-CE2 4Å; K438-Y455 HydrophobicContact CG-CG 4.08Å; K453-Y455 HydrophobicContact CB-CD2 4.09Å; K453-Y455 HydrophobicContact CB-CE2 4.25Å; K453-Y455 HydrophobicContact CD-CE2 4.34Å; K453-Y455 PolarHBondContact O-N 3.47Å
456	Q	55	Low	46.7	Very low	104 Å²	104	77.6 Å²	77.6	49%	0.486	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	137.5	-172	-167.2	171.5	-4.5	0	0	111.2	L436 T458	L436-Q456 HydrophobicContact CB-CB 4.03Å; L436-Q456 HydrophobicContact CD2-CB 4.29Å; L436-Q456 PolarHBondContact N-O 3.38Å; Q456-T458 HydrophobicContact CG-CG2 3.95Å
457	I	46.3	Very low	45.8	Very low	86 Å²	86	71.9 Å²	71.9	44%	0.441	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.3	166.5	-52	179.7	0	0	0	105.9	I433 T434 L435 L454	I433-I457 HydrophobicContact CG2-CG2 3.98Å; T434-I457 WeakPolarHBondContact O-CA 3.19Å; L435-I457 HydrophobicContact CD2-CB 4.18Å; L435-I457 HydrophobicContact CD2-CD1 4.29Å; L435-I457 HydrophobicContact CD2-CG1 3.73Å; L435-I457 HydrophobicContact CD2-CG2 3.88Å; L454-I457 HydrophobicContact CD1-CG1 4.46Å; L454-I457 HydrophobicContact CD2-CD1 3.96Å; L454-I457 HydrophobicContact CD2-CG1 4.01Å; L454-I457 HydrophobicContact CG-CG1 4.41Å
458	T	51.1	Low	45	Very low	53 Å²	53	71 Å²	71	33%	0.325	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.2	176	32.8	0	0	0	0	110.5	T434 Q456	T434-T458 WeakPolarHBondContact CB-OG1 3.43Å; T434-T458 PolarHBondContact N-O 2.84Å; T434-T458 PolarHBondContact O-N 3.43Å; Q456-T458 HydrophobicContact CG-CG2 3.95Å
459	S	49.8	Very low	43.9	Very low	20 Å²	20	71.7 Å²	71.7	14%	0.14	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	132.8	161.9	92.4	0	0	0	0	108.2	K432 T461 S462	K432-S459 WeakPolarHBondContact O-CA 3.29Å; S459-T461 PolarHBondContact O-N 2.96Å; S459-S462 PolarHBondContact O-OG 2.97Å; S459-S462 WeakPolarHBondContact OG-CB 3.18Å; S459-S462 PolarHBondContact OG-N 2.98Å; S459-S462 PolarHBondContact OG-OG 3.27Å; S459-S462 VanDerWaalsContact OG-OG 3.08Å
460	A	47.1	Very low	42.7	Very low	71 Å²	71	75.7 Å²	75.7	59%	0.587	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.3	179.3	0	0	0	0	0	113.1	K432	K432-A460 HydrophobicContact CB-CB 3.83Å; K432-A460 PolarHBondContact O-N 3.33Å
461	T	41.4	Very low	41.4	Very low	61 Å²	61	82 Å²	82	37%	0.374	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-8.5	-173.2	48.2	0	0	0	0	114.2	D430 N431 S459 V463	D430-T461 WeakPolarHBondContact O-CG2 3.28Å; N431-T461 PolarHBondContact OD1-OG1 2.88Å; S459-T461 PolarHBondContact O-N 2.96Å; T461-V463 PolarHBondContact O-N 3.21Å
462	S	34.5	Very low	40	Very low	60 Å²	60	88.5 Å²	88.5	42%	0.42	49%	0.486	S	S	.	.			trans	-91.6	98.8	176.3	62.1	0	0	0	0	111.4	S459 P464	S459-S462 PolarHBondContact O-OG 2.97Å; S459-S462 WeakPolarHBondContact OG-CB 3.18Å; S459-S462 PolarHBondContact OG-N 2.98Å; S459-S462 PolarHBondContact OG-OG 3.27Å; S459-S462 VanDerWaalsContact OG-OG 3.08Å; S462-P464 WeakPolarHBondContact O-CD 3.47Å
463	V	30.7	Very low	38.5	Very low	134 Å²	134	93.9 Å²	93.9	81%	0.812	51%	0.509	S	S	*	.			trans	-56.2	122.7	163.8	178.1	0	0	0	0	107.9	T461 S465	T461-V463 PolarHBondContact O-N 3.21Å; V463-S465 PolarHBondContact O-N 3.32Å
464	P	27.3	Very low	37.4	Very low	95 Å²	95	97.6 Å²	97.6	62%	0.617	53%	0.525	S	S	*	.			trans	-74.4	95.2	-172	27.5	-32	0	0	0	110.2	S462 S466 I469	S462-P464 WeakPolarHBondContact O-CD 3.47Å; P464-S466 PolarHBondContact O-N 3.21Å; P464-S466 VanDerWaalsContact O-N 3.09Å; P464-I469 HydrophobicContact CB-CD1 3.65Å
465	S	27.6	Very low	36.3	Very low	66 Å²	66	99.3 Å²	99.3	46%	0.462	54%	0.535	S	S	.	.			trans	-64.7	110.6	167.2	62.7	0	0	0	0	108.6	V463 A467 L468	V463-S465 PolarHBondContact O-N 3.32Å; S465-A467 PolarHBondContact O-N 2.93Å; S465-L468 PolarHBondContact O-N 3.22Å
466	S	28.5	Very low	35.5	Very low	101 Å²	101	98 Å²	98	71%	0.706	54%	0.536	S	S	*	.	H	α-helix	trans	-54.8	-27.1	-172.2	61.6	0	0	0	0	114.4	P464	P464-S466 PolarHBondContact O-N 3.21Å; P464-S466 VanDerWaalsContact O-N 3.09Å
467	A	30.7	Very low	34.5	Very low	79 Å²	79	97.9 Å²	97.9	65%	0.653	53%	0.534	S	S	*	.	H	α-helix	trans	-75.9	-40.3	-176.7	0	0	0	0	0	114.1	S465	S465-A467 PolarHBondContact O-N 2.93Å
468	L	27.6	Very low	34	Very low	88 Å²	88	97.4 Å²	97.4	46%	0.461	53%	0.532	S	S	.	.	H	α-helix	trans	-76.5	-30.7	-178	-87.1	163.6	0	0	0	112.5	S465 Y472	S465-L468 PolarHBondContact O-N 3.22Å; L468-Y472 HydrophobicContact CD2-CD2 4.05Å; L468-Y472 HydrophobicContact CD2-CE2 3.85Å; L468-Y472 PolarHBondContact O-N 2.85Å
469	I	27.1	Very low	33.2	Very low	80 Å²	80	102 Å²	102	41%	0.41	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-41.4	175.7	-64.2	176.6	0	0	0	109.9	P464 F471 K473	P464-I469 HydrophobicContact CB-CD1 3.65Å; I469-F471 VanDerWaalsContact C-N 3.35Å; I469-F471 PolarHBondContact O-N 2.94Å; I469-K473 HydrophobicContact CG2-CB 4.05Å; I469-K473 HydrophobicContact CG2-CD 3.88Å; I469-K473 WeakPolarHBondContact O-CA 3.37Å; I469-K473 WeakPolarHBondContact O-CB 3.19Å; I469-K473 PolarHBondContact O-N 3.11Å
470	Q	30.6	Very low	32.3	Very low	158 Å²	158	104.8 Å²	104.8	74%	0.738	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-38.3	-179.2	-79.5	-163.3	-8.2	0	0	113.5	K474	Q470-K474 VanDerWaalsContact O-CB 3.3Å; Q470-K474 WeakPolarHBondContact O-CB 3.36Å; Q470-K474 PolarHBondContact O-N 3.19Å
471	F	30.4	Very low	31.6	Very low	158 Å²	158	106.1 Å²	106.1	69%	0.693	55%	0.554	S	S	*	*	H	α-helix	trans	-73.8	-47.3	-177.3	-149.2	-88.3	0	0	0	112.1	I469 D475	I469-F471 VanDerWaalsContact C-N 3.35Å; I469-F471 PolarHBondContact O-N 2.94Å; F471-D475 PolarHBondContact O-N 3.27Å
472	Y	28.5	Very low	31.1	Very low	157 Å²	157	109.4 Å²	109.4	62%	0.616	57%	0.565	S	S	*	*	H	α-helix	trans	-80.4	-29.9	179.9	-76	-77.8	0	0	0	113.6	L468 K474 L476	L468-Y472 HydrophobicContact CD2-CD2 4.05Å; L468-Y472 HydrophobicContact CD2-CE2 3.85Å; L468-Y472 PolarHBondContact O-N 2.85Å; Y472-K474 VanDerWaalsContact C-N 3.34Å; Y472-L476 WeakPolarHBondContact O-CB 3.15Å; Y472-L476 PolarHBondContact O-N 2.88Å
473	K	29.1	Very low	30.9	Very low	127 Å²	127	111.7 Å²	111.7	55%	0.552	57%	0.573	S	S	*	*	I	π-helix	trans	-63.7	-43.6	171.9	-166.8	178.2	-174.3	-178.5	0	109.3	I469 D475 F477	I469-K473 HydrophobicContact CG2-CB 4.05Å; I469-K473 HydrophobicContact CG2-CD 3.88Å; I469-K473 WeakPolarHBondContact O-CA 3.37Å; I469-K473 WeakPolarHBondContact O-CB 3.19Å; I469-K473 PolarHBondContact O-N 3.11Å; K473-D475 PolarHBondContact O-N 3.15Å; K473-F477 HydrophobicContact CG-CD2 3.95Å; K473-F477 HydrophobicContact CG-CG 4.45Å; K473-F477 WeakPolarHBondContact O-CA 3.47Å; K473-F477 WeakPolarHBondContact O-CB 3.39Å; K473-F477 PolarHBondContact O-N 2.93Å
474	K	34.3	Very low	30.9	Very low	148 Å²	148	109.4 Å²	109.4	64%	0.643	56%	0.556	S	S	*	*	I	π-helix	trans	-65.2	-45.5	-178.7	-154.4	172.3	-172.5	179.1	0	111.9	Q470 Y472 N478	Q470-K474 VanDerWaalsContact O-CB 3.3Å; Q470-K474 WeakPolarHBondContact O-CB 3.36Å; Q470-K474 PolarHBondContact O-N 3.19Å; Y472-K474 VanDerWaalsContact C-N 3.34Å; K474-N478 WeakPolarHBondContact O-CB 3.13Å; K474-N478 PolarHBondContact O-N 3.46Å; K474-N478 PolarHBondContact O-ND2 2.9Å; K474-N478 PolarHBondContact O-OD1 2.8Å
475	D	35.8	Very low	30.9	Very low	107 Å²	107	109.9 Å²	109.9	57%	0.572	55%	0.551	S	S	*	*	I	π-helix	trans	-82	-42.5	-175.6	-109.5	21.6	0	0	0	114.1	F471 K473 K479	F471-D475 PolarHBondContact O-N 3.27Å; K473-D475 PolarHBondContact O-N 3.15Å; D475-K479 WeakPolarHBondContact O-CB 3.18Å; D475-K479 PolarHBondContact O-N 3.13Å; D475-K479 VanDerWaalsContact O-N 3.15Å
476	L	33.1	Very low	31	Very low	105 Å²	105	113.2 Å²	113.2	55%	0.55	56%	0.563	S	S	.	*	I	π-helix	trans	-76.2	-43.8	-179	-157.8	87	0	0	0	110.8	Y472 K479 I480	Y472-L476 WeakPolarHBondContact O-CB 3.15Å; Y472-L476 PolarHBondContact O-N 2.88Å; L476-K479 PolarHBondContact O-N 3.26Å; L476-I480 HydrophobicContact CD2-CD1 3.97Å; L476-I480 HydrophobicContact CG-CD1 3.87Å; L476-I480 WeakPolarHBondContact O-CB 2.96Å; L476-I480 WeakPolarHBondContact O-CG1 3.34Å; L476-I480 PolarHBondContact O-N 2.95Å
477	F	33	Very low	31	Very low	102 Å²	102	110.9 Å²	110.9	45%	0.447	54%	0.543	S	S	.	.	I	π-helix	trans	-71.9	-35.7	173.5	-84.9	-98	0	0	0	112	K473 K479 I480 E481	K473-F477 HydrophobicContact CG-CD2 3.95Å; K473-F477 HydrophobicContact CG-CG 4.45Å; K473-F477 WeakPolarHBondContact O-CA 3.47Å; K473-F477 WeakPolarHBondContact O-CB 3.39Å; K473-F477 PolarHBondContact O-N 2.93Å; F477-K479 VanDerWaalsContact C-N 3.25Å; F477-K479 PolarHBondContact O-N 2.82Å; F477-I480 PolarHBondContact O-N 2.99Å; F477-E481 WeakPolarHBondContact O-CA 3.22Å; F477-E481 WeakPolarHBondContact O-CB 2.94Å; F477-E481 PolarHBondContact O-N 2.99Å
478	N	35.6	Very low	30.8	Very low	75 Å²	75	112 Å²	112	40%	0.401	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-33.9	175.4	-71.1	-13.3	0	0	0	111.7	K474 H482	K474-N478 WeakPolarHBondContact O-CB 3.13Å; K474-N478 PolarHBondContact O-N 3.46Å; K474-N478 PolarHBondContact O-ND2 2.9Å; K474-N478 PolarHBondContact O-OD1 2.8Å; N478-H482 WeakPolarHBondContact O-CB 3.4Å; N478-H482 PolarHBondContact O-N 3.3Å
479	K	33.6	Very low	30.7	Very low	151 Å²	151	114.3 Å²	114.3	66%	0.657	55%	0.549	S	S	*	.	H	α-helix	trans	-67.5	-49.1	172.1	-92.5	177.3	175.8	168.1	0	112	D475 L476 F477 D483	D475-K479 WeakPolarHBondContact O-CB 3.18Å; D475-K479 PolarHBondContact O-N 3.13Å; D475-K479 VanDerWaalsContact O-N 3.15Å; L476-K479 PolarHBondContact O-N 3.26Å; F477-K479 VanDerWaalsContact C-N 3.25Å; F477-K479 PolarHBondContact O-N 2.82Å; K479-D483 VanDerWaalsContact O-CB 3.26Å; K479-D483 WeakPolarHBondContact O-CB 3.35Å; K479-D483 VanDerWaalsContact O-CG 3.32Å; K479-D483 PolarHBondContact O-N 2.9Å
480	I	32.4	Very low	30.7	Very low	77 Å²	77	113.3 Å²	113.3	40%	0.395	54%	0.544	S	S	.	.	H	α-helix	trans	-66.2	-45.2	-178.9	-68.1	167.2	0	0	0	110.3	L476 F477 D483 L484	L476-I480 HydrophobicContact CD2-CD1 3.97Å; L476-I480 HydrophobicContact CG-CD1 3.87Å; L476-I480 WeakPolarHBondContact O-CB 2.96Å; L476-I480 WeakPolarHBondContact O-CG1 3.34Å; L476-I480 PolarHBondContact O-N 2.95Å; F477-I480 PolarHBondContact O-N 2.99Å; I480-D483 CarbonylContact O-C 3.51Å; I480-D483 PolarHBondContact O-N 3.02Å; I480-L484 HydrophobicContact CG2-CD1 4.35Å; I480-L484 WeakPolarHBondContact O-CA 3.32Å; I480-L484 WeakPolarHBondContact O-CB 3.5Å; I480-L484 PolarHBondContact O-N 3.1Å
481	E	31	Very low	30.5	Very low	99 Å²	99	107 Å²	107	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-70.7	-38.2	-179	-165.5	174.7	-153.9	0	0	111.6	F477 L484 M485	F477-E481 WeakPolarHBondContact O-CA 3.22Å; F477-E481 WeakPolarHBondContact O-CB 2.94Å; F477-E481 PolarHBondContact O-N 2.99Å; E481-L484 PolarHBondContact O-N 2.71Å; E481-M485 HydrophobicContact CG-CG 3.85Å; E481-M485 WeakPolarHBondContact O-CA 3.34Å; E481-M485 WeakPolarHBondContact O-CB 3.39Å; E481-M485 WeakPolarHBondContact O-CG 3.34Å; E481-M485 PolarHBondContact O-N 2.98Å
482	H	31.9	Very low	30.3	Very low	131 Å²	131	101.1 Å²	101.1	61%	0.606	50%	0.495	S	S	*	.	H	α-helix	trans	-63.5	-44.1	167.3	-89	-21.3	0	0	0	111.4	N478 L484 D486	N478-H482 WeakPolarHBondContact O-CB 3.4Å; N478-H482 PolarHBondContact O-N 3.3Å; H482-L484 VanDerWaalsContact C-N 3.26Å; H482-L484 PolarHBondContact O-N 3.03Å; H482-D486 WeakPolarHBondContact O-CB 3.35Å; H482-D486 PolarHBondContact O-N 3.44Å
483	D	30.7	Very low	30.2	Very low	108 Å²	108	98.2 Å²	98.2	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-67.9	-25	176.3	-75.3	-16.8	0	0	0	112.5	K479 I480 N487	K479-D483 VanDerWaalsContact O-CB 3.26Å; K479-D483 WeakPolarHBondContact O-CB 3.35Å; K479-D483 VanDerWaalsContact O-CG 3.32Å; K479-D483 PolarHBondContact O-N 2.9Å; I480-D483 CarbonylContact O-C 3.51Å; I480-D483 PolarHBondContact O-N 3.02Å; D483-N487 WeakPolarHBondContact O-CB 2.86Å; D483-N487 PolarHBondContact O-ND2 2.82Å
484	L	29.3	Very low	30	Very low	86 Å²	86	93.1 Å²	93.1	45%	0.45	47%	0.469	S	S	.	.	H	α-helix	trans	-85	-41.7	178.7	-136.9	86.3	0	0	0	111.6	I480 E481 H482 N487 I488	I480-L484 HydrophobicContact CG2-CD1 4.35Å; I480-L484 WeakPolarHBondContact O-CA 3.32Å; I480-L484 WeakPolarHBondContact O-CB 3.5Å; I480-L484 PolarHBondContact O-N 3.1Å; E481-L484 PolarHBondContact O-N 2.71Å; H482-L484 VanDerWaalsContact C-N 3.26Å; H482-L484 PolarHBondContact O-N 3.03Å; L484-N487 CarbonylContact O-C 3.59Å; L484-N487 VanDerWaalsContact O-C 3.28Å; L484-N487 PolarHBondContact O-N 3.29Å; L484-I488 PolarHBondContact O-N 2.9Å
485	M	29.1	Very low	29.7	Very low	104 Å²	104	88.1 Å²	88.1	51%	0.512	45%	0.449	S	S	.	.	H	α-helix	trans	-77.7	-35.6	-175.8	-69.2	-69.9	-87	0	0	111.5	E481 N487 I488	E481-M485 HydrophobicContact CG-CG 3.85Å; E481-M485 WeakPolarHBondContact O-CA 3.34Å; E481-M485 WeakPolarHBondContact O-CB 3.39Å; E481-M485 WeakPolarHBondContact O-CG 3.34Å; E481-M485 PolarHBondContact O-N 2.98Å; M485-N487 PolarHBondContact O-N 3.4Å; M485-N487 VanDerWaalsContact O-N 3.12Å; M485-I488 VanDerWaalsContact O-CD1 3.29Å; M485-I488 WeakPolarHBondContact O-CD1 3.24Å; M485-I488 VanDerWaalsContact O-CG1 3.22Å; M485-I488 WeakPolarHBondContact O-CG1 3.35Å; M485-I488 PolarHBondContact O-N 3.43Å; M485-I488 HydrophobicContact SD-CD1 4.42Å
486	D	28.8	Very low	29.4	Very low	136 Å²	136	86.7 Å²	86.7	73%	0.727	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.1	171.1	-77.3	-11.9	0	0	0	112	H482	H482-D486 WeakPolarHBondContact O-CB 3.35Å; H482-D486 PolarHBondContact O-N 3.44Å
487	N	27.8	Very low	29.4	Very low	53 Å²	53	83.7 Å²	83.7	28%	0.283	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	36.5	-179	-75.1	-46.8	0	0	0	112.7	D483 L484 M485 L489 L490 S491	D483-N487 WeakPolarHBondContact O-CB 2.86Å; D483-N487 PolarHBondContact O-ND2 2.82Å; L484-N487 CarbonylContact O-C 3.59Å; L484-N487 VanDerWaalsContact O-C 3.28Å; L484-N487 PolarHBondContact O-N 3.29Å; M485-N487 PolarHBondContact O-N 3.4Å; M485-N487 VanDerWaalsContact O-N 3.12Å; N487-L489 PolarHBondContact O-N 2.95Å; N487-L490 HydrophobicContact CB-CB 3.72Å; N487-L490 HydrophobicContact CB-CD2 4.29Å; N487-L490 WeakPolarHBondContact O-CA 3.47Å; N487-L490 WeakPolarHBondContact O-CB 3.47Å; N487-L490 PolarHBondContact O-N 3.16Å; N487-S491 PolarHBondContact O-N 3.02Å
488	I	27	Very low	29.3	Very low	102 Å²	102	82.8 Å²	82.8	52%	0.523	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-26.5	174	-77.4	160.7	0	0	0	112.8	L484 M485	L484-I488 PolarHBondContact O-N 2.9Å; M485-I488 VanDerWaalsContact O-CD1 3.29Å; M485-I488 WeakPolarHBondContact O-CD1 3.24Å; M485-I488 VanDerWaalsContact O-CG1 3.22Å; M485-I488 WeakPolarHBondContact O-CG1 3.35Å; M485-I488 PolarHBondContact O-N 3.43Å; M485-I488 HydrophobicContact SD-CD1 4.42Å
489	L	26.5	Very low	29.2	Very low	137 Å²	137	83.1 Å²	83.1	72%	0.717	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-14.3	174.1	-149.2	80.5	0	0	0	113.6	V444 N487	V444-L489 HydrophobicContact CG1-CD1 4.45Å; N487-L489 PolarHBondContact O-N 2.95Å
490	L	25.9	Very low	29.3	Very low	59 Å²	59	82.5 Å²	82.5	31%	0.309	43%	0.429	S	S	.	.			trans	-104.6	2.8	-172.3	-146.1	69.1	0	0	0	113.1	N487 T492 I493 T494	N487-L490 HydrophobicContact CB-CB 3.72Å; N487-L490 HydrophobicContact CB-CD2 4.29Å; N487-L490 WeakPolarHBondContact O-CA 3.47Å; N487-L490 WeakPolarHBondContact O-CB 3.47Å; N487-L490 PolarHBondContact O-N 3.16Å; L490-T492 PolarHBondContact O-N 2.87Å; L490-I493 HydrophobicContact CD1-CB 3.94Å; L490-I493 HydrophobicContact CD1-CD1 3.66Å; L490-I493 HydrophobicContact CD1-CG1 4.36Å; L490-I493 HydrophobicContact CD1-CG2 4.1Å; L490-I493 HydrophobicContact CG-CB 3.88Å; L490-I493 HydrophobicContact CG-CG2 4.07Å; L490-I493 CarbonylContact O-C 3.15Å; L490-I493 WeakPolarHBondContact O-CA 3.47Å; L490-I493 PolarHBondContact O-N 3.37Å; L490-T494 HydrophobicContact CB-CG2 4.46Å; L490-T494 WeakPolarHBondContact O-CG2 3.37Å; L490-T494 PolarHBondContact O-N 2.83Å; L490-T494 PolarHBondContact O-OG1 3.43Å
491	S	27.1	Very low	29.5	Very low	25 Å²	25	86.9 Å²	86.9	18%	0.175	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.8	-175.2	87.3	0	0	0	0	113.9	N487 T494	N487-S491 PolarHBondContact O-N 3.02Å; S491-T494 VanDerWaalsContact C-OG1 3.29Å; S491-T494 VanDerWaalsContact CA-OG1 3.22Å; S491-T494 WeakPolarHBondContact CA-OG1 3.23Å; S491-T494 PolarHBondContact O-OG1 3.33Å
492	T	25.9	Very low	29.7	Very low	34 Å²	34	86.1 Å²	86.1	21%	0.209	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-24.2	173.1	46.2	0	0	0	0	113.5	Y363 C364 Q367 L490	Y363-T492 WeakPolarHBondContact O-CB 3.46Å; Y363-T492 WeakPolarHBondContact O-CG2 3.36Å; Y363-T492 PolarHBondContact O-OG1 3.03Å; C364-T492 WeakPolarHBondContact SG-CG2 3.29Å; Q367-T492 PolarHBondContact NE2-O 3.32Å; L490-T492 PolarHBondContact O-N 2.87Å
493	I	26.6	Very low	30	Very low	96 Å²	96	86.2 Å²	86.2	49%	0.492	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-22.6	172.9	-70.2	165.4	0	0	0	111	L490 N495 L496 S497	L490-I493 HydrophobicContact CD1-CB 3.94Å; L490-I493 HydrophobicContact CD1-CD1 3.66Å; L490-I493 HydrophobicContact CD1-CG1 4.36Å; L490-I493 HydrophobicContact CD1-CG2 4.1Å; L490-I493 HydrophobicContact CG-CB 3.88Å; L490-I493 HydrophobicContact CG-CG2 4.07Å; L490-I493 CarbonylContact O-C 3.15Å; L490-I493 WeakPolarHBondContact O-CA 3.47Å; L490-I493 PolarHBondContact O-N 3.37Å; I493-N495 PolarHBondContact O-N 3.28Å; I493-L496 PolarHBondContact O-N 2.88Å; I493-S497 PolarHBondContact O-N 2.86Å
494	T	25.7	Very low	30.4	Very low	21 Å²	21	82.8 Å²	82.8	13%	0.129	43%	0.425	C	S	.	.	H	α-helix	trans	-64.5	-30.9	-171.9	42.2	0	0	0	0	114.3	L490 S491 L496 S497 I498	L490-T494 HydrophobicContact CB-CG2 4.46Å; L490-T494 WeakPolarHBondContact O-CG2 3.37Å; L490-T494 PolarHBondContact O-N 2.83Å; L490-T494 PolarHBondContact O-OG1 3.43Å; S491-T494 VanDerWaalsContact C-OG1 3.29Å; S491-T494 VanDerWaalsContact CA-OG1 3.22Å; S491-T494 WeakPolarHBondContact CA-OG1 3.23Å; S491-T494 PolarHBondContact O-OG1 3.33Å; T494-L496 PolarHBondContact O-N 3.23Å; T494-S497 WeakPolarHBondContact CA-OG 3.42Å; T494-S497 CarbonylContact O-C 3.59Å; T494-S497 WeakPolarHBondContact O-CA 3.25Å; T494-S497 WeakPolarHBondContact O-CB 3.4Å; T494-S497 PolarHBondContact O-N 2.87Å; T494-S497 VanDerWaalsContact O-N 3.12Å; T494-S497 PolarHBondContact O-OG 3.08Å; T494-I498 WeakPolarHBondContact O-CG1 3.38Å; T494-I498 PolarHBondContact O-N 3.3Å
495	N	28	Very low	30.8	Very low	43 Å²	43	81.9 Å²	81.9	23%	0.23	42%	0.419	C	S	.	.	H	α-helix	trans	-71.9	-32.6	-177.8	-69.9	-14.5	0	0	0	113.2	Q367 I493 S497 I498	Q367-N495 PolarHBondContact OE1-ND2 2.94Å; I493-N495 PolarHBondContact O-N 3.28Å; N495-S497 VanDerWaalsContact C-N 3.3Å; N495-I498 PolarHBondContact O-N 3.05Å
496	L	28.7	Very low	31.3	Very low	77 Å²	77	77.6 Å²	77.6	40%	0.403	40%	0.4	S	S	.	.	H	α-helix	trans	-72.1	-30.6	170.2	-127.9	106.6	0	0	0	111.6	I493 T494 I498 K500	I493-L496 PolarHBondContact O-N 2.88Å; T494-L496 PolarHBondContact O-N 3.23Å; L496-I498 VanDerWaalsContact C-N 3.29Å; L496-I498 PolarHBondContact O-N 2.94Å; L496-K500 PolarHBondContact O-N 3.34Å
497	S	33.1	Very low	32.2	Very low	41 Å²	41	74.2 Å²	74.2	29%	0.287	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-31.3	174.8	86.9	0	0	0	0	111.8	I493 T494 N495 R501	I493-S497 PolarHBondContact O-N 2.86Å; T494-S497 WeakPolarHBondContact CA-OG 3.42Å; T494-S497 CarbonylContact O-C 3.59Å; T494-S497 WeakPolarHBondContact O-CA 3.25Å; T494-S497 WeakPolarHBondContact O-CB 3.4Å; T494-S497 PolarHBondContact O-N 2.87Å; T494-S497 VanDerWaalsContact O-N 3.12Å; T494-S497 PolarHBondContact O-OG 3.08Å; N495-S497 VanDerWaalsContact C-N 3.3Å; S497-R501 WeakPolarHBondContact O-CA 3.35Å; S497-R501 WeakPolarHBondContact O-CB 3.39Å; S497-R501 PolarHBondContact O-N 3.22Å
498	I	30.9	Very low	32.8	Very low	84 Å²	84	76.8 Å²	76.8	43%	0.431	40%	0.396	S	S	.	.	H	α-helix	trans	-62.1	-49.3	179.3	-69.2	166	0	0	0	110.4	T494 N495 L496 R501 I502	T494-I498 WeakPolarHBondContact O-CG1 3.38Å; T494-I498 PolarHBondContact O-N 3.3Å; N495-I498 PolarHBondContact O-N 3.05Å; L496-I498 VanDerWaalsContact C-N 3.29Å; L496-I498 PolarHBondContact O-N 2.94Å; I498-R501 PolarHBondContact O-N 2.95Å; I498-I502 HydrophobicContact CG2-CD1 3.54Å; I498-I502 HydrophobicContact CG2-CG1 4.22Å; I498-I502 WeakPolarHBondContact O-CB 3.48Å; I498-I502 WeakPolarHBondContact O-CG1 3.48Å; I498-I502 PolarHBondContact O-N 2.87Å
499	T	32.7	Very low	33.4	Very low	82 Å²	82	72.7 Å²	72.7	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-64.1	-47.7	-179.1	-26.1	0	0	0	0	111.3	R501 I502 E503	T499-R501 VanDerWaalsContact C-N 3.29Å; T499-R501 PolarHBondContact O-N 2.97Å; T499-I502 PolarHBondContact O-N 2.96Å; T499-E503 WeakPolarHBondContact O-CG 3.22Å; T499-E503 PolarHBondContact O-N 3.13Å
500	K	36.8	Very low	34.3	Very low	137 Å²	137	69.3 Å²	69.3	60%	0.596	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-32.2	175.2	-76.6	-173.4	176.6	177.8	0	112.6	L496 S504	L496-K500 PolarHBondContact O-N 3.34Å; K500-S504 WeakPolarHBondContact O-CB 3.42Å; K500-S504 PolarHBondContact O-N 3.15Å
501	R	35.8	Very low	35.3	Very low	170 Å²	170	70.8 Å²	70.8	64%	0.642	37%	0.369	S	S	*	.	H	α-helix	trans	-69.9	-45.6	174.5	-137.4	88.2	179.1	-158.9	-0.7	109.8	S497 I498 T499 E503 S504 I505	S497-R501 WeakPolarHBondContact O-CA 3.35Å; S497-R501 WeakPolarHBondContact O-CB 3.39Å; S497-R501 PolarHBondContact O-N 3.22Å; I498-R501 PolarHBondContact O-N 2.95Å; T499-R501 VanDerWaalsContact C-N 3.29Å; T499-R501 PolarHBondContact O-N 2.97Å; R501-E503 VanDerWaalsContact C-N 3.26Å; R501-E503 PolarHBondContact O-N 3.23Å; R501-S504 WeakPolarHBondContact CA-OG 3.26Å; R501-S504 CarbonylContact O-C 3.57Å; R501-S504 WeakPolarHBondContact O-CA 3.38Å; R501-S504 PolarHBondContact O-N 3.23Å; R501-S504 PolarHBondContact O-OG 2.77Å; R501-I505 WeakPolarHBondContact O-CG1 3.25Å; R501-I505 PolarHBondContact O-N 3.16Å
502	I	35.3	Very low	36	Very low	82 Å²	82	77.6 Å²	77.6	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-57.9	-41	175.3	-69.4	168.5	0	0	0	110.1	I498 T499 I505 P506	I498-I502 HydrophobicContact CG2-CD1 3.54Å; I498-I502 HydrophobicContact CG2-CG1 4.22Å; I498-I502 WeakPolarHBondContact O-CB 3.48Å; I498-I502 WeakPolarHBondContact O-CG1 3.48Å; I498-I502 PolarHBondContact O-N 2.87Å; T499-I502 PolarHBondContact O-N 2.96Å; I502-I505 PolarHBondContact O-N 3.49Å; I502-P506 WeakPolarHBondContact O-CD 3.47Å
503	E	38.4	Very low	36.8	Very low	134 Å²	134	77 Å²	77	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-66.5	-33.3	172.6	-72.6	174	171.7	0	0	113.1	T499 R501 P506	T499-E503 WeakPolarHBondContact O-CG 3.22Å; T499-E503 PolarHBondContact O-N 3.13Å; R501-E503 VanDerWaalsContact C-N 3.26Å; R501-E503 PolarHBondContact O-N 3.23Å; E503-P506 WeakPolarHBondContact O-CD 3.29Å
504	S	39.2	Very low	37.9	Very low	36 Å²	36	78 Å²	78	25%	0.252	39%	0.394	S	S	.	.	H	α-helix	trans	-79.8	-26.2	178.2	80.1	0	0	0	0	113.8	K500 R501 S507 Q508	K500-S504 WeakPolarHBondContact O-CB 3.42Å; K500-S504 PolarHBondContact O-N 3.15Å; R501-S504 WeakPolarHBondContact CA-OG 3.26Å; R501-S504 CarbonylContact O-C 3.57Å; R501-S504 WeakPolarHBondContact O-CA 3.38Å; R501-S504 PolarHBondContact O-N 3.23Å; R501-S504 PolarHBondContact O-OG 2.77Å; S504-S507 PolarHBondContact O-N 3.12Å; S504-S507 VanDerWaalsContact O-N 3.13Å; S504-S507 PolarHBondContact O-OG 3.12Å; S504-Q508 WeakPolarHBondContact O-CG 3.38Å; S504-Q508 PolarHBondContact O-N 3.06Å
505	I	38.4	Very low	38.9	Very low	66 Å²	66	85.1 Å²	85.1	34%	0.338	42%	0.423	S	S	.	.	H	α-helix	trans	-57.2	-45.5	-176.7	-79.6	166.1	0	0	0	111.7	R501 I502 S507 Q508 I509	R501-I505 WeakPolarHBondContact O-CG1 3.25Å; R501-I505 PolarHBondContact O-N 3.16Å; I502-I505 PolarHBondContact O-N 3.49Å; I505-S507 VanDerWaalsContact C-N 3.35Å; I505-S507 PolarHBondContact O-N 3.24Å; I505-Q508 PolarHBondContact O-N 3.38Å; I505-I509 HydrophobicContact CG2-CD1 3.45Å; I505-I509 VanDerWaalsContact CG2-CD1 3.45Å; I505-I509 HydrophobicContact CG2-CG1 4.12Å; I505-I509 WeakPolarHBondContact O-CB 3.46Å; I505-I509 WeakPolarHBondContact O-CG1 2.94Å; I505-I509 PolarHBondContact O-N 3.41Å
506	P	39.9	Very low	39.3	Very low	15 Å²	15	85.1 Å²	85.1	10%	0.097	43%	0.427	C	S	.	.	H	α-helix	trans	-53.3	-51.1	173.7	-25.9	30.4	0	0	0	112.1	I502 E503 Q508 I509 T510 I538	I502-P506 WeakPolarHBondContact O-CD 3.47Å; E503-P506 WeakPolarHBondContact O-CD 3.29Å; P506-Q508 VanDerWaalsContact C-N 3.31Å; P506-Q508 PolarHBondContact O-N 3.41Å; P506-I509 WeakPolarHBondContact O-CB 3.23Å; P506-I509 PolarHBondContact O-N 2.66Å; P506-I509 VanDerWaalsContact O-N 3.1Å; P506-T510 PolarHBondContact O-N 3.26Å; P506-T510 PolarHBondContact O-OG1 3.18Å; P506-I538 HydrophobicContact CB-CG2 4.44Å; P506-I538 HydrophobicContact CG-CB 3.77Å; P506-I538 HydrophobicContact CG-CD1 3.76Å; P506-I538 HydrophobicContact CG-CG1 4.37Å; P506-I538 HydrophobicContact CG-CG2 3.29Å
507	S	46.1	Very low	40.1	Very low	64 Å²	64	90.1 Å²	90.1	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-62.3	-38.2	-178.2	70.8	0	0	0	0	112.7	S504 I505 L511	S504-S507 PolarHBondContact O-N 3.12Å; S504-S507 VanDerWaalsContact O-N 3.13Å; S504-S507 PolarHBondContact O-OG 3.12Å; I505-S507 VanDerWaalsContact C-N 3.35Å; I505-S507 PolarHBondContact O-N 3.24Å; S507-L511 WeakPolarHBondContact O-CB 3.34Å; S507-L511 PolarHBondContact O-N 2.94Å
508	Q	42	Very low	40.5	Very low	107 Å²	107	97.7 Å²	97.7	50%	0.5	48%	0.476	S	S	.	.	H	α-helix	trans	-68.1	-39	175.6	-70.9	-88.3	-0.6	0	0	111.3	S504 I505 P506 L511 Y512	S504-Q508 WeakPolarHBondContact O-CG 3.38Å; S504-Q508 PolarHBondContact O-N 3.06Å; I505-Q508 PolarHBondContact O-N 3.38Å; P506-Q508 VanDerWaalsContact C-N 3.31Å; P506-Q508 PolarHBondContact O-N 3.41Å; Q508-L511 WeakPolarHBondContact O-CB 3.43Å; Q508-L511 PolarHBondContact O-N 3.13Å; Q508-Y512 PolarHBondContact O-N 2.86Å
509	I	38.5	Very low	40.8	Very low	16 Å²	16	97.4 Å²	97.4	8%	0.082	48%	0.478	C	S	.	.	H	α-helix	trans	-66	-45	176.4	-73.1	173.2	0	0	0	111	I505 P506 L511 Y512 T513 L531 L534 A535	I505-I509 HydrophobicContact CG2-CD1 3.45Å; I505-I509 VanDerWaalsContact CG2-CD1 3.45Å; I505-I509 HydrophobicContact CG2-CG1 4.12Å; I505-I509 WeakPolarHBondContact O-CB 3.46Å; I505-I509 WeakPolarHBondContact O-CG1 2.94Å; I505-I509 PolarHBondContact O-N 3.41Å; P506-I509 WeakPolarHBondContact O-CB 3.23Å; P506-I509 PolarHBondContact O-N 2.66Å; P506-I509 VanDerWaalsContact O-N 3.1Å; I509-L511 VanDerWaalsContact C-N 3.27Å; I509-L511 PolarHBondContact O-N 2.84Å; I509-Y512 PolarHBondContact O-N 2.9Å; I509-T513 WeakPolarHBondContact O-CG2 3.48Å; I509-T513 PolarHBondContact O-N 3.47Å; I509-T513 PolarHBondContact O-OG1 2.92Å; I509-L531 HydrophobicContact CD1-CD2 3.74Å; I509-L531 HydrophobicContact CG1-CD2 3.93Å; I509-L531 HydrophobicContact CG2-CB 3.67Å; I509-L531 HydrophobicContact CG2-CD2 4.45Å; I509-L531 HydrophobicContact CG2-CG 4.47Å; I509-L534 HydrophobicContact CD1-CD2 4.4Å; I509-A535 HydrophobicContact CG2-CB 4.13Å
510	T	45.1	Very low	40.9	Very low	67 Å²	67	101.7 Å²	101.7	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-39.3	174.9	-34	0	0	0	0	110.8	P506 T513 N514	P506-T510 PolarHBondContact O-N 3.26Å; P506-T510 PolarHBondContact O-OG1 3.18Å; T510-T513 VanDerWaalsContact CA-OG1 3.28Å; T510-T513 WeakPolarHBondContact CA-OG1 3.11Å; T510-T513 PolarHBondContact O-OG1 3.42Å; T510-N514 WeakPolarHBondContact O-CB 3.29Å; T510-N514 PolarHBondContact O-N 2.68Å; T510-N514 PolarHBondContact O-ND2 2.79Å
511	L	47.3	Very low	41.2	Very low	90 Å²	90	102.1 Å²	102.1	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-40.5	173.8	-98.6	154.9	0	0	0	113	S507 Q508 I509 K515	S507-L511 WeakPolarHBondContact O-CB 3.34Å; S507-L511 PolarHBondContact O-N 2.94Å; Q508-L511 WeakPolarHBondContact O-CB 3.43Å; Q508-L511 PolarHBondContact O-N 3.13Å; I509-L511 VanDerWaalsContact C-N 3.27Å; I509-L511 PolarHBondContact O-N 2.84Å; L511-K515 WeakPolarHBondContact O-CB 3.44Å; L511-K515 WeakPolarHBondContact O-CG 3.5Å; L511-K515 PolarHBondContact O-N 2.96Å; L511-K515 VanDerWaalsContact O-N 3.15Å
512	Y	41.1	Very low	41.4	Very low	167 Å²	167	98.3 Å²	98.3	66%	0.655	50%	0.499	S	S	*	.	H	α-helix	trans	-69.3	-41.7	178.1	-104.5	-83.7	0	0	0	112.3	Q508 I509 N514 K515 S516	Q508-Y512 PolarHBondContact O-N 2.86Å; I509-Y512 PolarHBondContact O-N 2.9Å; Y512-N514 VanDerWaalsContact C-N 3.35Å; Y512-K515 PolarHBondContact O-N 2.8Å; Y512-S516 WeakPolarHBondContact O-CB 3.2Å; Y512-S516 PolarHBondContact O-N 2.8Å
513	T	43.6	Very low	41.3	Very low	22 Å²	22	98.2 Å²	98.2	14%	0.135	51%	0.506	C	S	.	.	H	α-helix	trans	-66.5	-35.7	177.9	44.3	0	0	0	0	112.4	I509 T510 S516 K528	I509-T513 WeakPolarHBondContact O-CG2 3.48Å; I509-T513 PolarHBondContact O-N 3.47Å; I509-T513 PolarHBondContact O-OG1 2.92Å; T510-T513 VanDerWaalsContact CA-OG1 3.28Å; T510-T513 WeakPolarHBondContact CA-OG1 3.11Å; T510-T513 PolarHBondContact O-OG1 3.42Å; T513-S516 PolarHBondContact O-OG 2.86Å; T513-K528 HydrophobicContact CG2-CG 3.98Å
514	N	50.1	Low	41.2	Very low	116 Å²	116	95.2 Å²	95.2	62%	0.62	49%	0.494	S	S	*	.	H	α-helix	trans	-75.5	-30.5	177	-70.4	-10.3	0	0	0	113.4	T510 Y512 S516	T510-N514 WeakPolarHBondContact O-CB 3.29Å; T510-N514 PolarHBondContact O-N 2.68Å; T510-N514 PolarHBondContact O-ND2 2.79Å; Y512-N514 VanDerWaalsContact C-N 3.35Å; N514-S516 VanDerWaalsContact C-N 3.35Å
515	K	45.4	Very low	41.5	Very low	171 Å²	171	98.7 Å²	98.7	74%	0.743	51%	0.509	S	S	*	.	H	α-helix	trans	-80.8	-13.9	178	-77.4	-177.3	177.8	-179.9	0	113.7	L511 Y512 E517	L511-K515 WeakPolarHBondContact O-CB 3.44Å; L511-K515 WeakPolarHBondContact O-CG 3.5Å; L511-K515 PolarHBondContact O-N 2.96Å; L511-K515 VanDerWaalsContact O-N 3.15Å; Y512-K515 PolarHBondContact O-N 2.8Å; K515-E517 VanDerWaalsContact C-N 3.32Å; K515-E517 PolarHBondContact O-N 3.48Å
516	S	37.3	Very low	41.5	Very low	44 Å²	44	100 Å²	100	31%	0.308	52%	0.516	S	S	.	.			trans	-90.5	27.7	-171.3	80	0	0	0	0	114.7	Y512 T513 N514 K518	Y512-S516 WeakPolarHBondContact O-CB 3.2Å; Y512-S516 PolarHBondContact O-N 2.8Å; T513-S516 PolarHBondContact O-OG 2.86Å; N514-S516 VanDerWaalsContact C-N 3.35Å; S516-K518 PolarHBondContact O-N 2.85Å; S516-K518 VanDerWaalsContact O-N 3.14Å
517	E	45.4	Very low	41.5	Very low	181 Å²	181	103.8 Å²	103.8	85%	0.846	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-14	176.6	-79.4	-175.5	163	0	0	113.8	K515	K515-E517 VanDerWaalsContact C-N 3.32Å; K515-E517 PolarHBondContact O-N 3.48Å
518	K	41.8	Very low	41.5	Very low	201 Å²	201	105.1 Å²	105.1	87%	0.874	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	18.5	-172.7	-71.4	-168.1	175.5	-175.1	0	116.5	S516	S516-K518 PolarHBondContact O-N 2.85Å; S516-K518 VanDerWaalsContact O-N 3.14Å
519	V	36.3	Very low	41.7	Very low	78 Å²	78	104.9 Å²	104.9	47%	0.473	53%	0.534	S	S	.	.			trans	-123.3	92	-179.1	-170.1	0	0	0	0	111.9	K521	V519-K521 PolarHBondContact O-N 2.79Å
520	D	35.5	Very low	41.8	Very low	171 Å²	171	110.7 Å²	110.7	91%	0.914	56%	0.556	S	S	*	*			trans	-75.9	45.8	-173.8	-140	4.4	0	0	0	114
521	K	43.3	Very low	41.5	Very low	146 Å²	146	109.7 Å²	109.7	64%	0.635	55%	0.548	S	S	*	.			trans	-121.3	120.1	-177.6	-68.6	-175.3	178.9	-178.8	0	110.9	V519 S523 N524	V519-K521 PolarHBondContact O-N 2.79Å; K521-S523 PolarHBondContact O-N 2.88Å; K521-N524 WeakPolarHBondContact O-CB 3.11Å; K521-N524 PolarHBondContact O-N 3.02Å
522	S	39.1	Very low	41.7	Very low	91 Å²	91	110 Å²	110	64%	0.636	55%	0.547	S	S	*	.	H	α-helix	trans	-48.2	-31.3	178.9	57.7	0	0	0	0	114.3	N524 I525	S522-N524 PolarHBondContact O-N 3.34Å; S522-I525 PolarHBondContact O-N 3.28Å; S522-I525 VanDerWaalsContact O-N 3.16Å
523	S	33.6	Very low	42	Very low	80 Å²	80	109.6 Å²	109.6	56%	0.559	55%	0.549	S	S	*	.	H	α-helix	trans	-59.8	-29.7	174.9	-31.2	0	0	0	0	113.3	K521	K521-S523 PolarHBondContact O-N 2.88Å
524	N	36.5	Very low	41.7	Very low	71 Å²	71	111.3 Å²	111.3	38%	0.38	56%	0.557	S	S	.	*	H	α-helix	trans	-84.3	-21.2	178.2	-91.4	-25.4	0	0	0	113.4	K521 S522 L526 L527 K528	K521-N524 WeakPolarHBondContact O-CB 3.11Å; K521-N524 PolarHBondContact O-N 3.02Å; S522-N524 PolarHBondContact O-N 3.34Å; N524-L526 VanDerWaalsContact C-N 3.31Å; N524-L526 PolarHBondContact O-N 3.3Å; N524-L527 PolarHBondContact O-N 2.68Å; N524-K528 WeakPolarHBondContact O-CB 3.48Å; N524-K528 PolarHBondContact O-N 3.01Å
525	I	44.4	Very low	41.4	Very low	109 Å²	109	106.5 Å²	106.5	56%	0.559	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-42.4	175.8	-62.4	174.2	0	0	0	109.7	S522 K528 L529	S522-I525 PolarHBondContact O-N 3.28Å; S522-I525 VanDerWaalsContact O-N 3.16Å; I525-K528 PolarHBondContact O-N 2.74Å; I525-L529 HydrophobicContact CG2-CD1 4.02Å; I525-L529 HydrophobicContact CG2-CG 4.46Å; I525-L529 WeakPolarHBondContact O-CB 3.34Å; I525-L529 WeakPolarHBondContact O-CG 3.4Å; I525-L529 PolarHBondContact O-N 3.46Å
526	L	40	Very low	41.5	Very low	92 Å²	92	103.2 Å²	103.2	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-63.9	-43.3	176	-107.9	146.5	0	0	0	112.1	R385 N524 K528 Y530	R385-L526 VanDerWaalsContact NH2-CD2 3.34Å; N524-L526 VanDerWaalsContact C-N 3.31Å; N524-L526 PolarHBondContact O-N 3.3Å; L526-K528 VanDerWaalsContact C-N 3.34Å; L526-Y530 WeakPolarHBondContact O-CB 3.19Å; L526-Y530 PolarHBondContact O-N 3.38Å
527	L	39.5	Very low	41.6	Very low	96 Å²	96	104.2 Å²	104.2	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-42.8	174.9	-163.7	79.7	0	0	0	110.7	N524 Y530 L531	N524-L527 PolarHBondContact O-N 2.68Å; L527-Y530 PolarHBondContact O-N 2.66Å; L527-L531 HydrophobicContact CD2-CD1 4.18Å; L527-L531 HydrophobicContact CG-CD1 3.97Å; L527-L531 HydrophobicContact CG-CG 4.32Å; L527-L531 VanDerWaalsContact O-CB 3.25Å; L527-L531 WeakPolarHBondContact O-CB 3.37Å; L527-L531 WeakPolarHBondContact O-CG 3.37Å; L527-L531 PolarHBondContact O-N 2.83Å
528	K	45.7	Very low	41.3	Very low	92 Å²	92	96.9 Å²	96.9	40%	0.4	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-50.7	177.8	-169	174.7	-175.1	-178.1	0	111	T513 N524 I525 L526 Y530 L531 E532	T513-K528 HydrophobicContact CG2-CG 3.98Å; N524-K528 WeakPolarHBondContact O-CB 3.48Å; N524-K528 PolarHBondContact O-N 3.01Å; I525-K528 PolarHBondContact O-N 2.74Å; L526-K528 VanDerWaalsContact C-N 3.34Å; K528-Y530 VanDerWaalsContact C-N 3.3Å; K528-Y530 PolarHBondContact O-N 2.82Å; K528-L531 PolarHBondContact O-N 2.64Å; K528-E532 WeakPolarHBondContact O-CB 3.46Å; K528-E532 PolarHBondContact O-N 2.78Å
529	L	45.5	Very low	41.6	Very low	102 Å²	102	91.1 Å²	91.1	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-59.6	-39.8	175.2	-75.1	168.5	0	0	0	112	I525 K533	I525-L529 HydrophobicContact CG2-CD1 4.02Å; I525-L529 HydrophobicContact CG2-CG 4.46Å; I525-L529 WeakPolarHBondContact O-CB 3.34Å; I525-L529 WeakPolarHBondContact O-CG 3.4Å; I525-L529 PolarHBondContact O-N 3.46Å; L529-K533 VanDerWaalsContact O-CB 3.27Å; L529-K533 WeakPolarHBondContact O-CB 2.94Å; L529-K533 PolarHBondContact O-N 2.96Å
530	Y	40.4	Very low	42	Very low	138 Å²	138	90.7 Å²	90.7	54%	0.541	47%	0.47	S	S	.	.	H	α-helix	trans	-67.5	-46.2	178.8	-148	-85.9	0	0	0	111.6	L526 L527 K528 K533 L534	L526-Y530 WeakPolarHBondContact O-CB 3.19Å; L526-Y530 PolarHBondContact O-N 3.38Å; L527-Y530 PolarHBondContact O-N 2.66Å; K528-Y530 VanDerWaalsContact C-N 3.3Å; K528-Y530 PolarHBondContact O-N 2.82Å; Y530-K533 PolarHBondContact O-N 3.2Å; Y530-L534 HydrophobicContact CD1-CD1 4.5Å; Y530-L534 HydrophobicContact CE1-CD1 4.47Å; Y530-L534 VanDerWaalsContact O-CB 3.28Å; Y530-L534 WeakPolarHBondContact O-CB 3.17Å; Y530-L534 PolarHBondContact O-N 2.74Å
531	L	40.3	Very low	42.2	Very low	46 Å²	46	83.7 Å²	83.7	24%	0.241	43%	0.432	C	S	.	.	H	α-helix	trans	-66.6	-39.4	179	-73.6	177.9	0	0	0	111.8	I509 L527 K528 L534 A535	I509-L531 HydrophobicContact CD1-CD2 3.74Å; I509-L531 HydrophobicContact CG1-CD2 3.93Å; I509-L531 HydrophobicContact CG2-CB 3.67Å; I509-L531 HydrophobicContact CG2-CD2 4.45Å; I509-L531 HydrophobicContact CG2-CG 4.47Å; L527-L531 HydrophobicContact CD2-CD1 4.18Å; L527-L531 HydrophobicContact CG-CD1 3.97Å; L527-L531 HydrophobicContact CG-CG 4.32Å; L527-L531 VanDerWaalsContact O-CB 3.25Å; L527-L531 WeakPolarHBondContact O-CB 3.37Å; L527-L531 WeakPolarHBondContact O-CG 3.37Å; L527-L531 PolarHBondContact O-N 2.83Å; K528-L531 PolarHBondContact O-N 2.64Å; L531-L534 PolarHBondContact O-N 3.38Å; L531-A535 VanDerWaalsContact O-CB 3.29Å; L531-A535 WeakPolarHBondContact O-CB 3.39Å; L531-A535 PolarHBondContact O-N 2.87Å
532	E	50.7	Low	42.2	Very low	96 Å²	96	82.2 Å²	82.2	45%	0.449	43%	0.426	S	S	.	.	H	α-helix	trans	-65.3	-43.2	175.4	-170.2	173.8	-159.2	0	0	111.2	K528 L534 A535 N536	K528-E532 WeakPolarHBondContact O-CB 3.46Å; K528-E532 PolarHBondContact O-N 2.78Å; E532-L534 VanDerWaalsContact C-N 3.34Å; E532-L534 PolarHBondContact O-N 2.82Å; E532-A535 PolarHBondContact O-N 2.68Å; E532-N536 WeakPolarHBondContact O-CB 3.3Å; E532-N536 VanDerWaalsContact O-CG 3.27Å; E532-N536 PolarHBondContact O-N 3.47Å
533	K	46.6	Very low	42.5	Very low	159 Å²	159	81.4 Å²	81.4	69%	0.691	41%	0.414	S	S	*	.	H	α-helix	trans	-65	-39.1	175.1	-153	169.8	-170.4	178	0	111.9	L529 Y530 N536 V537	L529-K533 VanDerWaalsContact O-CB 3.27Å; L529-K533 WeakPolarHBondContact O-CB 2.94Å; L529-K533 PolarHBondContact O-N 2.96Å; Y530-K533 PolarHBondContact O-N 3.2Å; K533-N536 PolarHBondContact O-N 2.78Å; K533-V537 WeakPolarHBondContact O-CG2 3.26Å; K533-V537 PolarHBondContact O-N 2.97Å
534	L	38.1	Very low	42.8	Very low	58 Å²	58	81 Å²	81	30%	0.304	41%	0.405	S	S	.	.	H	α-helix	trans	-68.4	-40.8	176.8	-155.6	154.6	0	0	0	111.2	I509 Y530 L531 E532 V537 I538	I509-L534 HydrophobicContact CD1-CD2 4.4Å; Y530-L534 HydrophobicContact CD1-CD1 4.5Å; Y530-L534 HydrophobicContact CE1-CD1 4.47Å; Y530-L534 VanDerWaalsContact O-CB 3.28Å; Y530-L534 WeakPolarHBondContact O-CB 3.17Å; Y530-L534 PolarHBondContact O-N 2.74Å; L531-L534 PolarHBondContact O-N 3.38Å; E532-L534 VanDerWaalsContact C-N 3.34Å; E532-L534 PolarHBondContact O-N 2.82Å; L534-V537 PolarHBondContact O-N 2.79Å; L534-I538 HydrophobicContact CD2-CD1 3.48Å; L534-I538 VanDerWaalsContact CD2-CD1 3.48Å; L534-I538 HydrophobicContact CD2-CG1 4.24Å; L534-I538 WeakPolarHBondContact O-CG1 3.3Å; L534-I538 PolarHBondContact O-N 2.89Å
535	A	43.7	Very low	42.7	Very low	14 Å²	14	83 Å²	83	12%	0.116	41%	0.414	C	S	.	.	H	α-helix	trans	-62.5	-42.5	173.1	0	0	0	0	0	111.7	I509 L531 E532 I538 Q539	I509-A535 HydrophobicContact CG2-CB 4.13Å; L531-A535 VanDerWaalsContact O-CB 3.29Å; L531-A535 WeakPolarHBondContact O-CB 3.39Å; L531-A535 PolarHBondContact O-N 2.87Å; E532-A535 PolarHBondContact O-N 2.68Å; A535-I538 PolarHBondContact O-N 2.81Å; A535-Q539 VanDerWaalsContact O-CB 3.3Å; A535-Q539 WeakPolarHBondContact O-CB 3.48Å; A535-Q539 PolarHBondContact O-N 2.63Å
536	N	47.2	Very low	42.5	Very low	103 Å²	103	84.1 Å²	84.1	55%	0.551	42%	0.415	S	S	*	.	H	α-helix	trans	-63.4	-41.1	176.2	-74.1	-14.3	0	0	0	112.3	E532 K533 Q539 S540	E532-N536 WeakPolarHBondContact O-CB 3.3Å; E532-N536 VanDerWaalsContact O-CG 3.27Å; E532-N536 PolarHBondContact O-N 3.47Å; K533-N536 PolarHBondContact O-N 2.78Å; N536-Q539 PolarHBondContact O-N 2.78Å; N536-S540 WeakPolarHBondContact O-CB 3.41Å; N536-S540 PolarHBondContact O-N 2.76Å; N536-S540 PolarHBondContact O-OG 3.36Å
537	V	40.2	Very low	42.4	Very low	64 Å²	64	83.7 Å²	83.7	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-60.7	-48.2	174.1	170.7	0	0	0	0	110.5	K533 L534 Q539 S540 Q541	K533-V537 WeakPolarHBondContact O-CG2 3.26Å; K533-V537 PolarHBondContact O-N 2.97Å; L534-V537 PolarHBondContact O-N 2.79Å; V537-Q539 VanDerWaalsContact C-N 3.34Å; V537-Q539 PolarHBondContact O-N 3.29Å; V537-S540 PolarHBondContact O-N 2.7Å; V537-S540 PolarHBondContact O-OG 2.97Å; V537-Q541 WeakPolarHBondContact O-CB 3.48Å; V537-Q541 PolarHBondContact O-N 2.91Å
538	I	39.9	Very low	42	Very low	27 Å²	27	83.6 Å²	83.6	14%	0.138	42%	0.416	C	S	.	.	H	α-helix	trans	-66.9	-36.1	179.9	-60.3	169.3	0	0	0	111.7	P506 L534 A535 Q541 K542	P506-I538 HydrophobicContact CB-CG2 4.44Å; P506-I538 HydrophobicContact CG-CB 3.77Å; P506-I538 HydrophobicContact CG-CD1 3.76Å; P506-I538 HydrophobicContact CG-CG1 4.37Å; P506-I538 HydrophobicContact CG-CG2 3.29Å; L534-I538 HydrophobicContact CD2-CD1 3.48Å; L534-I538 VanDerWaalsContact CD2-CD1 3.48Å; L534-I538 HydrophobicContact CD2-CG1 4.24Å; L534-I538 WeakPolarHBondContact O-CG1 3.3Å; L534-I538 PolarHBondContact O-N 2.89Å; A535-I538 PolarHBondContact O-N 2.81Å; I538-Q541 WeakPolarHBondContact O-CB 3.15Å; I538-Q541 PolarHBondContact O-N 2.99Å; I538-K542 PolarHBondContact O-N 2.75Å
539	Q	47.6	Very low	41.4	Very low	81 Å²	81	87.6 Å²	87.6	38%	0.379	44%	0.436	S	S	.	.	H	α-helix	trans	-68.2	-43.6	177.1	-172.7	57.1	46.1	0	0	111.3	A535 N536 V537 Q541 K542 D543	A535-Q539 VanDerWaalsContact O-CB 3.3Å; A535-Q539 WeakPolarHBondContact O-CB 3.48Å; A535-Q539 PolarHBondContact O-N 2.63Å; N536-Q539 PolarHBondContact O-N 2.78Å; V537-Q539 VanDerWaalsContact C-N 3.34Å; V537-Q539 PolarHBondContact O-N 3.29Å; Q539-Q541 VanDerWaalsContact C-N 3.25Å; Q539-Q541 PolarHBondContact O-N 3.1Å; Q539-K542 WeakPolarHBondContact O-CB 3.22Å; Q539-K542 PolarHBondContact O-N 2.84Å; Q539-K542 VanDerWaalsContact O-N 3.09Å; Q539-D543 PolarHBondContact NE2-OD1 3.18Å; Q539-D543 PolarHBondContact NE2-OD2 3.47Å; Q539-D543 PolarHBondContact O-N 3.33Å
540	S	45	Very low	40.5	Very low	68 Å²	68	88.2 Å²	88.2	48%	0.476	45%	0.447	S	S	.	.	H	α-helix	trans	-60	-36.8	173.6	69.2	0	0	0	0	112.2	N536 V537 D543 L544	N536-S540 WeakPolarHBondContact O-CB 3.41Å; N536-S540 PolarHBondContact O-N 2.76Å; N536-S540 PolarHBondContact O-OG 3.36Å; V537-S540 PolarHBondContact O-N 2.7Å; V537-S540 PolarHBondContact O-OG 2.97Å; S540-D543 PolarHBondContact O-N 3.02Å; S540-L544 WeakPolarHBondContact O-CB 3.44Å; S540-L544 PolarHBondContact O-N 3.49Å
541	Q	38.7	Very low	40	Very low	25 Å²	25	85.7 Å²	85.7	12%	0.117	45%	0.447	C	S	.	.	H	α-helix	trans	-66.1	-40.5	172.6	-85.9	-103.9	-29.7	0	0	112.6	E379 V537 I538 Q539 D543 L544 M545	E379-Q541 PolarHBondContact OE2-NE2 2.77Å; V537-Q541 WeakPolarHBondContact O-CB 3.48Å; V537-Q541 PolarHBondContact O-N 2.91Å; I538-Q541 WeakPolarHBondContact O-CB 3.15Å; I538-Q541 PolarHBondContact O-N 2.99Å; Q539-Q541 VanDerWaalsContact C-N 3.25Å; Q539-Q541 PolarHBondContact O-N 3.1Å; Q541-D543 VanDerWaalsContact C-N 3.31Å; Q541-D543 PolarHBondContact O-N 3Å; Q541-L544 PolarHBondContact O-N 2.66Å; Q541-M545 WeakPolarHBondContact O-CG 3.18Å; Q541-M545 PolarHBondContact O-N 2.63Å
542	K	43.4	Very low	39.3	Very low	114 Å²	114	92.3 Å²	92.3	50%	0.496	47%	0.473	S	S	.	.	H	α-helix	trans	-62.6	-40.1	174.7	-173.4	179.4	-179.5	177.7	0	111.6	I538 Q539 M545 K546	I538-K542 PolarHBondContact O-N 2.75Å; Q539-K542 WeakPolarHBondContact O-CB 3.22Å; Q539-K542 PolarHBondContact O-N 2.84Å; Q539-K542 VanDerWaalsContact O-N 3.09Å; K542-M545 PolarHBondContact O-N 2.85Å; K542-K546 PolarHBondContact O-N 3.35Å; K542-K546 VanDerWaalsContact O-N 3.13Å
543	D	46.3	Very low	38.3	Very low	74 Å²	74	97.6 Å²	97.6	40%	0.396	50%	0.498	S	S	.	.	H	α-helix	trans	-71.2	-37.9	177.2	-64.4	-29.2	0	0	0	110.9	Q539 S540 Q541 K546 T547	Q539-D543 PolarHBondContact NE2-OD1 3.18Å; Q539-D543 PolarHBondContact NE2-OD2 3.47Å; Q539-D543 PolarHBondContact O-N 3.33Å; S540-D543 PolarHBondContact O-N 3.02Å; Q541-D543 VanDerWaalsContact C-N 3.31Å; Q541-D543 PolarHBondContact O-N 3Å; D543-K546 WeakPolarHBondContact O-CB 3.33Å; D543-K546 PolarHBondContact O-N 3.21Å; D543-T547 PolarHBondContact O-N 2.92Å; D543-T547 PolarHBondContact O-OG1 2.79Å; D543-T547 VanDerWaalsContact O-OG1 3.11Å
544	L	39.2	Very low	37.7	Very low	71 Å²	71	97.6 Å²	97.6	37%	0.372	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-40.6	172.4	-164.7	75.7	0	0	0	112.4	S540 Q541 K546 T547 N548	S540-L544 WeakPolarHBondContact O-CB 3.44Å; S540-L544 PolarHBondContact O-N 3.49Å; Q541-L544 PolarHBondContact O-N 2.66Å; L544-K546 VanDerWaalsContact C-N 3.34Å; L544-K546 PolarHBondContact O-N 3.19Å; L544-T547 VanDerWaalsContact CA-OG1 3.27Å; L544-T547 WeakPolarHBondContact CA-OG1 3.47Å; L544-T547 PolarHBondContact O-N 3.4Å; L544-T547 PolarHBondContact O-OG1 3.41Å; L544-N548 WeakPolarHBondContact O-CB 3.37Å; L544-N548 PolarHBondContact O-N 3.39Å
545	M	33.8	Very low	37.6	Very low	114 Å²	114	102.2 Å²	102.2	56%	0.562	52%	0.52	S	S	*	.	H	α-helix	trans	-63.5	-38.6	175	-78.5	-175.3	93.2	0	0	112	Q541 K542 Q549	Q541-M545 WeakPolarHBondContact O-CG 3.18Å; Q541-M545 PolarHBondContact O-N 2.63Å; K542-M545 PolarHBondContact O-N 2.85Å; M545-Q549 PolarHBondContact O-N 2.88Å; M545-Q549 VanDerWaalsContact O-N 3.14Å
546	K	39.8	Very low	37.7	Very low	133 Å²	133	105.3 Å²	105.3	58%	0.578	54%	0.541	S	S	*	.	H	α-helix	trans	-66.1	-40.5	174.7	-77.2	180	175.7	-178.4	0	112	K542 D543 L544	K542-K546 PolarHBondContact O-N 3.35Å; K542-K546 VanDerWaalsContact O-N 3.13Å; D543-K546 WeakPolarHBondContact O-CB 3.33Å; D543-K546 PolarHBondContact O-N 3.21Å; L544-K546 VanDerWaalsContact C-N 3.34Å; L544-K546 PolarHBondContact O-N 3.19Å
547	T	38.3	Very low	38.1	Very low	82 Å²	82	104.7 Å²	104.7	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-69.5	-39.8	176.5	40.9	0	0	0	0	112.3	D543 L544 Q549 C550	D543-T547 PolarHBondContact O-N 2.92Å; D543-T547 PolarHBondContact O-OG1 2.79Å; D543-T547 VanDerWaalsContact O-OG1 3.11Å; L544-T547 VanDerWaalsContact CA-OG1 3.27Å; L544-T547 WeakPolarHBondContact CA-OG1 3.47Å; L544-T547 PolarHBondContact O-N 3.4Å; L544-T547 PolarHBondContact O-OG1 3.41Å; T547-Q549 VanDerWaalsContact C-N 3.32Å; T547-Q549 PolarHBondContact O-N 3.4Å; T547-C550 WeakPolarHBondContact O-CB 3.31Å; T547-C550 PolarHBondContact O-N 3.43Å
548	N	32.1	Very low	39	Very low	94 Å²	94	103.1 Å²	103.1	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-26.3	-179.7	-74.4	-10.8	0	0	0	113	L544 C550 T551	L544-N548 WeakPolarHBondContact O-CB 3.37Å; L544-N548 PolarHBondContact O-N 3.39Å; N548-C550 PolarHBondContact O-N 3.32Å; N548-T551 PolarHBondContact O-N 3.32Å
549	Q	31.9	Very low	40.2	Very low	177 Å²	177	102.1 Å²	102.1	83%	0.827	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.8	170.1	-88.6	-176.3	-9.2	0	0	113.5	M545 T547	M545-Q549 PolarHBondContact O-N 2.88Å; M545-Q549 VanDerWaalsContact O-N 3.14Å; T547-Q549 VanDerWaalsContact C-N 3.32Å; T547-Q549 PolarHBondContact O-N 3.4Å
550	C	28.2	Very low	41.2	Very low	114 Å²	114	98.4 Å²	98.4	77%	0.77	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.3	178	-145.4	0	0	0	0	113.5	T547 N548	T547-C550 WeakPolarHBondContact O-CB 3.31Å; T547-C550 PolarHBondContact O-N 3.43Å; N548-C550 PolarHBondContact O-N 3.32Å
551	T	29	Very low	42.4	Very low	86 Å²	86	96.1 Å²	96.1	53%	0.528	48%	0.484	S	S	.	.	S	Bend	trans	-135.1	114.2	-175.3	55.8	0	0	0	0	112.2	N548	N548-T551 PolarHBondContact O-N 3.32Å
552	K	26.1	Very low	43.6	Very low	184 Å²	184	95.1 Å²	95.1	80%	0.8	48%	0.479	S	S	*	.			trans	85.9	101.6	170.3	-56.5	-178	177.3	-177.7	0	116.1	E554	K552-E554 PolarHBondContact O-N 3.01Å
553	H	29.6	Very low	44.7	Very low	208 Å²	208	91.4 Å²	91.4	96%	0.963	47%	0.468	S	S	*	.			trans	-63.1	69.7	158.5	-84.1	-75.7	0	0	0	110.9
554	E	33.8	Very low	45	Very low	158 Å²	158	91.8 Å²	91.8	74%	0.738	47%	0.473	S	S	*	.			trans	-87.8	116.9	156.9	-80.2	178.9	177.4	0	0	107	K552 S556	K552-E554 PolarHBondContact O-N 3.01Å; E554-S556 PolarHBondContact O-N 3.07Å
555	Q	36.2	Very low	45.9	Very low	155 Å²	155	92.1 Å²	92.1	72%	0.724	48%	0.475	S	S	*	.			trans	-59.2	90.7	171.5	-78.8	174	-22.8	0	0	108.1	Y557	Q555-Y557 HydrophobicContact CB-CE2 4.12Å; Q555-Y557 VanDerWaalsContact O-CD2 3.31Å; Q555-Y557 WeakPolarHBondContact O-CD2 3.44Å; Q555-Y557 PolarHBondContact O-N 2.95Å; Q555-Y557 PolarHBondContact OE1-OH 3.49Å; Q555-Y557 VanDerWaalsContact OE1-OH 3.07Å
556	S	45.5	Very low	47.4	Very low	80 Å²	80	86.8 Å²	86.8	56%	0.559	45%	0.449	S	S	*	.			trans	-75.1	95.8	-179.7	65.2	0	0	0	0	108.9	L370 E554	L370-S556 WeakPolarHBondContact CD2-O 3.12Å; E554-S556 PolarHBondContact O-N 3.07Å
557	Y	55.8	Low	48.8	Very low	90 Å²	90	81.3 Å²	81.3	35%	0.353	43%	0.427	S	S	.	.			trans	-67.7	143.8	170.3	-60.7	-76.9	0	0	0	109.5	Q555 W559	Q555-Y557 HydrophobicContact CB-CE2 4.12Å; Q555-Y557 VanDerWaalsContact O-CD2 3.31Å; Q555-Y557 WeakPolarHBondContact O-CD2 3.44Å; Q555-Y557 PolarHBondContact O-N 2.95Å; Q555-Y557 PolarHBondContact OE1-OH 3.49Å; Q555-Y557 VanDerWaalsContact OE1-OH 3.07Å; Y557-W559 PolarHBondContact O-N 2.9Å
558	P	59	Low	50.6	Low	30 Å²	30	77.6 Å²	77.6	20%	0.195	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	128.1	175.5	27.3	-33.6	0	0	0	110.2	Y368 R571	Y368-P558 HydrophobicContact CD1-CB 3.66Å; Y368-P558 HydrophobicContact CD1-CG 3.71Å; Y368-P558 HydrophobicContact CE1-CG 4.28Å; Y368-P558 HydrophobicContact CG-CB 4.2Å; P558-R571 WeakPolarHBondContact O-CD 3.29Å
559	W	64.8	Low	52.9	Low	6 Å²	6	74.3 Å²	74.3	2%	0.023	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-39.7	-178.2	-171	55.6	0	0	0	111.2	I369 Y371 L374 Y557 V570 R571 F881 T883 V887 L889	I369-W559 WeakPolarHBondContact O-CB 3.47Å; I369-W559 PolarHBondContact O-N 3.45Å; Y371-W559 HydrophobicContact CD2-CD2 4.01Å; Y371-W559 HydrophobicContact CD2-CG 4.06Å; L374-W559 HydrophobicContact CD1-CD2 4.31Å; L374-W559 HydrophobicContact CD1-CE3 3.14Å; L374-W559 HydrophobicContact CD1-CH2 4.42Å; L374-W559 HydrophobicContact CD1-CZ3 3.23Å; Y557-W559 PolarHBondContact O-N 2.9Å; W559-V570 WeakPolarHBondContact O-CA 3.32Å; W559-R571 PolarHBondContact NE1-O 2.86Å; W559-R571 VanDerWaalsContact NE1-O 3.13Å; W559-R571 PolarHBondContact O-N 3.13Å; W559-F881 AromaticContact CE2-CE1 3.77Å; W559-F881 HydrophobicContact CH2-CD1 4.29Å; W559-F881 AromaticContact CZ2-CD1 3.65Å; W559-F881 HydrophobicContact CZ2-CD1 3.65Å; W559-F881 AromaticContact CZ2-CE1 3.47Å; W559-F881 HydrophobicContact CZ2-CE1 3.47Å; W559-F881 VanDerWaalsContact CZ2-CE1 3.47Å; W559-F881 AromaticContact NE1-CE1 3.68Å; W559-T883 HydrophobicContact CH2-CG2 4.46Å; W559-T883 HydrophobicContact CZ2-CG2 3.43Å; W559-T883 VanDerWaalsContact CZ2-CG2 3.43Å; W559-V887 HydrophobicContact CH2-CB 4.3Å; W559-V887 HydrophobicContact CH2-CG1 3.77Å; W559-V887 HydrophobicContact CZ3-CG1 4.04Å; W559-L889 HydrophobicContact CH2-CB 4.3Å; W559-L889 HydrophobicContact CH2-CD1 4.49Å; W559-L889 HydrophobicContact CZ3-CD1 4.03Å
560	V	68.9	Low	55.2	Low	4 Å²	4	65.9 Å²	65.9	2%	0.024	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.2	170	-176.6	0	0	0	0	108.5	Y368 I369 L568 T569 V570 L889	Y368-V560 WeakPolarHBondContact CA-O 3.46Å; I369-V560 HydrophobicContact CB-CB 4.17Å; I369-V560 HydrophobicContact CD1-CB 4.42Å; I369-V560 HydrophobicContact CG1-CB 4.47Å; I369-V560 PolarHBondContact N-O 3.29Å; I369-V560 PolarHBondContact O-N 3.36Å; V560-L568 HydrophobicContact CG1-CD1 3.52Å; V560-T569 WeakPolarHBondContact CA-O 3.08Å; V560-V570 HydrophobicContact CG1-CG2 4.44Å; V560-V570 HydrophobicContact CG2-CG1 4.39Å; V560-V570 HydrophobicContact CG2-CG2 4.35Å; V560-L889 HydrophobicContact CG2-CD1 4Å
561	S	69.9	Low	57.6	Low	19 Å²	19	64 Å²	64	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131.7	172.8	64.9	0	0	0	0	110.9	Q367 T569	Q367-S561 CarbonylContact O-C 3.58Å; Q367-S561 VanDerWaalsContact O-CA 3.29Å; Q367-S561 WeakPolarHBondContact O-CA 3.15Å; S561-T569 PolarHBondContact N-O 2.86Å; S561-T569 PolarHBondContact O-N 2.86Å; S561-T569 WeakPolarHBondContact OG-CB 3.46Å
562	Y	64.9	Low	59.8	Low	4 Å²	4	60 Å²	60	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.1	175.1	-170.3	-108.2	0	0	0	109.6	P366 Q367 V439 P450 I451 M452 G566 T567 L568 W581	P366-Y562 CarbonylContact C-O 3.58Å; P366-Y562 WeakPolarHBondContact CA-O 3.45Å; Q367-Y562 PolarHBondContact N-O 3.22Å; Q367-Y562 PolarHBondContact O-N 2.77Å; V439-Y562 HydrophobicContact CG1-CE2 4.5Å; P450-Y562 WeakPolarHBondContact CB-OH 3.4Å; I451-Y562 PolarHBondContact N-OH 3.12Å; M452-Y562 HydrophobicContact CB-CD1 4.45Å; M452-Y562 HydrophobicContact CB-CD2 4.26Å; M452-Y562 HydrophobicContact CB-CE1 4.3Å; M452-Y562 HydrophobicContact CB-CE2 4.12Å; M452-Y562 HydrophobicContact CB-CG 4.4Å; M452-Y562 HydrophobicContact SD-CD2 4.23Å; M452-Y562 HydrophobicContact SD-CG 4.24Å; Y562-G566 VanDerWaalsContact CE2-O 3.29Å; Y562-G566 WeakPolarHBondContact CE2-O 3.41Å; Y562-T567 WeakPolarHBondContact CA-O 2.99Å; Y562-L568 HydrophobicContact CD2-CB 3.86Å; Y562-L568 HydrophobicContact CD2-CD1 4.1Å; Y562-L568 HydrophobicContact CE2-CB 4.29Å; Y562-W581 HydrophobicContact CE2-CZ3 4.5Å
563	S	65	Low	61.7	Low	36 Å²	36	54.9 Å²	54.9	25%	0.252	29%	0.285	S	S	.	.			trans	-87.6	168.4	-176.2	49.3	0	0	0	0	113.1	D565 G566 T567	S563-D565 VanDerWaalsContact C-N 3.28Å; S563-D565 WeakPolarHBondContact CB-OD1 3.16Å; S563-D565 PolarHBondContact O-N 3.25Å; S563-D565 PolarHBondContact OG-OD1 3Å; S563-G566 WeakPolarHBondContact O-CA 3.48Å; S563-G566 PolarHBondContact O-N 2.85Å; S563-T567 PolarHBondContact N-O 3.46Å; S563-T567 WeakPolarHBondContact OG-CA 3.47Å; S563-T567 WeakPolarHBondContact OG-CB 3.43Å; S563-T567 PolarHBondContact OG-N 3.42Å; S563-T567 PolarHBondContact OG-O 3.36Å
564	T	53.3	Low	63.5	Low	83 Å²	83	49 Å²	49	51%	0.509	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.6	-177	47.3	0	0	0	0	114.2	C364 G566	C364-T564 WeakPolarHBondContact O-CG2 3.42Å; T564-G566 PolarHBondContact O-N 3.44Å
565	D	58.7	Low	65.1	Low	78 Å²	78	41.7 Å²	41.7	42%	0.417	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	0.1	173.8	68.5	-28.3	0	0	0	112.5	S563 T567 S583	S563-D565 VanDerWaalsContact C-N 3.28Å; S563-D565 WeakPolarHBondContact CB-OD1 3.16Å; S563-D565 PolarHBondContact O-N 3.25Å; S563-D565 PolarHBondContact OG-OD1 3Å; D565-T567 VanDerWaalsContact CG-OG1 3.31Å; D565-T567 WeakPolarHBondContact OD1-CB 3.46Å; D565-T567 PolarHBondContact OD1-N 3.48Å; D565-T567 VanDerWaalsContact OD1-N 3.1Å; D565-T567 PolarHBondContact OD1-OG1 3.4Å; D565-T567 PolarHBondContact OD2-OG1 3.02Å; D565-S583 PolarHBondContact O-OG 2.83Å
566	G	64.3	Low	66.9	Low	1 Å²	1	34.8 Å²	34.8	1%	0.01	20%	0.202	C	C	.	.	S	Bend	trans	81.8	13.1	-176.7	0	0	0	0	0	113.7	Y562 S563 T564 L568 W581	Y562-G566 VanDerWaalsContact CE2-O 3.29Å; Y562-G566 WeakPolarHBondContact CE2-O 3.41Å; S563-G566 WeakPolarHBondContact O-CA 3.48Å; S563-G566 PolarHBondContact O-N 2.85Å; T564-G566 PolarHBondContact O-N 3.44Å; G566-L568 PolarHBondContact O-N 3.1Å; G566-W581 WeakPolarHBondContact O-CZ3 3.42Å
567	T	69.3	Low	68.4	Low	19 Å²	19	32.2 Å²	32.2	12%	0.117	18%	0.184	C	C	.	.			trans	-76.3	121.1	175.1	-60.9	0	0	0	0	110.5	Y562 S563 D565 I580 W581 S582	Y562-T567 WeakPolarHBondContact CA-O 2.99Å; S563-T567 PolarHBondContact N-O 3.46Å; S563-T567 WeakPolarHBondContact OG-CA 3.47Å; S563-T567 WeakPolarHBondContact OG-CB 3.43Å; S563-T567 PolarHBondContact OG-N 3.42Å; S563-T567 PolarHBondContact OG-O 3.36Å; D565-T567 VanDerWaalsContact CG-OG1 3.31Å; D565-T567 WeakPolarHBondContact OD1-CB 3.46Å; D565-T567 PolarHBondContact OD1-N 3.48Å; D565-T567 VanDerWaalsContact OD1-N 3.1Å; D565-T567 PolarHBondContact OD1-OG1 3.4Å; D565-T567 PolarHBondContact OD2-OG1 3.02Å; T567-I580 HydrophobicContact CG2-CG2 3.93Å; T567-W581 CarbonylContact C-O 3.55Å; T567-W581 VanDerWaalsContact CA-O 3.23Å; T567-W581 WeakPolarHBondContact CA-O 3.29Å; T567-W581 WeakPolarHBondContact CG2-O 3.39Å; T567-S582 WeakPolarHBondContact OG1-CB 3.38Å; T567-S582 PolarHBondContact OG1-OG 3.21Å
568	L	77.3	Confident	69.6	Low	3 Å²	3	27.9 Å²	27.9	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.9	172	176.9	68.2	0	0	0	109.5	V439 M452 V560 Y562 G566 V570 I580 W581 I891	V439-L568 HydrophobicContact CG2-CD2 3.91Å; M452-L568 HydrophobicContact SD-CD1 3.96Å; V560-L568 HydrophobicContact CG1-CD1 3.52Å; Y562-L568 HydrophobicContact CD2-CB 3.86Å; Y562-L568 HydrophobicContact CD2-CD1 4.1Å; Y562-L568 HydrophobicContact CE2-CB 4.29Å; G566-L568 PolarHBondContact O-N 3.1Å; L568-V570 HydrophobicContact CG-CG2 4.35Å; L568-I580 CarbonylContact O-C 3.51Å; L568-I580 WeakPolarHBondContact O-CA 3.34Å; L568-W581 HydrophobicContact CB-CB 4.21Å; L568-W581 HydrophobicContact CB-CE3 4.33Å; L568-W581 PolarHBondContact N-O 2.85Å; L568-W581 PolarHBondContact O-N 2.91Å; L568-I891 HydrophobicContact CD2-CD1 3.95Å; L568-I891 HydrophobicContact CD2-CG1 4.49Å; L568-I891 HydrophobicContact CD2-CG2 4.17Å
569	T	79.3	Confident	70.6	Confident	25 Å²	25	26.5 Å²	26.5	15%	0.153	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.8	170.8	-53.8	0	0	0	0	109.5	V560 S561 R571 P577 I579 I580	V560-T569 WeakPolarHBondContact CA-O 3.08Å; S561-T569 PolarHBondContact N-O 2.86Å; S561-T569 PolarHBondContact O-N 2.86Å; S561-T569 WeakPolarHBondContact OG-CB 3.46Å; T569-R571 HydrophobicContact CG2-CG 4.31Å; T569-P577 HydrophobicContact CG2-CB 4.45Å; T569-I579 CarbonylContact C-O 3.57Å; T569-I579 VanDerWaalsContact CA-O 3.32Å; T569-I579 WeakPolarHBondContact CA-O 3.49Å; T569-I580 HydrophobicContact CG2-CG1 4.27Å
570	V	80.2	Confident	71.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.5	170.3	-175.4	0	0	0	0	107.9	W559 V560 L568 A578 I579 F881 L889 I891	W559-V570 WeakPolarHBondContact O-CA 3.32Å; V560-V570 HydrophobicContact CG1-CG2 4.44Å; V560-V570 HydrophobicContact CG2-CG1 4.39Å; V560-V570 HydrophobicContact CG2-CG2 4.35Å; L568-V570 HydrophobicContact CG-CG2 4.35Å; V570-A578 WeakPolarHBondContact O-CA 3.39Å; V570-A578 WeakPolarHBondContact O-CB 3.47Å; V570-A578 PolarHBondContact O-N 3.48Å; V570-I579 HydrophobicContact CB-CB 4.06Å; V570-I579 HydrophobicContact CB-CD1 4.27Å; V570-I579 HydrophobicContact CB-CG1 4.49Å; V570-I579 HydrophobicContact CG2-CB 4.36Å; V570-I579 HydrophobicContact CG2-CD1 4.45Å; V570-I579 PolarHBondContact N-O 3.12Å; V570-I579 PolarHBondContact O-N 3Å; V570-F881 HydrophobicContact CG1-CD1 4.07Å; V570-F881 HydrophobicContact CG1-CD2 4.4Å; V570-F881 HydrophobicContact CG1-CE1 4.18Å; V570-F881 HydrophobicContact CG1-CG 4.2Å; V570-F881 HydrophobicContact CG1-CZ 4.45Å; V570-L889 HydrophobicContact CG2-CD2 4.3Å; V570-I891 HydrophobicContact CG2-CD1 3.92Å
571	R	78.7	Confident	72	Confident	74 Å²	74	28.6 Å²	28.6	28%	0.279	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	151.5	-177.2	-66.2	-179.7	173.9	-146.6	7.7	111.5	P558 W559 T569 G575 S576	P558-R571 WeakPolarHBondContact O-CD 3.29Å; W559-R571 PolarHBondContact NE1-O 2.86Å; W559-R571 VanDerWaalsContact NE1-O 3.13Å; W559-R571 PolarHBondContact O-N 3.13Å; T569-R571 HydrophobicContact CG2-CG 4.31Å; R571-G575 WeakPolarHBondContact CD-O 3.49Å; R571-G575 PolarHBondContact NH1-O 2.75Å; R571-G575 VanDerWaalsContact NH1-O 3.13Å; R571-S576 CarbonylContact C-O 3.48Å; R571-S576 VanDerWaalsContact CA-O 3.29Å; R571-S576 WeakPolarHBondContact CA-O 3.47Å; R571-S576 WeakPolarHBondContact CB-O 3.32Å
572	Y	75.9	Confident	72.2	Confident	4 Å²	4	29.1 Å²	29.1	2%	0.016	17%	0.172	C	C	.	.			trans	-67.4	161.4	166.1	-68.5	-74.3	0	0	0	110.7	C574 G575 S576 A578 F666 I668 N864 Y866 I867 F881	Y572-C574 VanDerWaalsContact CB-SG 3.58Å; Y572-C574 PolarHBondContact O-N 3.09Å; Y572-C574 VanDerWaalsContact O-N 3.15Å; Y572-G575 PolarHBondContact O-N 3.03Å; Y572-S576 WeakPolarHBondContact CD2-OG 3.36Å; Y572-S576 PolarHBondContact N-O 3.05Å; Y572-A578 HydrophobicContact CD1-CB 4.2Å; Y572-A578 HydrophobicContact CD2-CB 3.54Å; Y572-A578 HydrophobicContact CE1-CB 4.05Å; Y572-A578 VanDerWaalsContact CE2-CA 3.48Å; Y572-A578 HydrophobicContact CE2-CB 3.38Å; Y572-A578 HydrophobicContact CG-CB 3.97Å; Y572-F666 PolarHBondContact OH-O 2.89Å; Y572-I668 HydrophobicContact CD1-CD1 4.34Å; Y572-I668 HydrophobicContact CD1-CG1 3.92Å; Y572-I668 HydrophobicContact CD2-CG1 4.27Å; Y572-I668 HydrophobicContact CE1-CD1 4.2Å; Y572-I668 HydrophobicContact CE1-CG1 3.68Å; Y572-I668 HydrophobicContact CE2-CG1 4.04Å; Y572-I668 HydrophobicContact CG-CG1 4.21Å; Y572-N864 PolarHBondContact OH-ND2 3.37Å; Y572-Y866 HydrophobicContact CD1-CD1 4.49Å; Y572-Y866 HydrophobicContact CD1-CD2 4.42Å; Y572-Y866 HydrophobicContact CD1-CG 4.19Å; Y572-Y866 HydrophobicContact CE1-CD2 4.18Å; Y572-Y866 HydrophobicContact CE1-CG 4.04Å; Y572-I867 HydrophobicContact CE1-CD1 4.37Å; Y572-I867 HydrophobicContact CE1-CG1 4.41Å; Y572-I867 WeakPolarHBondContact OH-CD1 3.22Å; Y572-F881 HydrophobicContact CD1-CE2 4.04Å; Y572-F881 AromaticContact CD1-CZ 4Å; Y572-F881 HydrophobicContact CD1-CZ 4Å; Y572-F881 AromaticContact CE1-CE2 3.94Å; Y572-F881 HydrophobicContact CE1-CE2 3.94Å; Y572-F881 HydrophobicContact CE1-CZ 4.35Å
573	P	65.8	Low	72.4	Confident	75 Å²	75	30 Å²	30	49%	0.487	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.8	173.5	-27.3	35.9	0	0	0	114	G575 T883	P573-G575 PolarHBondContact O-N 3.41Å; P573-T883 HydrophobicContact CG-CG2 4.11Å
574	C	67.7	Low	72.2	Confident	85 Å²	85	28.7 Å²	28.7	57%	0.574	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-0.5	174.3	61.1	0	0	0	0	114.6	Y572 S576	Y572-C574 VanDerWaalsContact CB-SG 3.58Å; Y572-C574 PolarHBondContact O-N 3.09Å; Y572-C574 VanDerWaalsContact O-N 3.15Å; C574-S576 PolarHBondContact SG-OG 2.78Å
575	G	66.9	Low	72.1	Confident	4 Å²	4	30.3 Å²	30.3	4%	0.041	18%	0.182	C	C	.	.	S	Bend	trans	88.6	-8.3	177.1	0	0	0	0	0	115.5	R571 Y572 P573	R571-G575 WeakPolarHBondContact CD-O 3.49Å; R571-G575 PolarHBondContact NH1-O 2.75Å; R571-G575 VanDerWaalsContact NH1-O 3.13Å; Y572-G575 PolarHBondContact O-N 3.03Å; P573-G575 PolarHBondContact O-N 3.41Å
576	S	73	Confident	71.5	Confident	11 Å²	11	32.8 Å²	32.8	8%	0.077	19%	0.194	C	C	.	.			trans	-76	146.1	176.9	66.5	0	0	0	0	111.9	R571 Y572 C574 A578 P669	R571-S576 CarbonylContact C-O 3.48Å; R571-S576 VanDerWaalsContact CA-O 3.29Å; R571-S576 WeakPolarHBondContact CA-O 3.47Å; R571-S576 WeakPolarHBondContact CB-O 3.32Å; Y572-S576 WeakPolarHBondContact CD2-OG 3.36Å; Y572-S576 PolarHBondContact N-O 3.05Å; C574-S576 PolarHBondContact SG-OG 2.78Å; S576-A578 PolarHBondContact O-N 3.4Å; S576-P669 VanDerWaalsContact OG-CD 3.23Å; S576-P669 WeakPolarHBondContact OG-CD 3.44Å
577	P	78	Confident	70.5	Confident	25 Å²	25	36.9 Å²	36.9	16%	0.162	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	136.2	178.1	27.1	-33.6	0	0	0	111.1	T569 I580 F666 I774	T569-P577 HydrophobicContact CG2-CB 4.45Å; P577-I580 HydrophobicContact CB-CD1 4.39Å; P577-F666 WeakPolarHBondContact O-CB 3.35Å; P577-I774 HydrophobicContact CG-CG1 4.45Å; P577-I774 HydrophobicContact CG-CG2 4.27Å
578	A	80.7	Confident	68.9	Low	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-48.8	179.4	0	0	0	0	0	111	V570 Y572 S576 I665 F666 I867 F881	V570-A578 WeakPolarHBondContact O-CA 3.39Å; V570-A578 WeakPolarHBondContact O-CB 3.47Å; V570-A578 PolarHBondContact O-N 3.48Å; Y572-A578 HydrophobicContact CD1-CB 4.2Å; Y572-A578 HydrophobicContact CD2-CB 3.54Å; Y572-A578 HydrophobicContact CE1-CB 4.05Å; Y572-A578 VanDerWaalsContact CE2-CA 3.48Å; Y572-A578 HydrophobicContact CE2-CB 3.38Å; Y572-A578 HydrophobicContact CG-CB 3.97Å; S576-A578 PolarHBondContact O-N 3.4Å; A578-I665 WeakPolarHBondContact O-CA 3.21Å; A578-F666 PolarHBondContact O-N 3.43Å; A578-I867 HydrophobicContact CB-CD1 4.09Å; A578-F881 HydrophobicContact CB-CD2 4.43Å; A578-F881 HydrophobicContact CB-CE2 3.68Å; A578-F881 HydrophobicContact CB-CZ 4.29Å
579	I	80.9	Confident	66.9	Low	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.2	-178.5	-56	163	0	0	0	108.2	T569 V570 L663 I867 I879 F881 I891	T569-I579 CarbonylContact C-O 3.57Å; T569-I579 VanDerWaalsContact CA-O 3.32Å; T569-I579 WeakPolarHBondContact CA-O 3.49Å; V570-I579 HydrophobicContact CB-CB 4.06Å; V570-I579 HydrophobicContact CB-CD1 4.27Å; V570-I579 HydrophobicContact CB-CG1 4.49Å; V570-I579 HydrophobicContact CG2-CB 4.36Å; V570-I579 HydrophobicContact CG2-CD1 4.45Å; V570-I579 PolarHBondContact N-O 3.12Å; V570-I579 PolarHBondContact O-N 3Å; I579-L663 HydrophobicContact CG2-CD1 3.67Å; I579-I867 HydrophobicContact CG1-CD1 4.1Å; I579-I879 HydrophobicContact CD1-CG2 3.65Å; I579-I879 HydrophobicContact CG1-CG2 4.43Å; I579-I879 HydrophobicContact CG2-CD1 3.95Å; I579-F881 HydrophobicContact CD1-CB 4.12Å; I579-F881 HydrophobicContact CD1-CD2 3.98Å; I579-F881 HydrophobicContact CD1-CG 4.38Å; I579-I891 HydrophobicContact CD1-CD1 4.18Å
580	I	81.5	Confident	64.9	Low	53 Å²	53	52.1 Å²	52.1	27%	0.272	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	113.7	169.1	-57.2	-178.5	0	0	0	108	T567 L568 T569 P577 L663 S664 F666	T567-I580 HydrophobicContact CG2-CG2 3.93Å; L568-I580 CarbonylContact O-C 3.51Å; L568-I580 WeakPolarHBondContact O-CA 3.34Å; T569-I580 HydrophobicContact CG2-CG1 4.27Å; P577-I580 HydrophobicContact CB-CD1 4.39Å; I580-L663 CarbonylContact O-C 3.58Å; I580-L663 WeakPolarHBondContact O-CA 3.32Å; I580-S664 PolarHBondContact N-O 3.27Å; I580-S664 PolarHBondContact O-N 3.17Å; I580-F666 HydrophobicContact CB-CE2 4.47Å; I580-F666 HydrophobicContact CD1-CE2 3.68Å; I580-F666 HydrophobicContact CD1-CZ 4.34Å; I580-F666 HydrophobicContact CG1-CE2 3.95Å
581	W	80.8	Confident	62.7	Low	1 Å²	1	56.2 Å²	56.2	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.5	173.2	177.3	94.3	0	0	0	109.1	V439 F441 Y562 G566 T567 L568 F661 Y662 L663 C893	V439-W581 HydrophobicContact CG1-CD2 3.91Å; V439-W581 HydrophobicContact CG1-CE3 3.57Å; V439-W581 HydrophobicContact CG1-CH2 3.8Å; V439-W581 HydrophobicContact CG1-CZ2 4.11Å; V439-W581 HydrophobicContact CG1-CZ3 3.5Å; F441-W581 HydrophobicContact CE2-CH2 4.33Å; F441-W581 HydrophobicContact CE2-CZ2 4.13Å; F441-W581 HydrophobicContact CZ-CH2 4.01Å; F441-W581 HydrophobicContact CZ-CZ2 4.15Å; Y562-W581 HydrophobicContact CE2-CZ3 4.5Å; G566-W581 WeakPolarHBondContact O-CZ3 3.42Å; T567-W581 CarbonylContact C-O 3.55Å; T567-W581 VanDerWaalsContact CA-O 3.23Å; T567-W581 WeakPolarHBondContact CA-O 3.29Å; T567-W581 WeakPolarHBondContact CG2-O 3.39Å; L568-W581 HydrophobicContact CB-CB 4.21Å; L568-W581 HydrophobicContact CB-CE3 4.33Å; L568-W581 PolarHBondContact N-O 2.85Å; L568-W581 PolarHBondContact O-N 2.91Å; W581-F661 AromaticContact CD1-CD2 3.8Å; W581-F661 HydrophobicContact CZ2-CB 3.89Å; W581-F661 AromaticContact NE1-CD2 3.44Å; W581-F661 AromaticContact NE1-CG 3.45Å; W581-Y662 CarbonylContact C-O 3.46Å; W581-Y662 WeakPolarHBondContact CA-O 3.36Å; W581-L663 HydrophobicContact CB-CD1 4.12Å; W581-C893 VanDerWaalsContact CD1-SG 3.59Å
582	S	74.6	Confident	60.3	Low	31 Å²	31	57.8 Å²	57.8	22%	0.217	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.2	179.5	-172.1	0	0	0	0	111.3	T567 Y662	T567-S582 WeakPolarHBondContact OG1-CB 3.38Å; T567-S582 PolarHBondContact OG1-OG 3.21Å; S582-Y662 PolarHBondContact N-O 2.82Å; S582-Y662 PolarHBondContact O-N 3.3Å
583	S	67.8	Low	58.2	Low	22 Å²	22	64.5 Å²	64.5	15%	0.154	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	141.5	176.9	68.9	0	0	0	0	112.2	F441 D565 P585	F441-S583 VanDerWaalsContact CE1-CB 3.43Å; F441-S583 VanDerWaalsContact CZ-CB 3.48Å; D565-S583 PolarHBondContact O-OG 2.83Å; S583-P585 WeakPolarHBondContact O-CD 3.23Å
584	S	61.1	Low	56.4	Low	8 Å²	8	67.2 Å²	67.2	6%	0.056	37%	0.367	C	S	.	.			trans	-91.8	116.5	169.2	-175.5	0	0	0	0	110.5	R448 L586 G660	R448-S584 PolarHBondContact NH1-O 2.95Å; S584-L586 VanDerWaalsContact C-N 3.3Å; S584-G660 PolarHBondContact N-O 2.89Å
585	P	51.6	Low	54.6	Low	117 Å²	117	70.3 Å²	70.3	76%	0.76	38%	0.377	S	S	*	.			trans	-72.4	-24.2	177.5	26.9	-32	0	0	0	112.6	S583	S583-P585 WeakPolarHBondContact O-CD 3.23Å
586	L	45.7	Very low	52.7	Low	131 Å²	131	77.4 Å²	77.4	69%	0.686	41%	0.414	S	S	*	.	S	Bend	trans	-87.5	133.4	-173.8	-66.7	168	0	0	0	111.3	S584 Y588	S584-L586 VanDerWaalsContact C-N 3.3Å; L586-Y588 PolarHBondContact O-N 3.35Å; L586-Y588 VanDerWaalsContact O-N 3.14Å
587	I	43.3	Very low	50.5	Low	86 Å²	86	82.9 Å²	82.9	44%	0.441	44%	0.442	S	S	.	.			trans	-61	112.9	164.2	-59.4	171.7	0	0	0	105.8	H589 H657	I587-H589 PolarHBondContact O-N 2.84Å; I587-H589 VanDerWaalsContact O-N 3.15Å; I587-H657 HydrophobicContact CG2-CB 4.28Å
588	Y	35.5	Very low	47.9	Very low	95 Å²	95	86.7 Å²	86.7	37%	0.373	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-70	113.4	178.1	-177.3	-101	0	0	0	108.7	L586	L586-Y588 PolarHBondContact O-N 3.35Å; L586-Y588 VanDerWaalsContact O-N 3.14Å
589	H	36.3	Very low	45.2	Very low	130 Å²	130	94 Å²	94	60%	0.602	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-83.8	121.7	165.9	-68.4	-72.7	0	0	0	107.2	I587	I587-H589 PolarHBondContact O-N 2.84Å; I587-H589 VanDerWaalsContact O-N 3.15Å
590	K	36.1	Very low	42.3	Very low	142 Å²	142	99 Å²	99	62%	0.617	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-53.6	127.5	168.1	-160.9	-175.8	178.2	-159.7	0	106	C592 E593	K590-C592 PolarHBondContact O-N 3.19Å; K590-C592 VanDerWaalsContact O-N 3.11Å; K590-E593 WeakPolarHBondContact CE-OE1 3.42Å; K590-E593 IonicContact NZ-OE1 2.74Å; K590-E593 PolarHBondContact NZ-OE1 2.89Å
591	P	35.6	Very low	39.4	Very low	87 Å²	87	101.6 Å²	101.6	57%	0.565	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-50.4	126.5	168.3	-20.4	30	0	0	0	106.1	E593	P591-E593 PolarHBondContact O-N 3.37Å
592	C	28.4	Very low	36.6	Very low	107 Å²	107	107.2 Å²	107.2	72%	0.723	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-51.2	117.6	169.4	-74.8	0	0	0	0	105.2	K590 N594	K590-C592 PolarHBondContact O-N 3.19Å; K590-C592 VanDerWaalsContact O-N 3.11Å; C592-N594 PolarHBondContact O-N 3.19Å
593	E	30	Very low	34.1	Very low	145 Å²	145	111.5 Å²	111.5	68%	0.678	63%	0.631	S	S	*	*			trans	-57.8	93	157.2	-78.9	162.9	-154.3	0	0	102.8	K590 P591 L595	K590-E593 WeakPolarHBondContact CE-OE1 3.42Å; K590-E593 IonicContact NZ-OE1 2.74Å; K590-E593 PolarHBondContact NZ-OE1 2.89Å; P591-E593 PolarHBondContact O-N 3.37Å; E593-L595 PolarHBondContact O-N 2.81Å
594	N	29.7	Very low	31.9	Very low	131 Å²	131	118.2 Å²	118.2	70%	0.701	67%	0.665	S	S	*	*			trans	-55.1	108.9	160	-71.1	-26.1	0	0	0	101.5	C592 D596	C592-N594 PolarHBondContact O-N 3.19Å; N594-D596 PolarHBondContact O-N 2.82Å
595	L	29.4	Very low	30.1	Very low	150 Å²	150	127.5 Å²	127.5	79%	0.785	70%	0.704	S	S	*	*			trans	-44.3	108.7	159.9	-116.3	74.7	0	0	0	103.5	E593 N597	E593-L595 PolarHBondContact O-N 2.81Å; L595-N597 PolarHBondContact O-N 2.86Å
596	D	25.8	Very low	28.6	Very low	154 Å²	154	125.4 Å²	125.4	82%	0.824	70%	0.703	S	S	*	*			trans	-58.9	90.9	165.7	-76.6	-37.8	0	0	0	103.7	N594 S598	N594-D596 PolarHBondContact O-N 2.82Å; D596-S598 PolarHBondContact O-N 2.92Å
597	N	26.6	Very low	27.6	Very low	126 Å²	126	129.3 Å²	129.3	67%	0.674	72%	0.715	S	S	*	*			trans	-58.9	101.7	156.2	-82.1	-13.3	0	0	0	103.1	L595 D599	L595-N597 PolarHBondContact O-N 2.86Å; N597-D599 PolarHBondContact O-N 2.85Å
598	S	24.3	Very low	26.6	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	73%	0.731	S	S	*	*			trans	-51.8	73.7	161.4	53.6	0	0	0	0	109.2	D596 S600	D596-S598 PolarHBondContact O-N 2.92Å; S598-S600 PolarHBondContact O-N 2.84Å
599	D	23.5	Very low	25.9	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	75%	0.751	S	S	*	*			trans	-81.6	80.1	160.8	-80.7	-14.9	0	0	0	105.6	N597 S601	N597-D599 PolarHBondContact O-N 2.85Å; D599-S601 PolarHBondContact O-N 3.26Å
600	S	21.4	Very low	25.4	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	77%	0.765	S	S	*	*			trans	-46.3	115.1	163.1	34.5	0	0	0	0	108.8	S598 S602	S598-S600 PolarHBondContact O-N 2.84Å; S600-S602 PolarHBondContact O-N 3.48Å
601	S	19.4	Very low	24.7	Very low	109 Å²	109	134.7 Å²	134.7	76%	0.762	77%	0.769	S	S	*	*			trans	-30.3	100.8	160.7	55.3	0	0	0	0	112.2	D599	D599-S601 PolarHBondContact O-N 3.26Å
602	S	21.9	Very low	24	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	78%	0.782	S	S	*	*			trans	-97.4	95.4	155.7	59.1	0	0	0	0	107.4	S600 N604	S600-S602 PolarHBondContact O-N 3.48Å; S602-N604 PolarHBondContact O-N 3.42Å
603	V	22.2	Very low	23.7	Very low	122 Å²	122	143 Å²	143	74%	0.739	79%	0.791	S	S	*	*			trans	-48.3	126.1	174.7	171.2	0	0	0	0	110.3	K605	V603-K605 PolarHBondContact O-N 2.76Å
604	N	21.1	Very low	23.3	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	79%	0.793	S	S	*	*			trans	-39.3	99.6	163.9	-78.4	-39.3	0	0	0	111.7	S602 G606	S602-N604 PolarHBondContact O-N 3.42Å; N604-G606 PolarHBondContact O-N 2.8Å
605	K	24.7	Very low	22.9	Very low	203 Å²	203	144.4 Å²	144.4	88%	0.883	80%	0.8	S	S	*	*			trans	-84.6	97	158.9	-80.2	-173.2	177.5	176.6	0	107.9	V603 K607	V603-K605 PolarHBondContact O-N 2.76Å; K605-K607 PolarHBondContact O-N 2.8Å
606	G	20.3	Very low	22.7	Very low	72 Å²	72	146.7 Å²	146.7	74%	0.742	81%	0.807	S	S	*	*			trans	-52.3	132	166.3	0	0	0	0	0	110.8	N604	N604-G606 PolarHBondContact O-N 2.8Å
607	K	24.3	Very low	22.4	Very low	213 Å²	213	148.5 Å²	148.5	93%	0.926	81%	0.808	S	S	*	*			trans	-127.2	111.4	158.9	-98.4	-177.3	176.9	176.7	0	108.8	K605	K605-K607 PolarHBondContact O-N 2.8Å
608	V	21.8	Very low	22.2	Very low	128 Å²	128	149.7 Å²	149.7	78%	0.776	81%	0.814	S	S	*	*			trans	-65.4	133.6	179.8	170.7	0	0	0	0	111.4
609	N	20.3	Very low	22.2	Very low	148 Å²	148	153.9 Å²	153.9	79%	0.791	82%	0.822	S	S	*	*			trans	20.1	112.7	145.6	-57.6	-18.1	0	0	0	119.4
610	K	25.5	Very low	22	Very low	205 Å²	205	151.9 Å²	151.9	89%	0.891	82%	0.819	S	S	*	*			trans	-138.1	98.6	144.6	-75.9	-173.9	176.6	-179.3	0	106.7
611	A	21.8	Very low	22.2	Very low	86 Å²	86	152.6 Å²	152.6	71%	0.711	82%	0.821	S	S	*	*				58.1	108.8	86.7	0	0	0	0	0	114.4
612	N	21.5	Very low	22.1	Very low	158 Å²	158	153.6 Å²	153.6	85%	0.845	83%	0.827	S	S	*	*			trans	61	108	145.3	-62.2	-13	0	0	0	120.4
613	K	22.8	Very low	22.3	Very low	210 Å²	210	155.2 Å²	155.2	91%	0.913	83%	0.825	S	S	*	*				-175.1	135.1	117.9	-101.7	170.6	-176.3	-177.8	0	111.8
614	P	21.5	Very low	22.3	Very low	111 Å²	111	155 Å²	155	72%	0.721	83%	0.826	S	S	*	*			trans	-102.2	164.8	-177.4	40.3	-33.9	0	0	0	113.2
615	K	20.4	Very low	22.4	Very low	195 Å²	195	155.6 Å²	155.6	85%	0.848	83%	0.828	S	S	*	*			trans	67.4	105.3	159.1	-65.5	172	-178.6	-179.2	0	117.6
616	Q	25.9	Very low	22.3	Very low	198 Å²	198	155 Å²	155	93%	0.925	83%	0.828	S	S	*	*			trans	-157.2	128.5	135.1	-107.2	166.4	17.8	0	0	109.8
617	F	19.8	Very low	22.3	Very low	192 Å²	192	161.7 Å²	161.7	84%	0.842	84%	0.837	S	S	*	*			trans	-81.5	157.3	-179.4	-98	-94.3	0	0	0	111.3
618	L	21.5	Very low	22.1	Very low	151 Å²	151	157 Å²	157	79%	0.791	83%	0.831	S	S	*	*			trans	67.2	108.3	148.9	-68.4	156.1	0	0	0	118.9
619	Q	24.4	Very low	22.1	Very low	193 Å²	193	157.1 Å²	157.1	90%	0.902	83%	0.832	S	S	*	*				168	114	115.7	-92.4	175.3	-8.6	0	0	111
620	S	20.1	Very low	22.2	Very low	110 Å²	110	156.3 Å²	156.3	77%	0.769	83%	0.833	S	S	*	*			trans	-68.3	163.1	149.1	45.4	0	0	0	0	110
621	P	24.5	Very low	21.9	Very low	119 Å²	119	153.7 Å²	153.7	77%	0.773	83%	0.829	S	S	*	*			cis	-138.4	171.5	17.6	35.2	-13.3	0	0	0	116.2
622	C	18.6	Very low	21.8	Very low	130 Å²	130	156.1 Å²	156.1	88%	0.878	83%	0.834	S	S	*	*			trans	-45.2	131.2	172.9	-85.1	0	0	0	0	115.5
623	I	24.5	Very low	21.7	Very low	152 Å²	152	154.7 Å²	154.7	78%	0.779	83%	0.831	S	S	*	*			trans	-111.5	129.9	154.4	-62.9	174.9	0	0	0	107.4
624	P	22.9	Very low	21.7	Very low	117 Å²	117	152.1 Å²	152.1	76%	0.76	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-80.2	127.2	-173.9	28.5	-28.2	0	0	0	112
625	L	23	Very low	21.6	Very low	176 Å²	176	152.8 Å²	152.8	92%	0.921	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70.3	129.3	178	-112.8	88.1	0	0	0	111.7
626	Q	22.7	Very low	21.6	Very low	191 Å²	191	149.7 Å²	149.7	89%	0.893	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-66.9	137.8	178.5	-73.2	169.8	-28.5	0	0	112.4
627	K	21.4	Very low	21.4	Very low	212 Å²	212	147 Å²	147	92%	0.922	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-76	125.9	172.7	-72.5	175	174.2	178	0	110.1
628	S	19.8	Very low	21.4	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-85.2	133.9	167.3	54	0	0	0	0	111.4
629	T	20.4	Very low	21.4	Very low	131 Å²	131	141.6 Å²	141.6	80%	0.804	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-56.3	132.1	174.7	15.1	0	0	0	0	115.1
630	T	22.2	Very low	21.3	Very low	131 Å²	131	139 Å²	139	80%	0.804	81%	0.814	S	S	*	*			trans	-154.8	97	145.9	27.2	0	0	0	0	111
631	N	21.2	Very low	21.3	Very low	151 Å²	151	141.5 Å²	141.5	81%	0.807	82%	0.817	S	S	*	*			trans	40.8	99.9	142.9	-56.5	-13.1	0	0	0	119.7
632	V	19.6	Very low	21.3	Very low	137 Å²	137	143.1 Å²	143.1	83%	0.83	82%	0.82	S	S	*	*			trans	-95.8	127.4	159.3	172.4	0	0	0	0	108.3
633	T	19.2	Very low	21.4	Very low	127 Å²	127	141.8 Å²	141.8	78%	0.779	81%	0.811	S	S	*	*			trans	-132.4	93.4	167	-39.1	0	0	0	0	107.8
634	I	21.3	Very low	21.2	Very low	157 Å²	157	140.1 Å²	140.1	81%	0.805	81%	0.813	S	S	*	*			trans	-132.1	117.3	164.2	-59.1	-179.9	0	0	0	107.1
635	T	20.8	Very low	21.1	Very low	125 Å²	125	139.9 Å²	139.9	77%	0.767	81%	0.814	S	S	*	*			trans	-68.4	134.3	-172.1	-43.1	0	0	0	0	111.4
636	T	20.8	Very low	21	Very low	130 Å²	130	135 Å²	135	80%	0.798	81%	0.807	S	S	*	*			trans	-64.2	124.3	177.5	40.3	0	0	0	0	113.5
637	T	21.7	Very low	21	Very low	140 Å²	140	133.2 Å²	133.2	86%	0.859	80%	0.802	S	S	*	*			trans	-126	113.8	146.1	44.6	0	0	0	0	108.8
638	S	19.2	Very low	21	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	79%	0.791	S	S	*	*			trans	-59.5	131.7	174.6	45.2	0	0	0	0	113.2
639	T	21.7	Very low	21.1	Very low	127 Å²	127	131.4 Å²	131.4	78%	0.779	80%	0.796	S	S	*	*				169	139	116.7	33.8	0	0	0	0	112.7
640	T	22.9	Very low	21.3	Very low	137 Å²	137	132.6 Å²	132.6	84%	0.84	80%	0.796	S	S	*	*			trans	67.2	104.3	158.8	54.5	0	0	0	0	120
641	I	19.4	Very low	21.3	Very low	163 Å²	163	129.4 Å²	129.4	84%	0.836	79%	0.79	S	S	*	*			trans	-66.5	126.6	161.7	-63	157.8	0	0	0	109
642	N	23.2	Very low	21.5	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	78%	0.784	S	S	*	*			trans	-150.6	116.1	148	-106.4	-16.8	0	0	0	111.6
643	S	21.1	Very low	21.9	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	78%	0.784	S	S	*	*			trans	9.8	119.9	160.7	48.7	0	0	0	0	120.8
644	S	19.9	Very low	22.3	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	78%	0.784	S	S	*	*			trans	-32.8	130.7	151.6	53.6	0	0	0	0	116.9
645	S	21.8	Very low	22.8	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	78%	0.775	S	S	*	*			trans	-146.5	106.3	130.6	56	0	0	0	0	108.6	I647	S645-I647 PolarHBondContact O-N 2.8Å
646	G	20.5	Very low	23.4	Very low	75 Å²	75	127.9 Å²	127.9	77%	0.773	77%	0.767	S	S	*	*			trans	-67.9	114.4	172.7	0	0	0	0	0	109	P648	G646-P648 VanDerWaalsContact O-CD 3.31Å; G646-P648 WeakPolarHBondContact O-CD 3.48Å
647	I	22.9	Very low	24.2	Very low	152 Å²	152	127.8 Å²	127.8	78%	0.779	76%	0.757	S	S	*	*			trans	-70.6	115.5	173.5	-61.6	168.8	0	0	0	107.3	S645 M649	S645-I647 PolarHBondContact O-N 2.8Å; I647-M649 PolarHBondContact O-N 2.9Å
648	P	22.2	Very low	25.2	Very low	108 Å²	108	125.1 Å²	125.1	70%	0.701	73%	0.731	S	S	*	*			trans	-72.4	121.6	167.4	2.6	14.1	0	0	0	107.5	G646 L650	G646-P648 VanDerWaalsContact O-CD 3.31Å; G646-P648 WeakPolarHBondContact O-CD 3.48Å; P648-L650 PolarHBondContact O-N 3.31Å
649	M	21.5	Very low	26.7	Very low	180 Å²	180	121.1 Å²	121.1	89%	0.887	70%	0.703	S	S	*	*			trans	-53.7	114.3	176.6	-83.5	-153.1	81.6	0	0	111.1	I647 G651	I647-M649 PolarHBondContact O-N 2.9Å; M649-G651 PolarHBondContact O-N 2.84Å
650	L	24	Very low	28.7	Very low	157 Å²	157	115.1 Å²	115.1	82%	0.822	67%	0.666	S	S	*	*			trans	-67.5	79.7	163.9	-100.5	87.5	0	0	0	109.4	P648 T652	P648-L650 PolarHBondContact O-N 3.31Å; L650-T652 PolarHBondContact O-N 2.65Å
651	G	23.3	Very low	30.9	Very low	64 Å²	64	109.1 Å²	109.1	66%	0.66	63%	0.628	S	S	*	*			trans	-83.8	52.4	166.5	0	0	0	0	0	111.7	M649 Q653	M649-G651 PolarHBondContact O-N 2.84Å; G651-Q653 PolarHBondContact O-N 3.29Å
652	T	25.2	Very low	33.6	Very low	113 Å²	113	106.2 Å²	106.2	69%	0.693	61%	0.607	S	S	*	*			trans	-80.3	75.9	167.7	37.7	0	0	0	0	108.1	L650 N654	L650-T652 PolarHBondContact O-N 2.65Å; T652-N654 PolarHBondContact O-N 2.86Å
653	Q	28.3	Very low	36.2	Very low	178 Å²	178	98.9 Å²	98.9	83%	0.832	57%	0.568	S	S	*	*			trans	-56.6	123.3	169.6	-75.3	-177	-3.9	0	0	108.5	G651 V655	G651-Q653 PolarHBondContact O-N 3.29Å; Q653-V655 PolarHBondContact O-N 2.54Å
654	N	26.8	Very low	39.1	Very low	146 Å²	146	95.1 Å²	95.1	78%	0.781	54%	0.542	S	S	*	.			trans	-45.7	101.2	173.8	-71.7	-42.8	0	0	0	110.5	T652 Q656	T652-N654 PolarHBondContact O-N 2.86Å; N654-Q656 PolarHBondContact O-N 3.42Å
655	V	30.6	Very low	42	Very low	102 Å²	102	89.5 Å²	89.5	62%	0.618	50%	0.503	S	S	*	.			trans	-68.2	88	167	-179.2	0	0	0	0	106	Q653 H657	Q653-V655 PolarHBondContact O-N 2.54Å; V655-H657 PolarHBondContact O-N 3.13Å
656	Q	33.8	Very low	44.9	Very low	125 Å²	125	85.8 Å²	85.8	58%	0.584	47%	0.473	S	S	*	.			trans	-58.5	106.6	172.7	-72.7	-178.4	-14.8	0	0	107.1	N654 R658	N654-Q656 PolarHBondContact O-N 3.42Å; Q656-R658 VanDerWaalsContact C-N 3.33Å; Q656-R658 HydrophobicContact CB-CG 4.41Å; Q656-R658 PolarHBondContact O-N 3.36Å; Q656-R658 VanDerWaalsContact OE1-NH2 3.14Å
657	H	38.5	Very low	47.5	Very low	129 Å²	129	82.4 Å²	82.4	60%	0.597	44%	0.438	S	S	*	.			trans	-65.4	93.7	172.6	-67.7	-71.9	0	0	0	108.4	I587 V655	I587-H657 HydrophobicContact CG2-CB 4.28Å; V655-H657 PolarHBondContact O-N 3.13Å
658	R	42.1	Very low	49.9	Very low	84 Å²	84	78.6 Å²	78.6	32%	0.317	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-83.2	138.3	179.7	-69.9	-177.7	-179.7	-145.9	-7.6	110.6	Q656	Q656-R658 VanDerWaalsContact C-N 3.33Å; Q656-R658 HydrophobicContact CB-CG 4.41Å; Q656-R658 PolarHBondContact O-N 3.36Å; Q656-R658 VanDerWaalsContact OE1-NH2 3.14Å
659	T	50.4	Low	52	Low	20 Å²	20	74.5 Å²	74.5	12%	0.123	39%	0.392	C	S	.	.			trans	-107	144	176.8	66.3	0	0	0	0	109.1	Q895 N896	T659-Q895 PolarHBondContact O-OE1 2.89Å; T659-Q895 VanDerWaalsContact O-OE1 3.11Å; T659-N896 PolarHBondContact OG1-O 2.71Å; T659-N896 VanDerWaalsContact OG1-O 3.06Å
660	G	63.8	Low	53.9	Low	1 Å²	1	72.8 Å²	72.8	1%	0.01	38%	0.375	C	S	.	.			trans	-147.1	-175	179.9	0	0	0	0	0	114.9	R448 S584 P783	R448-G660 PolarHBondContact NH2-O 3.14Å; R448-G660 VanDerWaalsContact NH2-O 3.15Å; S584-G660 PolarHBondContact N-O 2.89Å; G660-P783 WeakPolarHBondContact CA-O 3.15Å
661	F	70.4	Confident	55.1	Low	10 Å²	10	71.5 Å²	71.5	4%	0.044	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.9	-177	62.8	-96.1	0	0	0	111.4	W581 L663 T782 P783 L877 C893 Q895	W581-F661 AromaticContact CD1-CD2 3.8Å; W581-F661 HydrophobicContact CZ2-CB 3.89Å; W581-F661 AromaticContact NE1-CD2 3.44Å; W581-F661 AromaticContact NE1-CG 3.45Å; F661-L663 HydrophobicContact CD2-CB 4.13Å; F661-L663 HydrophobicContact CE2-CB 4.03Å; F661-T782 CarbonylContact O-C 3.41Å; F661-P783 VanDerWaalsContact O-CA 3.29Å; F661-P783 WeakPolarHBondContact O-CA 3.17Å; F661-P783 VanDerWaalsContact O-N 3.1Å; F661-L877 HydrophobicContact CZ-CB 4.27Å; F661-C893 HydrophobicContact CE1-CB 4.37Å; F661-C893 HydrophobicContact CE2-CB 4.39Å; F661-C893 HydrophobicContact CZ-CB 4.14Å; F661-Q895 HydrophobicContact CD1-CG 3.75Å; F661-Q895 HydrophobicContact CE1-CG 3.79Å
662	Y	74.9	Confident	55.7	Low	103 Å²	103	75.4 Å²	75.4	40%	0.404	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139	166.8	-69.4	-85.5	0	0	0	109.5	W581 S582 F781 P783	W581-Y662 CarbonylContact C-O 3.46Å; W581-Y662 WeakPolarHBondContact CA-O 3.36Å; S582-Y662 PolarHBondContact N-O 2.82Å; S582-Y662 PolarHBondContact O-N 3.3Å; Y662-F781 WeakPolarHBondContact CA-O 3.31Å; Y662-P783 HydrophobicContact CD1-CG 4.31Å; Y662-P783 HydrophobicContact CD2-CG 3.89Å; Y662-P783 HydrophobicContact CE1-CG 3.94Å; Y662-P783 HydrophobicContact CE2-CG 3.47Å; Y662-P783 VanDerWaalsContact CE2-CG 3.47Å; Y662-P783 HydrophobicContact CG-CG 4.28Å; Y662-P783 VanDerWaalsContact CZ-CD 3.47Å; Y662-P783 VanDerWaalsContact CZ-CG 3.49Å
663	L	78.2	Confident	55.9	Low	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	125.2	175.4	171	69.4	0	0	0	109.9	I579 I580 W581 F661 I665 H780 F781 L877 I879	I579-L663 HydrophobicContact CG2-CD1 3.67Å; I580-L663 CarbonylContact O-C 3.58Å; I580-L663 WeakPolarHBondContact O-CA 3.32Å; W581-L663 HydrophobicContact CB-CD1 4.12Å; F661-L663 HydrophobicContact CD2-CB 4.13Å; F661-L663 HydrophobicContact CE2-CB 4.03Å; L663-I665 HydrophobicContact CD1-CG1 4.44Å; L663-I665 HydrophobicContact CD2-CD1 4.4Å; L663-I665 HydrophobicContact CG-CG1 4.32Å; L663-H780 CarbonylContact O-C 3.57Å; L663-H780 VanDerWaalsContact O-CA 3.26Å; L663-H780 WeakPolarHBondContact O-CA 3.46Å; L663-F781 HydrophobicContact CB-CB 4.18Å; L663-F781 HydrophobicContact CB-CD2 4.4Å; L663-F781 HydrophobicContact CD2-CD2 3.88Å; L663-F781 HydrophobicContact CD2-CE2 4.42Å; L663-F781 HydrophobicContact CG-CD2 4.3Å; L663-F781 PolarHBondContact N-O 3.02Å; L663-F781 PolarHBondContact O-N 3.47Å; L663-L877 HydrophobicContact CD2-CD1 4.23Å; L663-L877 HydrophobicContact CD2-CD2 3.33Å; L663-L877 HydrophobicContact CD2-CG 4.43Å; L663-I879 HydrophobicContact CD1-CD1 3.46Å; L663-I879 VanDerWaalsContact CD1-CD1 3.46Å; L663-I879 HydrophobicContact CD2-CD1 3.54Å; L663-I879 HydrophobicContact CD2-CG1 4.29Å; L663-I879 HydrophobicContact CG-CD1 4.13Å
664	S	82.1	Confident	56	Low	22 Å²	22	76.1 Å²	76.1	15%	0.154	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.6	175.3	-54.9	0	0	0	0	110.3	I580 A779 H780	I580-S664 PolarHBondContact N-O 3.27Å; I580-S664 PolarHBondContact O-N 3.17Å; S664-A779 CarbonylContact C-O 3.56Å; S664-A779 WeakPolarHBondContact CA-O 3.34Å; S664-H780 PolarHBondContact OG-ND1 3.24Å
665	I	81.5	Confident	55.9	Low	0 Å²	0	78.2 Å²	78.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.9	-178.6	-54.4	177.8	0	0	0	109.1	A578 L663 I778 A779 L863 I867 L869	A578-I665 WeakPolarHBondContact O-CA 3.21Å; L663-I665 HydrophobicContact CD1-CG1 4.44Å; L663-I665 HydrophobicContact CD2-CD1 4.4Å; L663-I665 HydrophobicContact CG-CG1 4.32Å; I665-I778 PolarHBondContact O-N 3.07Å; I665-A779 HydrophobicContact CB-CB 4.15Å; I665-A779 HydrophobicContact CD1-CB 4.2Å; I665-A779 HydrophobicContact CG1-CB 4.39Å; I665-A779 PolarHBondContact N-O 3.3Å; I665-A779 PolarHBondContact O-N 3.14Å; I665-L863 HydrophobicContact CB-CD1 4.25Å; I665-L863 HydrophobicContact CD1-CD1 3.69Å; I665-L863 HydrophobicContact CG2-CD1 3.72Å; I665-I867 HydrophobicContact CG2-CD1 3.66Å; I665-I867 HydrophobicContact CG2-CG2 4.11Å; I665-L869 HydrophobicContact CD1-CD1 4.31Å; I665-L869 HydrophobicContact CD1-CD2 4.38Å
666	F	81.8	Confident	55.6	Low	33 Å²	33	78.3 Å²	78.3	15%	0.145	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	149.4	-175.6	-61.3	-88.1	0	0	0	111.8	Y572 P577 A578 I580 I774 P776 L777	Y572-F666 PolarHBondContact OH-O 2.89Å; P577-F666 WeakPolarHBondContact O-CB 3.35Å; A578-F666 PolarHBondContact O-N 3.43Å; I580-F666 HydrophobicContact CB-CE2 4.47Å; I580-F666 HydrophobicContact CD1-CE2 3.68Å; I580-F666 HydrophobicContact CD1-CZ 4.34Å; I580-F666 HydrophobicContact CG1-CE2 3.95Å; F666-I774 HydrophobicContact CD1-CG2 3.87Å; F666-I774 HydrophobicContact CE1-CG2 4.12Å; F666-I774 HydrophobicContact CG-CG2 4.47Å; F666-P776 WeakPolarHBondContact CA-O 3.4Å; F666-L777 HydrophobicContact CD1-CB 4.38Å; F666-L777 HydrophobicContact CD1-CD1 4.13Å; F666-L777 HydrophobicContact CE1-CB 4.32Å; F666-L777 HydrophobicContact CE1-CD1 3.77Å; F666-L777 HydrophobicContact CZ-CD1 4Å
667	G	74.2	Confident	55.1	Low	4 Å²	4	80.8 Å²	80.8	4%	0.041	40%	0.398	C	S	.	.			trans	-76.4	174.3	171.4	0	0	0	0	0	113.1	G775 P776	G667-G775 WeakPolarHBondContact O-CA 3.41Å; G667-P776 PolarHBondContact N-O 2.96Å
668	I	73.4	Confident	54.6	Low	71 Å²	71	79.8 Å²	79.8	36%	0.364	40%	0.401	S	S	.	.			trans	-74.8	135.6	170.2	-60.2	172	0	0	0	107.7	Y572 R670 Y866	Y572-I668 HydrophobicContact CD1-CD1 4.34Å; Y572-I668 HydrophobicContact CD1-CG1 3.92Å; Y572-I668 HydrophobicContact CD2-CG1 4.27Å; Y572-I668 HydrophobicContact CE1-CD1 4.2Å; Y572-I668 HydrophobicContact CE1-CG1 3.68Å; Y572-I668 HydrophobicContact CE2-CG1 4.04Å; Y572-I668 HydrophobicContact CG-CG1 4.21Å; I668-R670 PolarHBondContact O-N 2.95Å; I668-Y866 HydrophobicContact CD1-CD2 3.63Å; I668-Y866 HydrophobicContact CD1-CE2 3.42Å; I668-Y866 VanDerWaalsContact CD1-CE2 3.42Å
669	P	68.1	Low	53.6	Low	23 Å²	23	83.9 Å²	83.9	15%	0.149	43%	0.429	C	S	.	.			trans	-58.5	131.8	174.6	-18.4	30.1	0	0	0	110.2	S576 V671 N773	S576-P669 VanDerWaalsContact OG-CD 3.23Å; S576-P669 WeakPolarHBondContact OG-CD 3.44Å; P669-V671 PolarHBondContact O-N 2.97Å; P669-N773 HydrophobicContact CB-CB 4Å; P669-N773 VanDerWaalsContact CB-O 3.25Å; P669-N773 WeakPolarHBondContact CB-O 3.4Å; P669-N773 WeakPolarHBondContact CG-O 3.21Å
670	R	59.7	Low	52.4	Low	143 Å²	143	88 Å²	88	54%	0.54	45%	0.454	S	S	.	.			trans	-74.5	107.3	168.8	-70.5	-176.6	176.9	165.2	1.7	107.4	I668 L672 H793	I668-R670 PolarHBondContact O-N 2.95Å; R670-L672 PolarHBondContact O-N 2.85Å; R670-L672 VanDerWaalsContact O-N 3.11Å; R670-H793 VanDerWaalsContact CZ-O 3.26Å; R670-H793 PolarHBondContact NH1-O 2.98Å; R670-H793 PolarHBondContact NH2-O 3.41Å
671	V	49.2	Very low	50.5	Low	130 Å²	130	96.3 Å²	96.3	79%	0.788	50%	0.498	S	S	*	.			trans	-67.8	108.8	166.5	-177.7	0	0	0	0	105.6	P669 S673	P669-V671 PolarHBondContact O-N 2.97Å; V671-S673 VanDerWaalsContact C-N 3.31Å; V671-S673 PolarHBondContact O-N 3.17Å
672	L	37.6	Very low	48.3	Very low	146 Å²	146	103.2 Å²	103.2	76%	0.764	53%	0.534	S	S	*	.			trans	-58.8	103.1	163.2	-75.9	160.3	0	0	0	105.2	R670 Y674	R670-L672 PolarHBondContact O-N 2.85Å; R670-L672 VanDerWaalsContact O-N 3.11Å; L672-Y674 VanDerWaalsContact C-N 3.25Å; L672-Y674 PolarHBondContact O-N 2.51Å
673	S	29.5	Very low	45.8	Very low	107 Å²	107	101.1 Å²	101.1	75%	0.748	54%	0.543	S	S	*	.			trans	-59.3	100.9	163.9	53.1	0	0	0	0	105.7	V671 K675	V671-S673 VanDerWaalsContact C-N 3.31Å; V671-S673 PolarHBondContact O-N 3.17Å; S673-K675 PolarHBondContact O-N 3.31Å
674	Y	28.8	Very low	43.1	Very low	200 Å²	200	110.1 Å²	110.1	78%	0.784	58%	0.582	S	S	*	*			trans	-52.1	125.4	170.8	-116.2	-97.3	0	0	0	106.8	L672 S676	L672-Y674 VanDerWaalsContact C-N 3.25Å; L672-Y674 PolarHBondContact O-N 2.51Å; Y674-S676 PolarHBondContact O-N 3.42Å
675	K	25	Very low	40.3	Very low	189 Å²	189	115.9 Å²	115.9	82%	0.822	62%	0.617	S	S	*	*			trans	-60.9	91	171.2	-73.9	-179.3	172.8	-174.8	0	107.6	S673 E677	S673-K675 PolarHBondContact O-N 3.31Å; K675-E677 VanDerWaalsContact C-N 3.3Å; K675-E677 PolarHBondContact O-N 2.96Å
676	S	25.5	Very low	37.4	Very low	104 Å²	104	121.4 Å²	121.4	73%	0.727	65%	0.647	S	S	*	*			trans	-80.5	88.2	162.8	57.4	0	0	0	0	107	Y674 V678	Y674-S676 PolarHBondContact O-N 3.42Å; S676-V678 PolarHBondContact O-N 3.12Å
677	E	23	Very low	34.5	Very low	177 Å²	177	127 Å²	127	83%	0.827	68%	0.678	S	S	*	*			trans	-65.8	83.4	154.8	-78	174.6	175.2	0	0	107.4	K675	K675-E677 VanDerWaalsContact C-N 3.3Å; K675-E677 PolarHBondContact O-N 2.96Å
678	V	26.8	Very low	32.1	Very low	109 Å²	109	133.5 Å²	133.5	66%	0.661	71%	0.71	S	S	*	*			trans	-135.9	96.7	157.5	-179.6	0	0	0	0	105.5	S676 T680	S676-V678 PolarHBondContact O-N 3.12Å; V678-T680 VanDerWaalsContact C-N 3.32Å; V678-T680 PolarHBondContact O-N 3.36Å; V678-T680 PolarHBondContact O-OG1 2.79Å
679	D	22.6	Very low	29.6	Very low	170 Å²	170	139.1 Å²	139.1	91%	0.909	73%	0.728	S	S	*	*			trans	-49.6	96.9	168.2	-74.4	-40.3	0	0	0	109.2
680	T	25.5	Very low	27.3	Very low	106 Å²	106	145 Å²	145	65%	0.65	76%	0.758	S	S	*	*			trans	-129.6	104.2	163.3	12.9	0	0	0	0	106.5	V678 I682	V678-T680 VanDerWaalsContact C-N 3.32Å; V678-T680 PolarHBondContact O-N 3.36Å; V678-T680 PolarHBondContact O-OG1 2.79Å; T680-I682 PolarHBondContact O-N 3.23Å
681	D	23	Very low	25.5	Very low	175 Å²	175	142.9 Å²	142.9	94%	0.936	77%	0.766	S	S	*	*			trans	-55.7	70.5	176.4	-80.6	-44.8	0	0	0	112.9
682	I	23.6	Very low	24	Very low	156 Å²	156	144.2 Å²	144.2	80%	0.8	76%	0.763	S	S	*	*			trans	-108.8	99.2	167.5	-58.9	178.7	0	0	0	106.9	T680	T680-I682 PolarHBondContact O-N 3.23Å
683	G	22	Very low	23.2	Very low	58 Å²	58	146.3 Å²	146.3	60%	0.598	77%	0.766	S	S	*	*			trans	-59.4	150.3	-166.9	0	0	0	0	0	115.9	T685	G683-T685 PolarHBondContact O-N 2.58Å
684	K	22.6	Very low	22.9	Very low	189 Å²	189	146.6 Å²	146.6	82%	0.822	77%	0.768	S	S	*	*			trans	34.3	78.5	134.7	-62.6	-178.5	179	178.4	0	115.5
685	T	22.2	Very low	22.6	Very low	144 Å²	144	146.6 Å²	146.6	88%	0.883	77%	0.772	S	S	*	*			trans	-112.6	84.6	143.1	48.1	0	0	0	0	107.9	G683	G683-T685 PolarHBondContact O-N 2.58Å
686	D	21.7	Very low	22.4	Very low	116 Å²	116	142.5 Å²	142.5	62%	0.62	77%	0.767	S	S	*	*			trans	-54.9	131.4	170.9	-72	-53.2	0	0	0	111.7	I688	D686-I688 PolarHBondContact O-N 3.16Å
687	N	21	Very low	22.1	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	77%	0.767	S	S	*	*				41.7	48.1	129.3	-63.5	-32.3	0	0	0	119.8
688	I	22.4	Very low	22	Very low	140 Å²	140	139.7 Å²	139.7	72%	0.718	77%	0.767	S	S	*	*			trans	-97.7	133.8	159.6	-52.8	178	0	0	0	107.3	D686	D686-I688 PolarHBondContact O-N 3.16Å
689	Y	21.9	Very low	21.7	Very low	189 Å²	189	140.4 Å²	140.4	74%	0.741	77%	0.772	S	S	*	*			trans	96.8	37.3	-177.9	-55.4	-74.5	0	0	0	117.6	H692	Y689-H692 AromaticContact CE1-NE2 3.72Å
690	N	20.3	Very low	21.8	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	77%	0.766	S	S	*	*	S	Bend	trans	-88.2	130.7	137.8	-95.8	-32.2	0	0	0	109.4
691	S	20.5	Very low	21.6	Very low	99 Å²	99	140.1 Å²	140.1	69%	0.692	77%	0.771	S	S	*	*			trans	54.5	88.9	162.1	66.5	0	0	0	0	118.6	F693	S691-F693 PolarHBondContact O-N 3.08Å
692	H	19.2	Very low	21.6	Very low	158 Å²	158	138.5 Å²	138.5	73%	0.731	76%	0.762	S	S	*	*			trans	-86.8	65.6	142.8	-72.7	-66.6	0	0	0	109.2	Y689	Y689-H692 AromaticContact CE1-NE2 3.72Å
693	F	20.9	Very low	21.5	Very low	190 Å²	190	139.2 Å²	139.2	83%	0.833	76%	0.763	S	S	*	*			trans	-83.5	103.8	148.2	-106.4	-86.5	0	0	0	105.1	S691 K695	S691-F693 PolarHBondContact O-N 3.08Å; F693-K695 PolarHBondContact O-N 2.87Å
694	S	21.6	Very low	21.6	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	77%	0.774	S	S	*	*			trans	-63.2	91.2	169.6	-54.6	0	0	0	0	108.2	S696	S694-S696 PolarHBondContact O-N 2.81Å; S694-S696 VanDerWaalsContact O-N 3.12Å
695	K	23.2	Very low	21.6	Very low	201 Å²	201	139.6 Å²	139.6	87%	0.874	77%	0.765	S	S	*	*			trans	-60.1	108.5	154.1	-91.1	178.6	174.6	176.7	0	106	F693 S697	F693-K695 PolarHBondContact O-N 2.87Å; K695-S697 PolarHBondContact O-N 3.4Å
696	S	20.2	Very low	21.5	Very low	103 Å²	103	143.4 Å²	143.4	72%	0.72	76%	0.764	S	S	*	*			trans	-49.1	117.1	165.8	47.5	0	0	0	0	110	S694	S694-S696 PolarHBondContact O-N 2.81Å; S694-S696 VanDerWaalsContact O-N 3.12Å
697	S	20.1	Very low	21.6	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	77%	0.772	S	S	*	*			trans	24.8	104.1	143.1	56.6	0	0	0	0	117.1	K695	K695-S697 PolarHBondContact O-N 3.4Å
698	S	20.1	Very low	21.6	Very low	117 Å²	117	145 Å²	145	82%	0.818	77%	0.772	S	S	*	*			trans	-72.9	125.4	151.6	51	0	0	0	0	110.6
699	T	20.4	Very low	21.7	Very low	124 Å²	124	147.6 Å²	147.6	76%	0.761	78%	0.778	S	S	*	*			trans	-150.9	145.5	155.2	41.8	0	0	0	0	107.1
700	T	25.2	Very low	21.7	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	78%	0.778	S	S	*	*			trans	86.7	81.3	-165.5	72.4	0	0	0	0	111.7
701	D	21.1	Very low	21.9	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	77%	0.771	S	S	*	*				71.9	134.1	74	-61.2	-34.2	0	0	0	113
702	N	24.3	Very low	22	Very low	140 Å²	140	147.5 Å²	147.5	75%	0.749	78%	0.775	S	S	*	*			trans	88.3	97.2	168.8	-52.8	-19.8	0	0	0	114.8
703	E	21.2	Very low	22.1	Very low	172 Å²	172	144.9 Å²	144.9	80%	0.804	77%	0.774	S	S	*	*				62.5	108.1	87.5	-71.2	-169.9	166.8	0	0	111.8
704	I	24.2	Very low	22.2	Very low	162 Å²	162	145.1 Å²	145.1	83%	0.831	78%	0.775	S	S	*	*				164.7	124.4	121.7	-79.7	153.9	0	0	0	109
705	S	21.1	Very low	22.3	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	77%	0.771	S	S	*	*			trans	-62.7	154.4	174.9	58	0	0	0	0	114.3
706	R	20.5	Very low	22.3	Very low	224 Å²	224	140.5 Å²	140.5	85%	0.845	76%	0.763	S	S	*	*			trans	52.2	117.9	140	-74.8	179.3	179.2	167.3	0.3	118
707	N	23.9	Very low	22.6	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	77%	0.765	S	S	*	*				156.6	103	125.3	-76.6	-25.6	0	0	0	107.4
708	N	22.3	Very low	22.8	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	78%	0.775	S	S	*	*				35.2	119.2	95.5	-83.9	-14	0	0	0	114.9
709	K	23.4	Very low	23.1	Very low	193 Å²	193	147.2 Å²	147.2	84%	0.839	77%	0.767	S	S	*	*			trans	92.3	125.3	159.4	-70.4	177	173.8	173.3	0	117.5
710	K	22.7	Very low	23.2	Very low	169 Å²	169	149 Å²	149	74%	0.735	77%	0.766	S	S	*	*			trans	87.8	119.8	136.6	-82.8	-176.6	167.5	-169.8	0	117.5
711	D	23.4	Very low	23.2	Very low	119 Å²	119	153 Å²	153	64%	0.636	77%	0.773	S	S	*	*			trans	64.8	106.2	131.7	-48.1	-22.2	0	0	0	115.8
712	N	23.5	Very low	23.2	Very low	145 Å²	145	149.8 Å²	149.8	78%	0.775	76%	0.761	S	S	*	*				179.7	114.2	113.9	-85.9	-25	0	0	0	111.6
713	S	21.5	Very low	23.1	Very low	103 Å²	103	154.3 Å²	154.3	72%	0.72	77%	0.768	S	S	*	*			trans	13.9	107	136.4	58.7	0	0	0	0	117.6
714	F	22.6	Very low	23.2	Very low	196 Å²	196	153.7 Å²	153.7	86%	0.86	77%	0.77	S	S	*	*			trans	-129.1	103.9	144.5	-100.4	-82.6	0	0	0	109.7	T716	F714-T716 PolarHBondContact O-N 3.43Å
715	S	23.6	Very low	23.2	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	76%	0.764	S	S	*	*			trans	38.5	77.8	146.2	59.5	0	0	0	0	117.2	E717	S715-E717 VanDerWaalsContact C-N 3.31Å; S715-E717 PolarHBondContact O-N 3.08Å; S715-E717 VanDerWaalsContact O-N 3.12Å
716	T	22.4	Very low	23.2	Very low	115 Å²	115	152.1 Å²	152.1	71%	0.706	78%	0.775	S	S	*	*			trans	-67.9	84.3	150.4	39.9	0	0	0	0	110	F714	F714-T716 PolarHBondContact O-N 3.43Å
717	E	26.8	Very low	23.3	Very low	163 Å²	163	152.1 Å²	152.1	76%	0.762	78%	0.775	S	S	*	*	S	Bend	trans	-132.2	-0.4	166.9	-111.5	179.9	-177.4	0	0	114.4	S715	S715-E717 VanDerWaalsContact C-N 3.31Å; S715-E717 PolarHBondContact O-N 3.08Å; S715-E717 VanDerWaalsContact O-N 3.12Å
718	L	24.8	Very low	23.2	Very low	176 Å²	176	153 Å²	153	92%	0.921	77%	0.772	S	S	*	*	S	Bend	trans	-119.8	2.7	173.2	-95.5	149.5	0	0	0	114.7
719	I	26	Very low	23.3	Very low	127 Å²	127	154.2 Å²	154.2	65%	0.651	78%	0.778	S	S	*	*			trans	-104.1	7.1	175.6	-56.7	177.5	0	0	0	111.3	K721 S722	I719-K721 PolarHBondContact O-N 2.88Å; I719-S722 PolarHBondContact O-N 3.07Å
720	Q	23.5	Very low	23.2	Very low	160 Å²	160	150.5 Å²	150.5	75%	0.748	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	38	-175.9	-133.4	162.3	2.6	0	0	114.3
721	K	23.4	Very low	23.2	Very low	213 Å²	213	147.3 Å²	147.3	93%	0.926	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	38.8	158.2	-86.9	-171.4	178.5	176.5	0	111.8	I719	I719-K721 PolarHBondContact O-N 2.88Å
722	S	23.1	Very low	23.2	Very low	75 Å²	75	146.4 Å²	146.4	52%	0.524	77%	0.765	S	S	.	*	S	Bend	trans	-127	89.4	158.7	67.2	0	0	0	0	109.3	I719	I719-S722 PolarHBondContact O-N 3.07Å
723	R	20.8	Very low	23.1	Very low	236 Å²	236	151.1 Å²	151.1	89%	0.891	77%	0.771	S	S	*	*			trans	158.9	92.3	153.9	-89.6	157.9	-176.6	163.8	2.2	108.9
724	N	23.7	Very low	23.2	Very low	159 Å²	159	153.9 Å²	153.9	85%	0.85	77%	0.773	S	S	*	*	S	Bend	trans	-179.1	75.6	156.2	-86.3	-20.2	0	0	0	104.4
725	T	23.6	Very low	23.2	Very low	115 Å²	115	150.7 Å²	150.7	71%	0.706	77%	0.765	S	S	*	*				-170.2	96.8	84.2	25.6	0	0	0	0	108.3	R727	T725-R727 PolarHBondContact O-N 3.22Å
726	A	21.9	Very low	23.1	Very low	107 Å²	107	154 Å²	154	88%	0.884	77%	0.773	S	S	*	*			trans	-69.9	87.5	155	0	0	0	0	0	106.6	K728	A726-K728 PolarHBondContact O-N 3.32Å; A726-K728 VanDerWaalsContact O-N 3.13Å
727	R	21.9	Very low	23.1	Very low	223 Å²	223	153.3 Å²	153.3	84%	0.842	77%	0.773	S	S	*	*			trans	-74.7	101.6	163	-78.2	-173.5	-172.7	162.1	3.6	106.7	T725	T725-R727 PolarHBondContact O-N 3.22Å
728	K	22.8	Very low	22.8	Very low	166 Å²	166	150.5 Å²	150.5	72%	0.722	77%	0.772	S	S	*	*			trans	13.2	117.6	146.8	-77.3	176.1	157.5	-159	0	115.6	A726 D730	A726-K728 PolarHBondContact O-N 3.32Å; A726-K728 VanDerWaalsContact O-N 3.13Å; K728-D730 IonicContact NZ-OD2 3.24Å; K728-D730 PolarHBondContact O-N 3.45Å; K728-D730 VanDerWaalsContact O-N 3.14Å
729	L	23.1	Very low	22.6	Very low	179 Å²	179	147.7 Å²	147.7	94%	0.937	77%	0.767	S	S	*	*			trans	-48.2	108.8	135	-107.3	81.3	0	0	0	107.2
730	D	22.8	Very low	22.3	Very low	114 Å²	114	147.9 Å²	147.9	61%	0.61	78%	0.778	S	S	*	*			trans	-140.4	133.1	153.7	-90.3	-38.4	0	0	0	106.2	K728	K728-D730 IonicContact NZ-OD2 3.24Å; K728-D730 PolarHBondContact O-N 3.45Å; K728-D730 VanDerWaalsContact O-N 3.14Å
731	S	22.9	Very low	22.2	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	78%	0.777	S	S	*	*			trans	5.7	133.2	157	61.7	0	0	0	0	115.7
732	V	23.4	Very low	22	Very low	101 Å²	101	142.7 Å²	142.7	61%	0.612	77%	0.77	S	S	*	*				-156.5	118.4	75.2	162	0	0	0	0	108.8	E734	V732-E734 HydrophobicContact CG1-CB 3.74Å; V732-E734 HydrophobicContact CG1-CG 3.46Å; V732-E734 VanDerWaalsContact CG1-CG 3.46Å; V732-E734 PolarHBondContact O-N 3.49Å
733	R	20.4	Very low	22	Very low	243 Å²	243	146.1 Å²	146.1	92%	0.917	78%	0.783	S	S	*	*			trans	-64.4	81.7	155.6	-172.6	-177.5	-164.3	171.4	3.1	107.1	N735	R733-N735 PolarHBondContact O-N 3.05Å
734	E	24.5	Very low	22.1	Very low	161 Å²	161	140.3 Å²	140.3	75%	0.752	78%	0.778	S	S	*	*			trans	-88.8	94.4	169.1	-110.6	169.2	-145.3	0	0	108.2	V732	V732-E734 HydrophobicContact CG1-CB 3.74Å; V732-E734 HydrophobicContact CG1-CG 3.46Å; V732-E734 VanDerWaalsContact CG1-CG 3.46Å; V732-E734 PolarHBondContact O-N 3.49Å
735	N	21.5	Very low	21.9	Very low	130 Å²	130	136.6 Å²	136.6	70%	0.695	78%	0.777	S	S	*	*				42.6	95.6	128.2	-59.8	-26.8	0	0	0	116.4	R733 S737	R733-N735 PolarHBondContact O-N 3.05Å; N735-S737 PolarHBondContact O-N 2.96Å
736	I	21	Very low	21.8	Very low	168 Å²	168	136 Å²	136	86%	0.862	78%	0.778	S	S	*	*				-7.5	108.6	126.7	-55.3	166.3	0	0	0	111.8
737	S	22.3	Very low	21.7	Very low	102 Å²	102	137.5 Å²	137.5	71%	0.713	77%	0.771	S	S	*	*			trans	-132.8	91.6	152.4	-65.2	0	0	0	0	105	N735	N735-S737 PolarHBondContact O-N 2.96Å
738	S	21	Very low	21.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	77%	0.771	S	S	*	*				56	79.1	87.2	77.1	0	0	0	0	112.8
739	S	20.2	Very low	21.6	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	77%	0.768	S	S	*	*			trans	-151.2	66.5	143.4	49.9	0	0	0	0	109.5
740	C	20	Very low	21.6	Very low	130 Å²	130	131.8 Å²	131.8	88%	0.878	76%	0.76	S	S	*	*			trans	-78.8	112	147.3	-63.7	0	0	0	0	107.4
741	S	21	Very low	21.5	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	77%	0.769	S	S	*	*			trans	-145	103	149.9	69.1	0	0	0	0	106.4
742	M	20.9	Very low	21.4	Very low	159 Å²	159	141.7 Å²	141.7	78%	0.783	78%	0.78	S	S	*	*				52.3	124.7	80.9	-70.9	-85.2	124.9	0	0	112
743	N	22.5	Very low	21.4	Very low	147 Å²	147	143.7 Å²	143.7	79%	0.786	79%	0.786	S	S	*	*			trans	90.1	108.7	169.9	-45.9	-20.7	0	0	0	112.9
744	S	22.8	Very low	21.4	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	78%	0.777	S	S	*	*				-153.6	117.9	61.1	-58.3	0	0	0	0	111
745	G	19.2	Very low	21.2	Very low	80 Å²	80	140.4 Å²	140.4	83%	0.825	78%	0.782	S	S	*	*			trans	-67.3	128.2	153.2	0	0	0	0	0	108.8
746	S	21.7	Very low	21.2	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	79%	0.788	S	S	*	*			trans	-124.8	100.9	156.7	60.4	0	0	0	0	106.8
747	N	20.5	Very low	21.2	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	79%	0.787	S	S	*	*			trans	25.4	113.1	136.2	-53.3	-21.6	0	0	0	115.3
748	F	22	Very low	21.2	Very low	190 Å²	190	142.6 Å²	142.6	83%	0.833	79%	0.787	S	S	*	*				-170	120.5	90.7	-102.2	-83.4	0	0	0	109
749	S	19.9	Very low	21.3	Very low	96 Å²	96	144.6 Å²	144.6	67%	0.671	79%	0.79	S	S	*	*			trans	-59.9	172.5	158.5	49.5	0	0	0	0	111.7
750	E	23.1	Very low	21.4	Very low	162 Å²	162	146.1 Å²	146.1	76%	0.757	79%	0.789	S	S	*	*			trans	97.6	103.9	177.2	-59.5	175.2	-179.1	0	0	111.5
751	F	21.1	Very low	21.6	Very low	185 Å²	185	147.2 Å²	147.2	81%	0.811	79%	0.786	S	S	*	*			cis	-146.7	131.7	29.8	-94.6	-100.5	0	0	0	109.9
752	Y	20.8	Very low	21.7	Very low	238 Å²	238	149.6 Å²	149.6	93%	0.933	79%	0.79	S	S	*	*			trans	-108.8	131.9	151.7	-95.5	-88.1	0	0	0	107.2
753	L	22.8	Very low	21.8	Very low	143 Å²	143	150.3 Å²	150.3	75%	0.749	79%	0.791	S	S	*	*			trans	-125.5	112.4	154.1	-161.6	86.8	0	0	0	107.6
754	E	20.3	Very low	21.8	Very low	152 Å²	152	150.9 Å²	150.9	71%	0.71	79%	0.794	S	S	*	*			trans	48.9	108.8	139.3	-59.8	171.3	153.8	0	0	118.4
755	Q	21.3	Very low	22	Very low	183 Å²	183	153.9 Å²	153.9	86%	0.855	80%	0.795	S	S	*	*				45.6	89.3	78.5	-71.7	-165.7	5	0	0	115.6
756	T	21.6	Very low	22.2	Very low	137 Å²	137	156.6 Å²	156.6	84%	0.84	79%	0.791	S	S	*	*			trans	-150.6	90	141	31.2	0	0	0	0	105.2
757	K	21.1	Very low	22.5	Very low	189 Å²	189	157.4 Å²	157.4	82%	0.822	79%	0.792	S	S	*	*				33.4	122.9	84.2	-92.8	-168	-178.8	-176.7	0	114.6
758	V	21	Very low	22.8	Very low	120 Å²	120	157.9 Å²	157.9	73%	0.727	79%	0.794	S	S	*	*			trans	86.3	118.5	156	-170.8	0	0	0	0	111.4
759	D	23.7	Very low	23.4	Very low	147 Å²	147	155.4 Å²	155.4	79%	0.786	79%	0.79	S	S	*	*			cis	-150.4	139.1	35	-93.8	-48	0	0	0	112
760	D	22.6	Very low	24	Very low	148 Å²	148	159.7 Å²	159.7	79%	0.791	80%	0.796	S	S	*	*			trans	-65.5	126.6	149.6	-71.7	-48.1	0	0	0	108.3
761	N	23	Very low	24.7	Very low	154 Å²	154	160.5 Å²	160.5	82%	0.824	80%	0.797	S	S	*	*			trans	150.3	98.7	148.8	-78.6	-33.5	0	0	0	111.3
762	L	23	Very low	25.9	Very low	155 Å²	155	158.7 Å²	158.7	81%	0.812	79%	0.789	S	S	*	*			trans	-167.4	101.4	130.7	-133	70.4	0	0	0	111.4
763	Q	23.1	Very low	27.5	Very low	173 Å²	173	152 Å²	152	81%	0.808	77%	0.77	S	S	*	*			trans	36.8	96.6	132.4	-59.3	-177.8	-9.3	0	0	116.9	E765	Q763-E765 PolarHBondContact O-N 3.25Å
764	N	24	Very low	29.2	Very low	160 Å²	160	150.5 Å²	150.5	86%	0.856	76%	0.761	S	S	*	*			trans	-62.1	112	156.7	-64.5	-43.9	0	0	0	108.3
765	E	25.5	Very low	31.3	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	73%	0.729	S	S	*	*			trans	-77.6	118.8	165.6	-76.3	-166.3	157	0	0	109.1	Q763 V767	Q763-E765 PolarHBondContact O-N 3.25Å; E765-V767 PolarHBondContact O-N 3.26Å
766	D	23.5	Very low	33.8	Very low	138 Å²	138	138 Å²	138	74%	0.738	71%	0.71	S	S	*	*			trans	-62.1	101	176.7	-72.9	-43.5	0	0	0	111
767	V	28.5	Very low	36.3	Very low	121 Å²	121	134 Å²	134	73%	0.733	68%	0.683	S	S	*	*			trans	-103.4	103.1	162.3	-177.4	0	0	0	0	107.4	E765 D769	E765-V767 PolarHBondContact O-N 3.26Å; V767-D769 PolarHBondContact O-N 3.14Å
768	D	26.5	Very low	38.9	Very low	147 Å²	147	125.5 Å²	125.5	79%	0.786	65%	0.646	S	S	*	*			trans	-60.8	62.5	-178.9	-90.2	-38.2	0	0	0	114	K770	D768-K770 PolarHBondContact O-N 2.95Å; D768-K770 VanDerWaalsContact O-N 3.16Å
769	D	34.1	Very low	41.4	Very low	139 Å²	139	119.8 Å²	119.8	74%	0.743	61%	0.612	S	S	*	*			trans	-80.1	93.2	163.6	-85.2	-21.4	0	0	0	108.1	V767 K771	V767-D769 PolarHBondContact O-N 3.14Å; D769-K771 PolarHBondContact O-N 3.09Å
770	K	33.3	Very low	44	Very low	185 Å²	185	115.3 Å²	115.3	80%	0.804	59%	0.586	S	S	*	*			trans	-60	78.2	172.4	-73.1	-177.1	179.5	177.2	0	110.7	D768 F772	D768-K770 PolarHBondContact O-N 2.95Å; D768-K770 VanDerWaalsContact O-N 3.16Å; K770-F772 PolarHBondContact O-N 3.05Å; K770-F772 VanDerWaalsContact O-N 3.12Å
771	K	37.7	Very low	46.6	Very low	179 Å²	179	108.4 Å²	108.4	78%	0.778	55%	0.549	S	S	*	.			trans	-54.5	115.2	164.5	-90	175.5	176	170.2	0	107.1	D769 N773	D769-K771 PolarHBondContact O-N 3.09Å; K771-N773 PolarHBondContact O-N 2.84Å
772	F	46.1	Very low	48.9	Very low	147 Å²	147	102.9 Å²	102.9	65%	0.645	52%	0.521	S	S	*	.			trans	-62.1	104.1	172.4	-76.8	-89.8	0	0	0	108.5	K770 I774	K770-F772 PolarHBondContact O-N 3.05Å; K770-F772 VanDerWaalsContact O-N 3.12Å; F772-I774 PolarHBondContact O-N 3.47Å; F772-I774 VanDerWaalsContact O-N 3.09Å
773	N	55.2	Low	50.8	Low	99 Å²	99	95.9 Å²	95.9	53%	0.529	49%	0.485	S	S	.	.			trans	-66.6	111.2	175.6	-70.3	-24.6	0	0	0	108.1	P669 K771	P669-N773 HydrophobicContact CB-CB 4Å; P669-N773 VanDerWaalsContact CB-O 3.25Å; P669-N773 WeakPolarHBondContact CB-O 3.4Å; P669-N773 WeakPolarHBondContact CG-O 3.21Å; K771-N773 PolarHBondContact O-N 2.84Å
774	I	57	Low	52.6	Low	111 Å²	111	89 Å²	89	57%	0.569	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-74.3	131.7	167.5	-63.1	167.1	0	0	0	106.4	P577 F666 F772	P577-I774 HydrophobicContact CG-CG1 4.45Å; P577-I774 HydrophobicContact CG-CG2 4.27Å; F666-I774 HydrophobicContact CD1-CG2 3.87Å; F666-I774 HydrophobicContact CE1-CG2 4.12Å; F666-I774 HydrophobicContact CG-CG2 4.47Å; F772-I774 PolarHBondContact O-N 3.47Å; F772-I774 VanDerWaalsContact O-N 3.09Å
775	G	66	Low	54.4	Low	4 Å²	4	81.6 Å²	81.6	4%	0.041	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-66.8	163.7	176.7	0	0	0	0	0	112	G667	G667-G775 WeakPolarHBondContact O-CA 3.41Å
776	P	73.9	Confident	56.4	Low	68 Å²	68	75.6 Å²	75.6	44%	0.442	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-61.6	144.7	-177.5	26.4	-34.5	0	0	0	111.4	F666 G667 I778	F666-P776 WeakPolarHBondContact CA-O 3.4Å; G667-P776 PolarHBondContact N-O 2.96Å; P776-I778 PolarHBondContact O-N 3.4Å
777	L	74.1	Confident	58.7	Low	54 Å²	54	69.2 Å²	69.2	28%	0.283	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	122.9	173.2	-177.6	69.9	0	0	0	109.4	F666 H780 Y790	F666-L777 HydrophobicContact CD1-CB 4.38Å; F666-L777 HydrophobicContact CD1-CD1 4.13Å; F666-L777 HydrophobicContact CE1-CB 4.32Å; F666-L777 HydrophobicContact CE1-CD1 3.77Å; F666-L777 HydrophobicContact CZ-CD1 4Å; L777-H780 HydrophobicContact CD2-CB 4.44Å; L777-Y790 HydrophobicContact CD2-CD2 4.35Å; L777-Y790 HydrophobicContact CD2-CE2 3.77Å; L777-Y790 HydrophobicContact CG-CD2 4.23Å; L777-Y790 HydrophobicContact CG-CE2 4.12Å
778	I	75.1	Confident	60.6	Low	9 Å²	9	65.1 Å²	65.1	5%	0.046	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-33.8	-178.3	-47.6	176.9	0	0	0	111.2	I665 P776 V789 Y790 L863	I665-I778 PolarHBondContact O-N 3.07Å; P776-I778 PolarHBondContact O-N 3.4Å; I778-V789 CarbonylContact O-C 3.59Å; I778-V789 WeakPolarHBondContact O-CA 3.15Å; I778-Y790 PolarHBondContact O-N 3.2Å; I778-L863 HydrophobicContact CG2-CB 4.35Å; I778-L863 HydrophobicContact CG2-CD2 3.78Å; I778-L863 HydrophobicContact CG2-CG 4.48Å
779	A	73.8	Confident	62.6	Low	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	147.4	176.3	0	0	0	0	0	112.5	S664 I665 F781 V788 V789 L863	S664-A779 CarbonylContact C-O 3.56Å; S664-A779 WeakPolarHBondContact CA-O 3.34Å; I665-A779 HydrophobicContact CB-CB 4.15Å; I665-A779 HydrophobicContact CD1-CB 4.2Å; I665-A779 HydrophobicContact CG1-CB 4.39Å; I665-A779 PolarHBondContact N-O 3.3Å; I665-A779 PolarHBondContact O-N 3.14Å; A779-F781 HydrophobicContact CB-CE2 4.1Å; A779-V788 CarbonylContact C-O 3.6Å; A779-V788 VanDerWaalsContact CA-O 3.3Å; A779-V788 WeakPolarHBondContact CA-O 3.48Å; A779-V789 HydrophobicContact CB-CG2 4.14Å; A779-L863 HydrophobicContact CB-CD1 4.36Å
780	H	78.8	Confident	64.1	Low	53 Å²	53	53.8 Å²	53.8	25%	0.245	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	132.2	174.9	-173.6	73.4	0	0	0	111.2	L663 S664 L777 G787 V788 Y790	L663-H780 CarbonylContact O-C 3.57Å; L663-H780 VanDerWaalsContact O-CA 3.26Å; L663-H780 WeakPolarHBondContact O-CA 3.46Å; S664-H780 PolarHBondContact OG-ND1 3.24Å; L777-H780 HydrophobicContact CD2-CB 4.44Å; H780-G787 CarbonylContact O-C 3.55Å; H780-G787 WeakPolarHBondContact O-CA 3.29Å; H780-V788 PolarHBondContact N-O 3.47Å; H780-V788 PolarHBondContact O-N 3.19Å; H780-Y790 HydrophobicContact CB-CE2 4.47Å
781	F	75.6	Confident	65.2	Low	3 Å²	3	48.9 Å²	48.9	1%	0.013	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.7	176.8	-63.4	-98.1	0	0	0	111	Y662 L663 A779 D786 F821 L869 L877	Y662-F781 WeakPolarHBondContact CA-O 3.31Å; L663-F781 HydrophobicContact CB-CB 4.18Å; L663-F781 HydrophobicContact CB-CD2 4.4Å; L663-F781 HydrophobicContact CD2-CD2 3.88Å; L663-F781 HydrophobicContact CD2-CE2 4.42Å; L663-F781 HydrophobicContact CG-CD2 4.3Å; L663-F781 PolarHBondContact N-O 3.02Å; L663-F781 PolarHBondContact O-N 3.47Å; A779-F781 HydrophobicContact CB-CE2 4.1Å; F781-D786 CarbonylContact C-O 3.57Å; F781-D786 WeakPolarHBondContact CA-O 3.45Å; F781-F821 HydrophobicContact CE1-CD2 4.25Å; F781-F821 HydrophobicContact CE1-CG 4.39Å; F781-L869 HydrophobicContact CE2-CD2 3.54Å; F781-L869 HydrophobicContact CZ-CD2 3.46Å; F781-L869 VanDerWaalsContact CZ-CD2 3.46Å; F781-L877 HydrophobicContact CD1-CD1 4.13Å; F781-L877 HydrophobicContact CD2-CD1 4.41Å; F781-L877 HydrophobicContact CE1-CD1 4.05Å; F781-L877 HydrophobicContact CE2-CD1 4.33Å; F781-L877 HydrophobicContact CG-CD1 4.33Å; F781-L877 HydrophobicContact CZ-CD1 4.17Å
782	T	71	Confident	65.8	Low	39 Å²	39	43.5 Å²	43.5	24%	0.239	23%	0.229	C	C	.	.			trans	-106.5	165.2	-176.5	69.1	0	0	0	0	112	F661 S784 G785 D786	F661-T782 CarbonylContact O-C 3.41Å; T782-S784 PolarHBondContact O-N 3.49Å; T782-S784 PolarHBondContact OG1-OG 3.4Å; T782-G785 PolarHBondContact O-N 3.13Å; T782-D786 PolarHBondContact N-O 3.05Å; T782-D786 PolarHBondContact OG1-O 3.33Å; T782-D786 VanDerWaalsContact OG1-O 3.08Å
783	P	64.7	Low	65.7	Low	8 Å²	8	42.4 Å²	42.4	5%	0.052	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.8	-179.3	-28.4	37	0	0	0	115.2	G660 F661 Y662 G785 Q895	G660-P783 WeakPolarHBondContact CA-O 3.15Å; F661-P783 VanDerWaalsContact O-CA 3.29Å; F661-P783 WeakPolarHBondContact O-CA 3.17Å; F661-P783 VanDerWaalsContact O-N 3.1Å; Y662-P783 HydrophobicContact CD1-CG 4.31Å; Y662-P783 HydrophobicContact CD2-CG 3.89Å; Y662-P783 HydrophobicContact CE1-CG 3.94Å; Y662-P783 HydrophobicContact CE2-CG 3.47Å; Y662-P783 VanDerWaalsContact CE2-CG 3.47Å; Y662-P783 HydrophobicContact CG-CG 4.28Å; Y662-P783 VanDerWaalsContact CZ-CD 3.47Å; Y662-P783 VanDerWaalsContact CZ-CG 3.49Å; P783-G785 PolarHBondContact O-N 2.78Å; P783-Q895 PolarHBondContact O-NE2 3.15Å
784	S	60.2	Low	64.8	Low	28 Å²	28	43.6 Å²	43.6	20%	0.196	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.4	175.8	49.7	0	0	0	0	113.1	T782 D786	T782-S784 PolarHBondContact O-N 3.49Å; T782-S784 PolarHBondContact OG1-OG 3.4Å; S784-D786 VanDerWaalsContact C-N 3.31Å; S784-D786 WeakPolarHBondContact CB-OD2 3.47Å; S784-D786 PolarHBondContact OG-OD2 2.86Å
785	G	61	Low	63.8	Low	5 Å²	5	43.9 Å²	43.9	5%	0.052	23%	0.234	C	C	.	.	S	Bend	trans	88.6	-1.6	-169.8	0	0	0	0	0	112.7	T782 P783 R871	T782-G785 PolarHBondContact O-N 3.13Å; P783-G785 PolarHBondContact O-N 2.78Å; G785-R871 VanDerWaalsContact O-CZ 3.3Å; G785-R871 PolarHBondContact O-NH1 2.85Å; G785-R871 PolarHBondContact O-NH2 3.28Å
786	D	68.4	Low	62.1	Low	51 Å²	51	50 Å²	50	27%	0.273	27%	0.265	S	S	.	.			trans	-74.5	151.9	175	-50.1	-38.4	0	0	0	109.5	F781 T782 S784 F821 T822 K823	F781-D786 CarbonylContact C-O 3.57Å; F781-D786 WeakPolarHBondContact CA-O 3.45Å; T782-D786 PolarHBondContact N-O 3.05Å; T782-D786 PolarHBondContact OG1-O 3.33Å; T782-D786 VanDerWaalsContact OG1-O 3.08Å; S784-D786 VanDerWaalsContact C-N 3.31Å; S784-D786 WeakPolarHBondContact CB-OD2 3.47Å; S784-D786 PolarHBondContact OG-OD2 2.86Å; D786-F821 CarbonylContact C-O 3.59Å; D786-F821 WeakPolarHBondContact CA-O 3.11Å; D786-F821 WeakPolarHBondContact CB-O 3.35Å; D786-T822 WeakPolarHBondContact OD1-CA 3.36Å; D786-K823 PolarHBondContact OD1-N 3.38Å
787	G	70.9	Confident	59.7	Low	3 Å²	3	51.2 Å²	51.2	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	161.5	-177.8	0	0	0	0	0	113.3	H780 I820 F821	H780-G787 CarbonylContact O-C 3.55Å; H780-G787 WeakPolarHBondContact O-CA 3.29Å; G787-I820 CarbonylContact O-C 3.48Å; G787-I820 WeakPolarHBondContact O-CA 3.4Å; G787-F821 PolarHBondContact N-O 2.78Å; G787-F821 PolarHBondContact O-N 2.73Å
788	V	68.9	Low	57.4	Low	35 Å²	35	54.9 Å²	54.9	21%	0.212	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	133.8	-177.3	-175.3	0	0	0	0	108.8	A779 H780 Y790 I817 A819	A779-V788 CarbonylContact C-O 3.6Å; A779-V788 VanDerWaalsContact CA-O 3.3Å; A779-V788 WeakPolarHBondContact CA-O 3.48Å; H780-V788 PolarHBondContact N-O 3.47Å; H780-V788 PolarHBondContact O-N 3.19Å; V788-Y790 HydrophobicContact CB-CE2 4.38Å; V788-Y790 HydrophobicContact CG1-CD1 4.48Å; V788-Y790 HydrophobicContact CG1-CE1 4.03Å; V788-Y790 HydrophobicContact CG1-CE2 4.18Å; V788-I817 HydrophobicContact CG1-CB 4.37Å; V788-I817 HydrophobicContact CG1-CD1 4.25Å; V788-I817 HydrophobicContact CG1-CG1 3.97Å; V788-I817 HydrophobicContact CG1-CG2 3.62Å; V788-A819 WeakPolarHBondContact CA-O 3.39Å
789	V	67.9	Low	55	Low	4 Å²	4	61.8 Å²	61.8	2%	0.024	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.3	173.2	178.5	0	0	0	0	108.5	I778 A779 H818 A819 F821 I861 L863	I778-V789 CarbonylContact O-C 3.59Å; I778-V789 WeakPolarHBondContact O-CA 3.15Å; A779-V789 HydrophobicContact CB-CG2 4.14Å; V789-H818 PolarHBondContact O-N 2.9Å; V789-A819 HydrophobicContact CB-CB 4.29Å; V789-A819 PolarHBondContact N-O 2.94Å; V789-A819 PolarHBondContact O-N 2.88Å; V789-F821 HydrophobicContact CG2-CD2 4.43Å; V789-F821 HydrophobicContact CG2-CE2 3.72Å; V789-I861 HydrophobicContact CG2-CD1 4.48Å; V789-L863 HydrophobicContact CG1-CD2 4.07Å
790	Y	66.8	Low	52.6	Low	44 Å²	44	67.9 Å²	67.9	17%	0.173	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	155.9	-176.7	-59.5	-84.2	0	0	0	111.8	L777 I778 H780 V788 P814 I817	L777-Y790 HydrophobicContact CD2-CD2 4.35Å; L777-Y790 HydrophobicContact CD2-CE2 3.77Å; L777-Y790 HydrophobicContact CG-CD2 4.23Å; L777-Y790 HydrophobicContact CG-CE2 4.12Å; I778-Y790 PolarHBondContact O-N 3.2Å; H780-Y790 HydrophobicContact CB-CE2 4.47Å; V788-Y790 HydrophobicContact CB-CE2 4.38Å; V788-Y790 HydrophobicContact CG1-CD1 4.48Å; V788-Y790 HydrophobicContact CG1-CE1 4.03Å; V788-Y790 HydrophobicContact CG1-CE2 4.18Å; Y790-P814 HydrophobicContact CD1-CB 3.71Å; Y790-P814 HydrophobicContact CD1-CG 3.97Å; Y790-P814 HydrophobicContact CE1-CB 4.26Å; Y790-P814 HydrophobicContact CE1-CG 3.99Å; Y790-P814 HydrophobicContact CG-CB 4.22Å; Y790-I817 HydrophobicContact CD1-CG1 4.36Å; Y790-I817 HydrophobicContact CE1-CG1 4.26Å
791	Y	56.1	Low	49.9	Very low	83 Å²	83	71 Å²	71	33%	0.325	39%	0.393	S	S	.	.			trans	-72.1	130	173.4	-126.8	-85.9	0	0	0	112.3	H793 N816 H818 N831	Y791-H793 PolarHBondContact O-N 3.25Å; Y791-N816 HydrophobicContact CD2-CB 4.43Å; Y791-N816 PolarHBondContact N-O 2.81Å; Y791-H818 HydrophobicContact CD2-CB 4.12Å; Y791-N831 WeakPolarHBondContact CE2-OD1 3.49Å; Y791-N831 VanDerWaalsContact CZ-OD1 3.31Å; Y791-N831 PolarHBondContact OH-ND2 2.46Å; Y791-N831 PolarHBondContact OH-OD1 3.1Å
792	P	51.3	Low	47.4	Very low	65 Å²	65	77.1 Å²	77.1	42%	0.422	42%	0.424	S	S	.	.			trans	-72.2	111.1	157.5	27.6	-27.6	0	0	0	107.9	N794	P792-N794 PolarHBondContact O-N 2.86Å
793	H	42	Very low	45.3	Very low	125 Å²	125	84.6 Å²	84.6	58%	0.579	45%	0.454	S	S	*	.			trans	-57.2	96.2	-177.5	-165.3	-24.6	0	0	0	111.2	R670 Y791 I795	R670-H793 VanDerWaalsContact CZ-O 3.26Å; R670-H793 PolarHBondContact NH1-O 2.98Å; R670-H793 PolarHBondContact NH2-O 3.41Å; Y791-H793 PolarHBondContact O-N 3.25Å; H793-I795 PolarHBondContact O-N 3.35Å
794	N	36.5	Very low	43.4	Very low	123 Å²	123	91.9 Å²	91.9	66%	0.658	49%	0.492	S	S	*	.			trans	-84.3	93.8	-178.2	-154.7	9	0	0	0	108.1	P792 N796	P792-N794 PolarHBondContact O-N 2.86Å; N794-N796 PolarHBondContact O-N 2.75Å
795	I	35.8	Very low	41.7	Very low	117 Å²	117	95.4 Å²	95.4	60%	0.6	52%	0.517	S	S	*	.			trans	-74.8	89	169.4	-57.8	171.2	0	0	0	105.5	H793	H793-I795 PolarHBondContact O-N 3.35Å
796	N	30.4	Very low	40	Very low	132 Å²	132	101.3 Å²	101.3	71%	0.706	55%	0.552	S	S	*	*			trans	-139.8	53	166.9	-121.9	18.1	0	0	0	108.3	N794	N794-N796 PolarHBondContact O-N 2.75Å
797	S	25.3	Very low	38	Very low	94 Å²	94	105.4 Å²	105.4	66%	0.657	57%	0.574	S	S	*	*			trans	-106.5	92.1	162.5	58.3	0	0	0	0	107.6
798	N	25	Very low	35.9	Very low	132 Å²	132	113 Å²	113	71%	0.706	61%	0.608	S	S	*	*			trans	-54	142	160.3	-66.5	-32.4	0	0	0	109.5
799	N	25.1	Very low	33.9	Very low	154 Å²	154	118.1 Å²	118.1	82%	0.824	63%	0.633	S	S	*	*			trans	85.9	35.6	155.4	-56.1	-6.9	0	0	0	120.7
800	T	23.6	Very low	31.9	Very low	128 Å²	128	126 Å²	126	79%	0.785	68%	0.675	S	S	*	*			trans	-118.3	89.3	156.7	3.6	0	0	0	0	111
801	T	22.6	Very low	30.2	Very low	117 Å²	117	130.6 Å²	130.6	72%	0.718	70%	0.703	S	S	*	*			trans	-33	130.7	156.2	21.2	0	0	0	0	113.9
802	I	22.5	Very low	29.1	Very low	133 Å²	133	132.9 Å²	132.9	68%	0.682	72%	0.72	S	S	*	*			trans	73.5	109.5	145	-51.1	159.8	0	0	0	115.4
803	F	26.7	Very low	28.3	Very low	196 Å²	196	137.5 Å²	137.5	86%	0.86	74%	0.736	S	S	*	*				-172.1	129.9	110.3	-107.2	-78.7	0	0	0	110.5	S805	F803-S805 PolarHBondContact O-N 3.47Å
804	N	24.3	Very low	28.2	Very low	161 Å²	161	134.9 Å²	134.9	86%	0.861	73%	0.73	S	S	*	*			trans	-63.8	105.9	178.8	-63.5	-26.6	0	0	0	110.9
805	S	25.3	Very low	28.6	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	73%	0.73	S	S	*	*			trans	-146.3	101.3	164.1	172.4	0	0	0	0	107.6	F803	F803-S805 PolarHBondContact O-N 3.47Å
806	T	25.5	Very low	29.6	Very low	129 Å²	129	132.4 Å²	132.4	79%	0.791	73%	0.729	S	S	*	*			trans	-112.2	53.8	-169.1	-46.4	0	0	0	0	109.5
807	D	25.9	Very low	30.7	Very low	138 Å²	138	129.7 Å²	129.7	74%	0.738	71%	0.714	S	S	*	*	S	Bend	trans	-140.1	-2.8	-176.3	-82.5	-44.4	0	0	0	118
808	H	26.1	Very low	32.5	Very low	162 Å²	162	128 Å²	128	75%	0.75	70%	0.695	S	S	*	*			trans	-138.6	42.7	-168.9	-68	-36.5	0	0	0	117.7
809	I	26.4	Very low	34.3	Very low	143 Å²	143	121.7 Å²	121.7	73%	0.733	66%	0.662	S	S	*	*			trans	-101.8	2.4	177.8	-54.8	-179.3	0	0	0	114.4	N811 L812	I809-N811 PolarHBondContact O-N 3.45Å; I809-N811 VanDerWaalsContact O-N 3.12Å; I809-L812 HydrophobicContact CG2-CD1 4.25Å
810	N	27.6	Very low	36.1	Very low	168 Å²	168	117.1 Å²	117.1	90%	0.898	64%	0.637	S	S	*	*	S	Bend	trans	-74.2	1.9	174.5	-78.2	-15.4	0	0	0	115.1
811	N	30.7	Very low	38	Very low	141 Å²	141	111.2 Å²	111.2	75%	0.754	60%	0.6	S	S	*	*			trans	-113.3	68.5	175	-68.7	-20.7	0	0	0	110.3	I809 Q813	I809-N811 PolarHBondContact O-N 3.45Å; I809-N811 VanDerWaalsContact O-N 3.12Å; N811-Q813 PolarHBondContact O-N 3.01Å
812	L	32.9	Very low	39.9	Very low	132 Å²	132	107.6 Å²	107.6	69%	0.691	58%	0.578	S	S	*	*			trans	-71.7	74.6	164.9	-86.2	111.2	0	0	0	109.2	I809	I809-L812 HydrophobicContact CG2-CD1 4.25Å
813	Q	33.8	Very low	41.5	Very low	162 Å²	162	105.3 Å²	105.3	76%	0.757	56%	0.563	S	S	*	*			trans	-60.6	128.9	156.9	-78.2	-166.2	-19.3	0	0	107.4	N811 A815	N811-Q813 PolarHBondContact O-N 3.01Å; Q813-A815 PolarHBondContact O-N 3.28Å
814	P	40.7	Very low	42.9	Very low	70 Å²	70	100.8 Å²	100.8	46%	0.455	55%	0.545	S	S	.	.			trans	-68.7	87.3	170.8	28.8	-31.3	0	0	0	107.4	Y790 N816	Y790-P814 HydrophobicContact CD1-CB 3.71Å; Y790-P814 HydrophobicContact CD1-CG 3.97Å; Y790-P814 HydrophobicContact CE1-CB 4.26Å; Y790-P814 HydrophobicContact CE1-CG 3.99Å; Y790-P814 HydrophobicContact CG-CB 4.22Å; P814-N816 PolarHBondContact O-N 2.89Å; P814-N816 VanDerWaalsContact O-N 3.15Å
815	A	44.1	Very low	44.3	Very low	80 Å²	80	96 Å²	96	66%	0.661	52%	0.515	S	S	*	.			trans	-70.1	-15.1	-162	0	0	0	0	0	114.4	Q813	Q813-A815 PolarHBondContact O-N 3.28Å
816	N	56.4	Low	45.7	Very low	107 Å²	107	92 Å²	92	57%	0.572	49%	0.487	S	S	*	.			trans	-133	120.3	-177.1	-68.8	-33.9	0	0	0	112.7	Y791 P814	Y791-N816 HydrophobicContact CD2-CB 4.43Å; Y791-N816 PolarHBondContact N-O 2.81Å; P814-N816 PolarHBondContact O-N 2.89Å; P814-N816 VanDerWaalsContact O-N 3.15Å
817	I	54.5	Low	47.2	Very low	76 Å²	76	90.4 Å²	90.4	39%	0.39	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.4	171.1	-65	169.5	0	0	0	108.1	V788 Y790 I820 F829	V788-I817 HydrophobicContact CG1-CB 4.37Å; V788-I817 HydrophobicContact CG1-CD1 4.25Å; V788-I817 HydrophobicContact CG1-CG1 3.97Å; V788-I817 HydrophobicContact CG1-CG2 3.62Å; Y790-I817 HydrophobicContact CD1-CG1 4.36Å; Y790-I817 HydrophobicContact CE1-CG1 4.26Å; I817-I820 HydrophobicContact CG2-CD1 4.08Å; I817-I820 HydrophobicContact CG2-CG1 3.6Å; I817-F829 HydrophobicContact CG2-CD2 4.38Å; I817-F829 HydrophobicContact CG2-CE2 4.17Å; I817-F829 WeakPolarHBondContact O-CD2 3.43Å
818	H	62.3	Low	48.6	Very low	57 Å²	57	88.1 Å²	88.1	26%	0.264	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-35.7	179	-177.7	54.5	0	0	0	112.6	V789 Y791 F829	V789-H818 PolarHBondContact O-N 2.9Å; Y791-H818 HydrophobicContact CD2-CB 4.12Å; H818-F829 PolarHBondContact CE1-O 2.92Å; H818-F829 VanDerWaalsContact CE1-O 3.29Å; H818-F829 PolarHBondContact ND1-O 2.83Å; H818-F829 WeakPolarHBondContact O-CD2 3.48Å; H818-F829 PolarHBondContact O-N 3.12Å
819	A	62.6	Low	50	Low	1 Å²	1	83.9 Å²	83.9	1%	0.008	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	145.1	175.7	0	0	0	0	0	112.7	V788 V789 F821 Y827 V828	V788-A819 WeakPolarHBondContact CA-O 3.39Å; V789-A819 HydrophobicContact CB-CB 4.29Å; V789-A819 PolarHBondContact N-O 2.94Å; V789-A819 PolarHBondContact O-N 2.88Å; A819-F821 HydrophobicContact CB-CE2 3.65Å; A819-F821 HydrophobicContact CB-CZ 3.84Å; A819-Y827 CarbonylContact C-O 3.41Å; A819-Y827 WeakPolarHBondContact CA-O 3.46Å; A819-Y827 WeakPolarHBondContact CB-O 3.17Å; A819-V828 HydrophobicContact CB-CG2 4.28Å
820	I	63.6	Low	51.2	Low	57 Å²	57	84.2 Å²	84.2	29%	0.292	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.5	173.1	-61.7	169.7	0	0	0	108.5	G787 I817 Y827 F829	G787-I820 CarbonylContact O-C 3.48Å; G787-I820 WeakPolarHBondContact O-CA 3.4Å; I817-I820 HydrophobicContact CG2-CD1 4.08Å; I817-I820 HydrophobicContact CG2-CG1 3.6Å; I820-Y827 PolarHBondContact N-O 2.93Å; I820-Y827 PolarHBondContact O-N 2.81Å; I820-F829 HydrophobicContact CD1-CE2 3.93Å; I820-F829 HydrophobicContact CD1-CZ 4.09Å; I820-F829 HydrophobicContact CG1-CE2 4.02Å
821	F	63.7	Low	52.1	Low	4 Å²	4	81.2 Å²	81.2	2%	0.018	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.1	177.5	-63.8	-83.9	0	0	0	109.3	F781 D786 G787 V789 A819 C826 L859 I861	F781-F821 HydrophobicContact CE1-CD2 4.25Å; F781-F821 HydrophobicContact CE1-CG 4.39Å; D786-F821 CarbonylContact C-O 3.59Å; D786-F821 WeakPolarHBondContact CA-O 3.11Å; D786-F821 WeakPolarHBondContact CB-O 3.35Å; G787-F821 PolarHBondContact N-O 2.78Å; G787-F821 PolarHBondContact O-N 2.73Å; V789-F821 HydrophobicContact CG2-CD2 4.43Å; V789-F821 HydrophobicContact CG2-CE2 3.72Å; A819-F821 HydrophobicContact CB-CE2 3.65Å; A819-F821 HydrophobicContact CB-CZ 3.84Å; F821-C826 HydrophobicContact CD1-CB 3.87Å; F821-C826 HydrophobicContact CE1-CB 3.6Å; F821-C826 WeakPolarHBondContact CE1-SG 2.99Å; F821-C826 HydrophobicContact CZ-CB 4.46Å; F821-C826 WeakPolarHBondContact CZ-SG 3.36Å; F821-L859 HydrophobicContact CD1-CD1 3.95Å; F821-L859 HydrophobicContact CE1-CD1 2.97Å; F821-L859 HydrophobicContact CE1-CG 4.37Å; F821-L859 HydrophobicContact CE2-CD1 3.71Å; F821-L859 HydrophobicContact CZ-CD1 2.87Å; F821-L859 HydrophobicContact CZ-CG 4.35Å; F821-I861 HydrophobicContact CZ-CD1 4.41Å
822	T	61.6	Low	52.6	Low	42 Å²	42	79.6 Å²	79.6	26%	0.258	42%	0.417	S	S	.	.			trans	-115.9	170.6	166.3	67.9	0	0	0	0	109.8	D786 E824 Y825 Y827	D786-T822 WeakPolarHBondContact OD1-CA 3.36Å; T822-E824 PolarHBondContact O-N 3.34Å; T822-Y825 PolarHBondContact N-O 2.89Å; T822-Y825 PolarHBondContact OG1-N 2.8Å; T822-Y825 VanDerWaalsContact OG1-N 3.14Å; T822-Y825 PolarHBondContact OG1-O 2.77Å; T822-Y827 HydrophobicContact CG2-CE2 4.11Å
823	K	57.4	Low	53	Low	84 Å²	84	78.6 Å²	78.6	37%	0.365	41%	0.412	S	S	.	.	S	Bend	trans	-46	-35.5	174.6	-176.6	-169.1	154.8	-133.5	0	114.1	D786	D786-K823 PolarHBondContact OD1-N 3.38Å
824	E	55.1	Low	53.2	Low	101 Å²	101	75 Å²	75	47%	0.472	42%	0.42	S	S	.	.	S	Bend	trans	-116.2	-19	-171.4	-70	171.9	-161.9	0	0	113.5	T822 V857	T822-E824 PolarHBondContact O-N 3.34Å; E824-V857 VanDerWaalsContact O-CG2 3.25Å; E824-V857 WeakPolarHBondContact O-CG2 3.43Å
825	Y	53.5	Low	52.8	Low	60 Å²	60	78.7 Å²	78.7	24%	0.235	43%	0.43	C	S	.	.			trans	-140.6	159.8	-168.6	-54.5	-60.2	0	0	0	113.6	T822 R854	T822-Y825 PolarHBondContact N-O 2.89Å; T822-Y825 PolarHBondContact OG1-N 2.8Å; T822-Y825 VanDerWaalsContact OG1-N 3.14Å; T822-Y825 PolarHBondContact OG1-O 2.77Å; Y825-R854 HydrophobicContact CD1-CB 3.62Å; Y825-R854 HydrophobicContact CD1-CG 3.61Å; Y825-R854 HydrophobicContact CE1-CB 3.72Å; Y825-R854 VanDerWaalsContact CE1-CD 3.46Å; Y825-R854 HydrophobicContact CE1-CG 3.54Å; Y825-R854 HydrophobicContact CG-CG 4.43Å; Y825-R854 PolarHBondContact OH-NH1 2.75Å
826	C	54.6	Low	52.3	Low	18 Å²	18	80.5 Å²	80.5	12%	0.122	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.2	169.8	171.3	0	0	0	0	108.8	F821 V828	F821-C826 HydrophobicContact CD1-CB 3.87Å; F821-C826 HydrophobicContact CE1-CB 3.6Å; F821-C826 WeakPolarHBondContact CE1-SG 2.99Å; F821-C826 HydrophobicContact CZ-CB 4.46Å; F821-C826 WeakPolarHBondContact CZ-SG 3.36Å; C826-V828 VanDerWaalsContact SG-CG2 3.58Å
827	Y	57.2	Low	51	Low	95 Å²	95	83.4 Å²	83.4	37%	0.373	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.1	173.2	-57	-85.7	0	0	0	108.2	A819 I820 T822 T852	A819-Y827 CarbonylContact C-O 3.41Å; A819-Y827 WeakPolarHBondContact CA-O 3.46Å; A819-Y827 WeakPolarHBondContact CB-O 3.17Å; I820-Y827 PolarHBondContact N-O 2.93Å; I820-Y827 PolarHBondContact O-N 2.81Å; T822-Y827 HydrophobicContact CG2-CE2 4.11Å; Y827-T852 HydrophobicContact CE1-CG2 4.09Å
828	V	55.4	Low	49.9	Very low	90 Å²	90	86 Å²	86	55%	0.545	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.6	178.6	-177.1	0	0	0	0	109.2	A819 C826	A819-V828 HydrophobicContact CB-CG2 4.28Å; C826-V828 VanDerWaalsContact SG-CG2 3.58Å
829	F	56.9	Low	48.2	Very low	73 Å²	73	90 Å²	90	32%	0.32	46%	0.463	S	S	.	.			trans	-101.9	128.7	-179.6	-57.1	-84.9	0	0	0	110.3	I817 H818 I820	I817-F829 HydrophobicContact CG2-CD2 4.38Å; I817-F829 HydrophobicContact CG2-CE2 4.17Å; I817-F829 WeakPolarHBondContact O-CD2 3.43Å; H818-F829 PolarHBondContact CE1-O 2.92Å; H818-F829 VanDerWaalsContact CE1-O 3.29Å; H818-F829 PolarHBondContact ND1-O 2.83Å; H818-F829 WeakPolarHBondContact O-CD2 3.48Å; H818-F829 PolarHBondContact O-N 3.12Å; I820-F829 HydrophobicContact CD1-CE2 3.93Å; I820-F829 HydrophobicContact CD1-CZ 4.09Å; I820-F829 HydrophobicContact CG1-CE2 4.02Å
830	K	51.1	Low	46.4	Very low	150 Å²	150	96 Å²	96	65%	0.652	49%	0.489	S	S	*	.			trans	-83.7	161.5	173.8	-83.4	-169.4	176.2	-168.2	0	112.3	E839	K830-E839 IonicContact NZ-OE2 3.8Å; K830-E839 PolarHBondContact NZ-OE2 3.02Å
831	N	45.6	Very low	44.7	Very low	106 Å²	106	95.7 Å²	95.7	57%	0.567	49%	0.491	S	S	*	.	S	Bend	trans	-88.3	-10.2	-144.7	-72.3	-20.5	0	0	0	119.6	Y791	Y791-N831 WeakPolarHBondContact CE2-OD1 3.49Å; Y791-N831 VanDerWaalsContact CZ-OD1 3.31Å; Y791-N831 PolarHBondContact OH-ND2 2.46Å; Y791-N831 PolarHBondContact OH-OD1 3.1Å
832	S	42.1	Very low	42.8	Very low	106 Å²	106	101.4 Å²	101.4	74%	0.741	53%	0.531	S	S	*	.	S	Bend	trans	-108	-27.7	-154.8	46.3	0	0	0	0	118.6
833	N	40.9	Very low	41	Very low	111 Å²	111	108.1 Å²	108.1	59%	0.594	56%	0.557	S	S	*	*	S	Bend	trans	-133.7	0.1	-167.2	-59.1	18.5	0	0	0	115.8	E835	N833-E835 HydrophobicContact CB-CB 4.31Å; N833-E835 PolarHBondContact O-N 3.21Å
834	G	37	Very low	39.5	Very low	88 Å²	88	110.3 Å²	110.3	91%	0.907	58%	0.578	S	S	*	*	S	Bend	trans	65.8	-7.4	-168.5	0	0	0	0	0	113.9
835	E	33.2	Very low	38.2	Very low	146 Å²	146	114.8 Å²	114.8	68%	0.682	60%	0.599	S	S	*	*	S	Bend	trans	-86.8	132.5	169.6	-69.7	-171.2	145.5	0	0	110.7	N833 E837	N833-E835 HydrophobicContact CB-CB 4.31Å; N833-E835 PolarHBondContact O-N 3.21Å; E835-E837 PolarHBondContact O-N 2.8Å
836	L	33.2	Very low	37	Very low	119 Å²	119	121.6 Å²	121.6	62%	0.623	63%	0.63	S	S	*	*			trans	-67.3	89.9	172.5	-95.4	115.1	0	0	0	109.9	Y838	L836-Y838 HydrophobicContact CB-CE2 4.29Å; L836-Y838 HydrophobicContact CD2-CD2 4.35Å; L836-Y838 HydrophobicContact CD2-CE2 3.54Å
837	E	29.7	Very low	35.7	Very low	167 Å²	167	126 Å²	126	78%	0.78	66%	0.66	S	S	*	*			trans	-97.1	106.2	163.2	-88.4	-165.3	148.1	0	0	111.3	E835 E839	E835-E837 PolarHBondContact O-N 2.8Å; E837-E839 PolarHBondContact O-N 2.86Å
838	Y	31.4	Very low	34.3	Very low	130 Å²	130	128.7 Å²	128.7	51%	0.51	68%	0.681	S	S	.	*			trans	-69.6	96.5	173.7	-77.8	-98.9	0	0	0	110.5	L836 F840 P851 T852	L836-Y838 HydrophobicContact CB-CE2 4.29Å; L836-Y838 HydrophobicContact CD2-CD2 4.35Å; L836-Y838 HydrophobicContact CD2-CE2 3.54Å; Y838-F840 PolarHBondContact O-N 3.44Å; Y838-P851 WeakPolarHBondContact CD1-O 2.94Å; Y838-P851 WeakPolarHBondContact CE1-O 3.48Å; Y838-T852 HydrophobicContact CE1-CG2 4.23Å
839	E	25.7	Very low	32.9	Very low	142 Å²	142	133.1 Å²	133.1	66%	0.664	70%	0.695	S	S	*	*			trans	-79.9	100.5	164	-97.3	-173.4	176.1	0	0	109.9	K830 E837 P841	K830-E839 IonicContact NZ-OE2 3.8Å; K830-E839 PolarHBondContact NZ-OE2 3.02Å; E837-E839 PolarHBondContact O-N 2.86Å; E839-P841 WeakPolarHBondContact O-CD 3.45Å
840	F	25.5	Very low	31.5	Very low	127 Å²	127	134 Å²	134	56%	0.557	70%	0.703	S	S	*	*			trans	-63.4	122.4	163.1	-86.9	-95.7	0	0	0	109.6	Y838 S842 I853	Y838-F840 PolarHBondContact O-N 3.44Å; F840-S842 PolarHBondContact O-N 3.41Å; F840-I853 HydrophobicContact CB-CD1 4.29Å; F840-I853 HydrophobicContact CD1-CD1 3.55Å; F840-I853 HydrophobicContact CD1-CG1 4.13Å; F840-I853 HydrophobicContact CE1-CD1 3.99Å; F840-I853 HydrophobicContact CE1-CG1 4.1Å; F840-I853 HydrophobicContact CG-CD1 3.92Å
841	P	28.9	Very low	30.4	Very low	51 Å²	51	130.9 Å²	130.9	33%	0.331	70%	0.698	S	S	.	*			trans	-64.1	122	154.8	-7.4	24.3	0	0	0	106.3	E839 F843 I853	E839-P841 WeakPolarHBondContact O-CD 3.45Å; P841-F843 VanDerWaalsContact C-N 3.31Å; P841-F843 HydrophobicContact CB-CD2 4.24Å; P841-F843 HydrophobicContact CB-CE2 4.22Å; P841-F843 PolarHBondContact O-N 3.27Å; P841-I853 HydrophobicContact CG-CD1 4.48Å
842	S	22.2	Very low	29.6	Very low	123 Å²	123	127.7 Å²	127.7	86%	0.86	68%	0.682	S	S	*	*			trans	-55.1	89.1	179	55.9	0	0	0	0	111.1	F840	F840-S842 PolarHBondContact O-N 3.41Å
843	F	23.6	Very low	29.3	Very low	183 Å²	183	125.8 Å²	125.8	80%	0.803	66%	0.663	S	S	*	*			trans	-97.3	125.5	165.6	-84.7	-82.4	0	0	0	108.4	P841 E845	P841-F843 VanDerWaalsContact C-N 3.31Å; P841-F843 HydrophobicContact CB-CD2 4.24Å; P841-F843 HydrophobicContact CB-CE2 4.22Å; P841-F843 PolarHBondContact O-N 3.27Å; F843-E845 PolarHBondContact O-N 2.68Å; F843-E845 VanDerWaalsContact O-N 3.08Å
844	T	26.6	Very low	29.1	Very low	130 Å²	130	126.3 Å²	126.3	80%	0.798	66%	0.657	S	S	*	*			trans	-46.1	103	-178.3	46.5	0	0	0	0	113.7	K846	T844-K846 VanDerWaalsContact C-N 3.29Å; T844-K846 PolarHBondContact O-N 2.85Å
845	E	28.9	Very low	29.1	Very low	195 Å²	195	128.1 Å²	128.1	91%	0.911	64%	0.637	S	S	*	*	S	Bend	trans	33.8	6.9	144.1	-103.7	178.7	-168.9	0	0	123.7	F843	F843-E845 PolarHBondContact O-N 2.68Å; F843-E845 VanDerWaalsContact O-N 3.08Å
846	K	28.3	Very low	29.7	Very low	204 Å²	204	125.7 Å²	125.7	89%	0.887	63%	0.634	S	S	*	*			trans	-120.3	13.1	-173.6	-75.1	-168.7	177.1	-178.4	0	117.9	T844	T844-K846 VanDerWaalsContact C-N 3.29Å; T844-K846 PolarHBondContact O-N 2.85Å
847	S	27.4	Very low	30.6	Very low	109 Å²	109	121 Å²	121	76%	0.762	61%	0.611	S	S	*	*			trans	-138.2	86.8	165.5	61.5	0	0	0	0	111.1	H849	S847-H849 PolarHBondContact O-N 2.74Å; S847-H849 VanDerWaalsContact O-N 3.16Å
848	L	26.5	Very low	31.7	Very low	153 Å²	153	117.9 Å²	117.9	80%	0.801	60%	0.603	S	S	*	*			trans	-50.4	114.2	147.2	-100.4	76.7	0	0	0	106.2
849	H	27.3	Very low	33	Very low	182 Å²	182	112.3 Å²	112.3	84%	0.843	58%	0.582	S	S	*	*			trans	157.9	113.8	147.8	-76.4	-47.8	0	0	0	109	S847	S847-H849 PolarHBondContact O-N 2.74Å; S847-H849 VanDerWaalsContact O-N 3.16Å
850	D	26.1	Very low	34.7	Very low	93 Å²	93	109.9 Å²	109.9	50%	0.497	57%	0.574	S	S	.	*			trans	92.9	107.5	159.2	-134	-19.4	0	0	0	118.6	T852 R854	D850-T852 PolarHBondContact O-N 3.01Å; D850-R854 IonicContact OD2-CZ 2.85Å; D850-R854 IonicContact OD2-NH2 2.54Å; D850-R854 PolarHBondContact OD2-NH2 3.23Å
851	P	27.9	Very low	36.6	Very low	84 Å²	84	106 Å²	106	55%	0.545	56%	0.558	S	S	.	*	S	Bend	trans	-78.9	28.5	-172.7	33.1	-36.6	0	0	0	115.3	Y838	Y838-P851 WeakPolarHBondContact CD1-O 2.94Å; Y838-P851 WeakPolarHBondContact CE1-O 3.48Å
852	T	29.4	Very low	38.5	Very low	38 Å²	38	108.9 Å²	108.9	23%	0.233	57%	0.571	C	S	.	*	S	Bend	trans	-119.4	112.6	165.3	34.5	0	0	0	0	108.1	Y827 Y838 D850 R854	Y827-T852 HydrophobicContact CE1-CG2 4.09Å; Y838-T852 HydrophobicContact CE1-CG2 4.23Å; D850-T852 PolarHBondContact O-N 3.01Å; T852-R854 VanDerWaalsContact C-N 3.25Å; T852-R854 WeakPolarHBondContact O-CG 3.2Å; T852-R854 PolarHBondContact O-N 2.81Å
853	I	36.2	Very low	40.8	Very low	67 Å²	67	104 Å²	104	34%	0.344	54%	0.535	S	S	.	.			trans	-72.4	92.7	174.4	-63.4	158	0	0	0	107	F840 P841 Y855	F840-I853 HydrophobicContact CB-CD1 4.29Å; F840-I853 HydrophobicContact CD1-CD1 3.55Å; F840-I853 HydrophobicContact CD1-CG1 4.13Å; F840-I853 HydrophobicContact CE1-CD1 3.99Å; F840-I853 HydrophobicContact CE1-CG1 4.1Å; F840-I853 HydrophobicContact CG-CD1 3.92Å; P841-I853 HydrophobicContact CG-CD1 4.48Å; I853-Y855 HydrophobicContact CG2-CD2 4.39Å; I853-Y855 HydrophobicContact CG2-CE2 4Å; I853-Y855 WeakPolarHBondContact O-CD2 3.2Å; I853-Y855 PolarHBondContact O-N 3.23Å
854	R	35.5	Very low	43	Very low	122 Å²	122	96.9 Å²	96.9	46%	0.46	51%	0.505	S	S	.	.			trans	-63.3	95.2	176.3	-64.8	165.8	-164.3	-157.6	17	108.5	Y825 D850 T852	Y825-R854 HydrophobicContact CD1-CB 3.62Å; Y825-R854 HydrophobicContact CD1-CG 3.61Å; Y825-R854 HydrophobicContact CE1-CB 3.72Å; Y825-R854 VanDerWaalsContact CE1-CD 3.46Å; Y825-R854 HydrophobicContact CE1-CG 3.54Å; Y825-R854 HydrophobicContact CG-CG 4.43Å; Y825-R854 PolarHBondContact OH-NH1 2.75Å; D850-R854 IonicContact OD2-CZ 2.85Å; D850-R854 IonicContact OD2-NH2 2.54Å; D850-R854 PolarHBondContact OD2-NH2 3.23Å; T852-R854 VanDerWaalsContact C-N 3.25Å; T852-R854 WeakPolarHBondContact O-CG 3.2Å; T852-R854 PolarHBondContact O-N 2.81Å
855	Y	37.7	Very low	45.1	Very low	126 Å²	126	99.6 Å²	99.6	49%	0.494	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-71.2	138	168.3	-74.7	-83.2	0	0	0	109.5	I853	I853-Y855 HydrophobicContact CG2-CD2 4.39Å; I853-Y855 HydrophobicContact CG2-CE2 4Å; I853-Y855 WeakPolarHBondContact O-CD2 3.2Å; I853-Y855 PolarHBondContact O-N 3.23Å
856	P	46.7	Very low	47.2	Very low	95 Å²	95	92.1 Å²	92.1	62%	0.617	46%	0.464	S	S	*	.			trans	-57.1	146.7	167.8	23.2	-30.8	0	0	0	110.2	T858	P856-T858 PolarHBondContact O-N 3.28Å
857	V	52.1	Low	49.4	Very low	21 Å²	21	82.4 Å²	82.4	13%	0.127	42%	0.422	C	S	.	.	S	Bend	trans	-71.1	44.1	-173.6	-164.4	0	0	0	0	112.5	E824	E824-V857 VanDerWaalsContact O-CG2 3.25Å; E824-V857 WeakPolarHBondContact O-CG2 3.43Å
858	T	51.7	Low	51.6	Low	101 Å²	101	81.3 Å²	81.3	62%	0.62	40%	0.401	S	S	*	.			trans	-100	122.5	166.8	53.1	0	0	0	0	108.4	P856 R871	P856-T858 PolarHBondContact O-N 3.28Å; T858-R871 CarbonylContact C-O 3.55Å; T858-R871 VanDerWaalsContact CA-O 3.31Å; T858-R871 WeakPolarHBondContact CA-O 3.42Å
859	L	58	Low	53.7	Low	12 Å²	12	74 Å²	74	6%	0.063	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.6	-179.1	-167.2	119	0	0	0	109.3	F821 I861 L869 V870 R871	F821-L859 HydrophobicContact CD1-CD1 3.95Å; F821-L859 HydrophobicContact CE1-CD1 2.97Å; F821-L859 HydrophobicContact CE1-CG 4.37Å; F821-L859 HydrophobicContact CE2-CD1 3.71Å; F821-L859 HydrophobicContact CZ-CD1 2.87Å; F821-L859 HydrophobicContact CZ-CG 4.35Å; L859-I861 HydrophobicContact CD1-CD1 3.51Å; L859-I861 HydrophobicContact CD1-CG1 4.1Å; L859-I861 HydrophobicContact CD2-CB 3.92Å; L859-I861 HydrophobicContact CD2-CD1 3.88Å; L859-I861 HydrophobicContact CD2-CG1 3.83Å; L859-I861 HydrophobicContact CG-CB 4.38Å; L859-I861 HydrophobicContact CG-CD1 3.74Å; L859-I861 HydrophobicContact CG-CG1 3.75Å; L859-L869 HydrophobicContact CD2-CB 3.94Å; L859-L869 HydrophobicContact CD2-CD2 3.5Å; L859-L869 HydrophobicContact CD2-CG 3.6Å; L859-V870 CarbonylContact O-C 3.48Å; L859-V870 VanDerWaalsContact O-CA 3.23Å; L859-V870 WeakPolarHBondContact O-CA 3.29Å; L859-R871 HydrophobicContact CB-CB 3.29Å; L859-R871 HydrophobicContact CB-CG 4.48Å; L859-R871 HydrophobicContact CD2-CB 4.49Å; L859-R871 HydrophobicContact CG-CB 4.42Å; L859-R871 PolarHBondContact N-O 3.45Å; L859-R871 PolarHBondContact O-N 2.91Å
860	D	63.2	Low	55.6	Low	92 Å²	92	66.8 Å²	66.8	49%	0.492	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	86.1	165.7	-172.9	3.4	0	0	0	108.1	R868 L869	D860-R868 VanDerWaalsContact CG-NH2 3.26Å; D860-R868 IonicContact OD1-CZ 3.54Å; D860-R868 VanDerWaalsContact OD1-CZ 3.29Å; D860-R868 IonicContact OD1-NE 3.66Å; D860-R868 PolarHBondContact OD1-NE 3.45Å; D860-R868 IonicContact OD1-NH2 3.26Å; D860-R868 PolarHBondContact OD1-NH2 3.37Å; D860-R868 VanDerWaalsContact OD1-NH2 3.1Å; D860-R868 IonicContact OD2-CZ 2.67Å; D860-R868 IonicContact OD2-NE 2.67Å; D860-R868 IonicContact OD2-NH2 3.93Å; D860-R868 PolarHBondContact OD2-NH2 2.72Å; D860-L869 WeakPolarHBondContact CA-O 3.07Å
861	I	64.5	Low	57.2	Low	46 Å²	46	62.7 Å²	62.7	24%	0.236	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.8	-176.9	-64.8	174.3	0	0	0	109.1	V789 F821 L859 L863 L869	V789-I861 HydrophobicContact CG2-CD1 4.48Å; F821-I861 HydrophobicContact CZ-CD1 4.41Å; L859-I861 HydrophobicContact CD1-CD1 3.51Å; L859-I861 HydrophobicContact CD1-CG1 4.1Å; L859-I861 HydrophobicContact CD2-CB 3.92Å; L859-I861 HydrophobicContact CD2-CD1 3.88Å; L859-I861 HydrophobicContact CD2-CG1 3.83Å; L859-I861 HydrophobicContact CG-CB 4.38Å; L859-I861 HydrophobicContact CG-CD1 3.74Å; L859-I861 HydrophobicContact CG-CG1 3.75Å; I861-L863 HydrophobicContact CG2-CD2 3.64Å; I861-L863 HydrophobicContact CG2-CG 4.2Å; I861-L869 PolarHBondContact N-O 2.87Å; I861-L869 PolarHBondContact O-N 3.13Å
862	N	68.1	Low	58.2	Low	110 Å²	110	62 Å²	62	59%	0.588	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	103.8	169.6	-159.1	21.7	0	0	0	109.1	N864 I867	N862-N864 PolarHBondContact OD1-O 3.13Å; N862-I867 PolarHBondContact OD1-O 2.74Å
863	L	70.3	Confident	59.1	Low	21 Å²	21	62.8 Å²	62.8	11%	0.11	31%	0.307	C	S	.	.			trans	-77.1	-35.9	-174.1	-64	171.5	0	0	0	111.6	I665 I778 A779 V789 I861 I867 L869	I665-L863 HydrophobicContact CB-CD1 4.25Å; I665-L863 HydrophobicContact CD1-CD1 3.69Å; I665-L863 HydrophobicContact CG2-CD1 3.72Å; I778-L863 HydrophobicContact CG2-CB 4.35Å; I778-L863 HydrophobicContact CG2-CD2 3.78Å; I778-L863 HydrophobicContact CG2-CG 4.48Å; A779-L863 HydrophobicContact CB-CD1 4.36Å; V789-L863 HydrophobicContact CG1-CD2 4.07Å; I861-L863 HydrophobicContact CG2-CD2 3.64Å; I861-L863 HydrophobicContact CG2-CG 4.2Å; L863-I867 HydrophobicContact CD1-CG2 4.21Å; L863-I867 PolarHBondContact N-O 3.08Å; L863-L869 HydrophobicContact CD1-CB 4.47Å
864	N	71.1	Confident	59.8	Low	33 Å²	33	61.6 Å²	61.6	18%	0.176	30%	0.304	C	S	.	.	S	Bend	trans	-159.1	-174.6	172.3	63.3	38.9	0	0	0	110.8	Y572 N862 Y866 I867	Y572-N864 PolarHBondContact OH-ND2 3.37Å; N862-N864 PolarHBondContact OD1-O 3.13Å; N864-Y866 PolarHBondContact O-N 3.48Å; N864-Y866 VanDerWaalsContact O-N 3.1Å; N864-Y866 WeakPolarHBondContact OD1-CA 3.47Å; N864-Y866 WeakPolarHBondContact OD1-CB 3.25Å; N864-Y866 PolarHBondContact OD1-N 2.98Å; N864-I867 PolarHBondContact N-O 3.14Å; N864-I867 PolarHBondContact O-N 3.24Å; N864-I867 PolarHBondContact OD1-N 3Å
865	R	70.1	Confident	60.5	Low	187 Å²	187	58.3 Å²	58.3	71%	0.706	29%	0.294	S	S	*	.	S	Bend	trans	-57.9	-24.7	179.6	-167.8	-178.8	-175.3	-178.5	5.8	113.6	E884	R865-E884 IonicContact CZ-OE1 3.33Å; R865-E884 VanDerWaalsContact CZ-OE1 3.26Å; R865-E884 IonicContact NE-OE1 2.72Å; R865-E884 IonicContact NH1-OE1 3.8Å; R865-E884 PolarHBondContact NH1-OE1 3.17Å
866	Y	72.4	Confident	61.5	Low	38 Å²	38	55.3 Å²	55.3	15%	0.149	29%	0.286	C	S	.	.	S	Bend	trans	-101.4	-35	-175.5	-60	-96.4	0	0	0	112.8	Y572 I668 N864 F881 K882 E884	Y572-Y866 HydrophobicContact CD1-CD1 4.49Å; Y572-Y866 HydrophobicContact CD1-CD2 4.42Å; Y572-Y866 HydrophobicContact CD1-CG 4.19Å; Y572-Y866 HydrophobicContact CE1-CD2 4.18Å; Y572-Y866 HydrophobicContact CE1-CG 4.04Å; I668-Y866 HydrophobicContact CD1-CD2 3.63Å; I668-Y866 HydrophobicContact CD1-CE2 3.42Å; I668-Y866 VanDerWaalsContact CD1-CE2 3.42Å; N864-Y866 PolarHBondContact O-N 3.48Å; N864-Y866 VanDerWaalsContact O-N 3.1Å; N864-Y866 WeakPolarHBondContact OD1-CA 3.47Å; N864-Y866 WeakPolarHBondContact OD1-CB 3.25Å; N864-Y866 PolarHBondContact OD1-N 2.98Å; Y866-F881 CarbonylContact O-C 3.59Å; Y866-F881 WeakPolarHBondContact O-CA 3.34Å; Y866-K882 WeakPolarHBondContact CA-O 3.45Å; Y866-K882 WeakPolarHBondContact CB-O 3.38Å; Y866-K882 WeakPolarHBondContact CD1-O 3.23Å; Y866-K882 PolarHBondContact O-N 3.33Å; Y866-E884 HydrophobicContact CE1-CG 4.03Å; Y866-E884 PolarHBondContact OH-OE1 3.18Å
867	I	75.6	Confident	62.4	Low	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119	-169.9	-47.6	-168.9	0	0	0	110.8	Y572 A578 I579 I665 N862 L863 N864 I879 F881	Y572-I867 HydrophobicContact CE1-CD1 4.37Å; Y572-I867 HydrophobicContact CE1-CG1 4.41Å; Y572-I867 WeakPolarHBondContact OH-CD1 3.22Å; A578-I867 HydrophobicContact CB-CD1 4.09Å; I579-I867 HydrophobicContact CG1-CD1 4.1Å; I665-I867 HydrophobicContact CG2-CD1 3.66Å; I665-I867 HydrophobicContact CG2-CG2 4.11Å; N862-I867 PolarHBondContact OD1-O 2.74Å; L863-I867 HydrophobicContact CD1-CG2 4.21Å; L863-I867 PolarHBondContact N-O 3.08Å; N864-I867 PolarHBondContact N-O 3.14Å; N864-I867 PolarHBondContact O-N 3.24Å; N864-I867 PolarHBondContact OD1-N 3Å; I867-I879 HydrophobicContact CG2-CG2 4.07Å; I867-F881 HydrophobicContact CD1-CD2 4.17Å; I867-F881 HydrophobicContact CD1-CE2 4.21Å; I867-F881 HydrophobicContact CG1-CD2 3.75Å; I867-F881 HydrophobicContact CG1-CE2 3.94Å
868	R	73.9	Confident	63.2	Low	86 Å²	86	51 Å²	51	33%	0.325	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	167	-177.9	-176	-177.5	-177.5	7.1	109.3	D860 V870 I880	D860-R868 VanDerWaalsContact CG-NH2 3.26Å; D860-R868 IonicContact OD1-CZ 3.54Å; D860-R868 VanDerWaalsContact OD1-CZ 3.29Å; D860-R868 IonicContact OD1-NE 3.66Å; D860-R868 PolarHBondContact OD1-NE 3.45Å; D860-R868 IonicContact OD1-NH2 3.26Å; D860-R868 PolarHBondContact OD1-NH2 3.37Å; D860-R868 VanDerWaalsContact OD1-NH2 3.1Å; D860-R868 IonicContact OD2-CZ 2.67Å; D860-R868 IonicContact OD2-NE 2.67Å; D860-R868 IonicContact OD2-NH2 3.93Å; D860-R868 PolarHBondContact OD2-NH2 2.72Å; R868-V870 HydrophobicContact CG-CG2 4.2Å; R868-I880 HydrophobicContact CB-CB 4.29Å; R868-I880 PolarHBondContact N-O 2.96Å; R868-I880 PolarHBondContact O-N 2.81Å
869	L	70.9	Confident	64.2	Low	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124	176.4	-175.4	66.5	0	0	0	109	I665 F781 L859 D860 I861 L863 L877 I879	I665-L869 HydrophobicContact CD1-CD1 4.31Å; I665-L869 HydrophobicContact CD1-CD2 4.38Å; F781-L869 HydrophobicContact CE2-CD2 3.54Å; F781-L869 HydrophobicContact CZ-CD2 3.46Å; F781-L869 VanDerWaalsContact CZ-CD2 3.46Å; L859-L869 HydrophobicContact CD2-CB 3.94Å; L859-L869 HydrophobicContact CD2-CD2 3.5Å; L859-L869 HydrophobicContact CD2-CG 3.6Å; D860-L869 WeakPolarHBondContact CA-O 3.07Å; I861-L869 PolarHBondContact N-O 2.87Å; I861-L869 PolarHBondContact O-N 3.13Å; L863-L869 HydrophobicContact CD1-CB 4.47Å; L869-L877 HydrophobicContact CD1-CD1 4.04Å; L869-L877 HydrophobicContact CD1-CD2 3.69Å; L869-L877 HydrophobicContact CD1-CG 3.8Å; L869-I879 HydrophobicContact CD1-CB 4.48Å; L869-I879 HydrophobicContact CD1-CG1 3.78Å
870	V	66.5	Low	65	Low	30 Å²	30	47 Å²	47	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	104.5	175.7	-173.4	0	0	0	0	108.2	L859 R868 T872 T878 I880	L859-V870 CarbonylContact O-C 3.48Å; L859-V870 VanDerWaalsContact O-CA 3.23Å; L859-V870 WeakPolarHBondContact O-CA 3.29Å; R868-V870 HydrophobicContact CG-CG2 4.2Å; V870-T872 HydrophobicContact CG1-CG2 4.13Å; V870-T878 CarbonylContact C-O 3.53Å; V870-T878 PolarHBondContact N-O 3.3Å; V870-T878 WeakPolarHBondContact O-CA 3.37Å; V870-T878 WeakPolarHBondContact O-CB 3.42Å; V870-T878 PolarHBondContact O-N 2.88Å; V870-T878 VanDerWaalsContact O-O 3.04Å; V870-I880 HydrophobicContact CG2-CD1 3.96Å
871	R	59	Low	65.7	Low	7 Å²	7	42.6 Å²	42.6	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.1	172.7	-165.3	177.6	-179.6	154.6	3.4	107.6	G785 T858 L859 N873 L877	G785-R871 VanDerWaalsContact O-CZ 3.3Å; G785-R871 PolarHBondContact O-NH1 2.85Å; G785-R871 PolarHBondContact O-NH2 3.28Å; T858-R871 CarbonylContact C-O 3.55Å; T858-R871 VanDerWaalsContact CA-O 3.31Å; T858-R871 WeakPolarHBondContact CA-O 3.42Å; L859-R871 HydrophobicContact CB-CB 3.29Å; L859-R871 HydrophobicContact CB-CG 4.48Å; L859-R871 HydrophobicContact CD2-CB 4.49Å; L859-R871 HydrophobicContact CG-CB 4.42Å; L859-R871 PolarHBondContact N-O 3.45Å; L859-R871 PolarHBondContact O-N 2.91Å; R871-N873 WeakPolarHBondContact CG-O 3.26Å; R871-N873 PolarHBondContact NE-O 3.07Å; R871-L877 HydrophobicContact CG-CD1 4.48Å
872	T	49.8	Very low	66	Low	69 Å²	69	44.5 Å²	44.5	42%	0.423	22%	0.216	S	C	.	.			trans	-91	-29.2	-176.9	52.7	0	0	0	0	111.6	V870 D876	V870-T872 HydrophobicContact CG1-CG2 4.13Å; T872-D876 PolarHBondContact N-O 3.3Å; T872-D876 WeakPolarHBondContact OG1-CB 3.45Å; T872-D876 PolarHBondContact OG1-O 3.35Å
873	N	48.8	Very low	65.8	Low	56 Å²	56	40 Å²	40	30%	0.299	19%	0.192	S	C	.	.	S	Bend	trans	-159	-172.4	174.9	63.2	49.6	0	0	0	112.2	R871 H875 D876	R871-N873 WeakPolarHBondContact CG-O 3.26Å; R871-N873 PolarHBondContact NE-O 3.07Å; N873-H875 PolarHBondContact O-N 3.38Å; N873-H875 VanDerWaalsContact OD1-CA 3.29Å; N873-H875 WeakPolarHBondContact OD1-CA 3.43Å; N873-H875 WeakPolarHBondContact OD1-CB 3.47Å; N873-H875 PolarHBondContact OD1-N 2.85Å; N873-D876 PolarHBondContact N-O 3.48Å; N873-D876 PolarHBondContact ND2-OD2 2.95Å; N873-D876 WeakPolarHBondContact OD1-CB 3.47Å; N873-D876 PolarHBondContact OD1-N 3.4Å
874	S	49.2	Very low	65.2	Low	42 Å²	42	44.4 Å²	44.4	29%	0.294	21%	0.212	S	C	.	.	S	Bend	trans	-69.4	-14.1	178	46.4	0	0	0	0	114.5
875	H	50.5	Low	64.4	Low	52 Å²	52	47.1 Å²	47.1	24%	0.241	22%	0.224	C	C	.	.	S	Bend	trans	-115.2	-20.7	-174.1	-55.4	96.5	0	0	0	114.2	N873 F894 Q895 L897	N873-H875 PolarHBondContact O-N 3.38Å; N873-H875 VanDerWaalsContact OD1-CA 3.29Å; N873-H875 WeakPolarHBondContact OD1-CA 3.43Å; N873-H875 WeakPolarHBondContact OD1-CB 3.47Å; N873-H875 PolarHBondContact OD1-N 2.85Å; H875-F894 CarbonylContact O-C 3.58Å; H875-F894 WeakPolarHBondContact O-CA 3.12Å; H875-Q895 PolarHBondContact O-N 2.82Å; H875-L897 VanDerWaalsContact CD2-CD1 3.49Å; H875-L897 WeakPolarHBondContact CD2-CD1 3.46Å; H875-L897 WeakPolarHBondContact NE2-CD1 3.47Å
876	D	58.3	Low	63.7	Low	64 Å²	64	39.7 Å²	39.7	34%	0.342	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120	-173.1	-62	-37.5	0	0	0	110	T872 N873 F894	T872-D876 PolarHBondContact N-O 3.3Å; T872-D876 WeakPolarHBondContact OG1-CB 3.45Å; T872-D876 PolarHBondContact OG1-O 3.35Å; N873-D876 PolarHBondContact N-O 3.48Å; N873-D876 PolarHBondContact ND2-OD2 2.95Å; N873-D876 WeakPolarHBondContact OD1-CB 3.47Å; N873-D876 PolarHBondContact OD1-N 3.4Å; D876-F894 WeakPolarHBondContact OD1-CB 3.44Å
877	L	66.3	Low	62.8	Low	4 Å²	4	38 Å²	38	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	119.2	177.2	177.7	143	0	0	0	108.7	F661 L663 F781 L869 R871 I879 C893	F661-L877 HydrophobicContact CZ-CB 4.27Å; L663-L877 HydrophobicContact CD2-CD1 4.23Å; L663-L877 HydrophobicContact CD2-CD2 3.33Å; L663-L877 HydrophobicContact CD2-CG 4.43Å; F781-L877 HydrophobicContact CD1-CD1 4.13Å; F781-L877 HydrophobicContact CD2-CD1 4.41Å; F781-L877 HydrophobicContact CE1-CD1 4.05Å; F781-L877 HydrophobicContact CE2-CD1 4.33Å; F781-L877 HydrophobicContact CG-CD1 4.33Å; F781-L877 HydrophobicContact CZ-CD1 4.17Å; L869-L877 HydrophobicContact CD1-CD1 4.04Å; L869-L877 HydrophobicContact CD1-CD2 3.69Å; L869-L877 HydrophobicContact CD1-CG 3.8Å; R871-L877 HydrophobicContact CG-CD1 4.48Å; L877-I879 HydrophobicContact CD2-CD1 3.95Å; L877-I879 HydrophobicContact CD2-CG1 3.56Å; L877-C893 HydrophobicContact CB-CB 4.35Å; L877-C893 HydrophobicContact CD2-CB 4.15Å; L877-C893 PolarHBondContact N-O 3.27Å; L877-C893 WeakPolarHBondContact O-CA 3.35Å; L877-C893 WeakPolarHBondContact O-CB 3.38Å; L877-C893 PolarHBondContact O-N 3.04Å
878	T	69.7	Low	62.2	Low	22 Å²	22	39.9 Å²	39.9	14%	0.135	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.6	-178.9	-51	0	0	0	0	109.7	V870 I880 T890 I891 D892	V870-T878 CarbonylContact C-O 3.53Å; V870-T878 PolarHBondContact N-O 3.3Å; V870-T878 WeakPolarHBondContact O-CA 3.37Å; V870-T878 WeakPolarHBondContact O-CB 3.42Å; V870-T878 PolarHBondContact O-N 2.88Å; V870-T878 VanDerWaalsContact O-O 3.04Å; T878-I880 HydrophobicContact CG2-CG1 4.37Å; T878-T890 HydrophobicContact CG2-CG2 3.39Å; T878-I891 CarbonylContact C-O 3.42Å; T878-I891 WeakPolarHBondContact CA-O 3.41Å; T878-D892 VanDerWaalsContact CG2-OD1 3.29Å; T878-D892 WeakPolarHBondContact CG2-OD1 3.09Å; T878-D892 PolarHBondContact OG1-OD1 2.98Å
879	I	72.5	Confident	61.6	Low	1 Å²	1	36 Å²	36	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.5	176.2	-43.8	175.3	0	0	0	108.4	I579 L663 I867 L869 L877 T890 I891	I579-I879 HydrophobicContact CD1-CG2 3.65Å; I579-I879 HydrophobicContact CG1-CG2 4.43Å; I579-I879 HydrophobicContact CG2-CD1 3.95Å; L663-I879 HydrophobicContact CD1-CD1 3.46Å; L663-I879 VanDerWaalsContact CD1-CD1 3.46Å; L663-I879 HydrophobicContact CD2-CD1 3.54Å; L663-I879 HydrophobicContact CD2-CG1 4.29Å; L663-I879 HydrophobicContact CG-CD1 4.13Å; I867-I879 HydrophobicContact CG2-CG2 4.07Å; L869-I879 HydrophobicContact CD1-CB 4.48Å; L869-I879 HydrophobicContact CD1-CG1 3.78Å; L877-I879 HydrophobicContact CD2-CD1 3.95Å; L877-I879 HydrophobicContact CD2-CG1 3.56Å; I879-T890 CarbonylContact O-C 3.42Å; I879-T890 WeakPolarHBondContact O-CA 3.3Å; I879-I891 HydrophobicContact CB-CB 4.29Å; I879-I891 PolarHBondContact N-O 3.4Å; I879-I891 PolarHBondContact O-N 2.93Å
880	I	74.6	Confident	61.4	Low	27 Å²	27	37 Å²	37	14%	0.138	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.5	176.7	-55.7	173.2	0	0	0	107.5	R868 V870 T878 K882 I888 T890	R868-I880 HydrophobicContact CB-CB 4.29Å; R868-I880 PolarHBondContact N-O 2.96Å; R868-I880 PolarHBondContact O-N 2.81Å; V870-I880 HydrophobicContact CG2-CD1 3.96Å; T878-I880 HydrophobicContact CG2-CG1 4.37Å; I880-K882 HydrophobicContact CG2-CG 3.99Å; I880-I888 HydrophobicContact CG2-CG2 3.72Å; I880-T890 HydrophobicContact CG1-CG2 4.29Å
881	F	77.8	Confident	61.3	Low	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	110.8	173	-171.6	-95.7	0	0	0	109.5	W559 V570 Y572 A578 I579 Y866 I867 T883 L889	W559-F881 AromaticContact CE2-CE1 3.77Å; W559-F881 HydrophobicContact CH2-CD1 4.29Å; W559-F881 AromaticContact CZ2-CD1 3.65Å; W559-F881 HydrophobicContact CZ2-CD1 3.65Å; W559-F881 AromaticContact CZ2-CE1 3.47Å; W559-F881 HydrophobicContact CZ2-CE1 3.47Å; W559-F881 VanDerWaalsContact CZ2-CE1 3.47Å; W559-F881 AromaticContact NE1-CE1 3.68Å; V570-F881 HydrophobicContact CG1-CD1 4.07Å; V570-F881 HydrophobicContact CG1-CD2 4.4Å; V570-F881 HydrophobicContact CG1-CE1 4.18Å; V570-F881 HydrophobicContact CG1-CG 4.2Å; V570-F881 HydrophobicContact CG1-CZ 4.45Å; Y572-F881 HydrophobicContact CD1-CE2 4.04Å; Y572-F881 AromaticContact CD1-CZ 4Å; Y572-F881 HydrophobicContact CD1-CZ 4Å; Y572-F881 AromaticContact CE1-CE2 3.94Å; Y572-F881 HydrophobicContact CE1-CE2 3.94Å; Y572-F881 HydrophobicContact CE1-CZ 4.35Å; A578-F881 HydrophobicContact CB-CD2 4.43Å; A578-F881 HydrophobicContact CB-CE2 3.68Å; A578-F881 HydrophobicContact CB-CZ 4.29Å; I579-F881 HydrophobicContact CD1-CB 4.12Å; I579-F881 HydrophobicContact CD1-CD2 3.98Å; I579-F881 HydrophobicContact CD1-CG 4.38Å; Y866-F881 CarbonylContact O-C 3.59Å; Y866-F881 WeakPolarHBondContact O-CA 3.34Å; I867-F881 HydrophobicContact CD1-CD2 4.17Å; I867-F881 HydrophobicContact CD1-CE2 4.21Å; I867-F881 HydrophobicContact CG1-CD2 3.75Å; I867-F881 HydrophobicContact CG1-CE2 3.94Å; F881-T883 HydrophobicContact CD1-CG2 4.46Å; F881-T883 HydrophobicContact CE1-CG2 3.76Å; F881-T883 HydrophobicContact CZ-CG2 4.5Å; F881-L889 HydrophobicContact CB-CB 4.28Å; F881-L889 HydrophobicContact CB-CD2 4.29Å; F881-L889 PolarHBondContact N-O 3.35Å; F881-L889 PolarHBondContact O-N 2.87Å
882	K	71.6	Confident	61.7	Low	86 Å²	86	36.9 Å²	36.9	37%	0.374	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.7	177.1	-59.8	-174	178	179.2	0	108.9	Y866 I880 I888	Y866-K882 WeakPolarHBondContact CA-O 3.45Å; Y866-K882 WeakPolarHBondContact CB-O 3.38Å; Y866-K882 WeakPolarHBondContact CD1-O 3.23Å; Y866-K882 PolarHBondContact O-N 3.33Å; I880-K882 HydrophobicContact CG2-CG 3.99Å; K882-I888 HydrophobicContact CG-CG1 4.22Å; K882-I888 HydrophobicContact CG-CG2 4.28Å
883	T	63.6	Low	62.6	Low	15 Å²	15	33.6 Å²	33.6	9%	0.092	17%	0.172	C	C	.	.			trans	-98.7	160.3	163.5	42.6	0	0	0	0	110.3	W559 P573 F881 E885 V887	W559-T883 HydrophobicContact CH2-CG2 4.46Å; W559-T883 HydrophobicContact CZ2-CG2 3.43Å; W559-T883 VanDerWaalsContact CZ2-CG2 3.43Å; P573-T883 HydrophobicContact CG-CG2 4.11Å; F881-T883 HydrophobicContact CD1-CG2 4.46Å; F881-T883 HydrophobicContact CE1-CG2 3.76Å; F881-T883 HydrophobicContact CZ-CG2 4.5Å; T883-E885 PolarHBondContact O-N 3.38Å; T883-V887 PolarHBondContact N-O 3.06Å; T883-V887 PolarHBondContact OG1-O 3.28Å
884	E	56.9	Low	63.2	Low	114 Å²	114	33.1 Å²	33.1	53%	0.533	17%	0.167	S	C	.	.	S	Bend	trans	-60.8	-25.7	174	-62.5	-169.9	166.2	0	0	111.3	R865 Y866 D886	R865-E884 IonicContact CZ-OE1 3.33Å; R865-E884 VanDerWaalsContact CZ-OE1 3.26Å; R865-E884 IonicContact NE-OE1 2.72Å; R865-E884 IonicContact NH1-OE1 3.8Å; R865-E884 PolarHBondContact NH1-OE1 3.17Å; Y866-E884 HydrophobicContact CE1-CG 4.03Å; Y866-E884 PolarHBondContact OH-OE1 3.18Å; E884-D886 PolarHBondContact O-N 2.13Å
885	E	54.5	Low	63.6	Low	90 Å²	90	32.1 Å²	32.1	42%	0.421	16%	0.158	S	C	.	.	S	Bend	trans	-95.7	73.1	178.7	-67.9	-178.9	-130.5	0	0	111.3	Y371 T883 V887	Y371-E885 WeakPolarHBondContact CE1-OE2 3.42Å; Y371-E885 WeakPolarHBondContact OH-CB 3.39Å; Y371-E885 WeakPolarHBondContact OH-CG 3.34Å; Y371-E885 PolarHBondContact OH-OE2 3.07Å; T883-E885 PolarHBondContact O-N 3.38Å; E885-V887 PolarHBondContact O-N 2.85Å
886	D	54.3	Low	63.6	Low	31 Å²	31	31.8 Å²	31.8	17%	0.166	16%	0.158	C	C	.	.	S	Bend	trans	48.3	5.7	156.5	-68.3	-31.5	0	0	0	120.6	K378 K432 I433 E884	K378-D886 VanDerWaalsContact CE-OD2 3.25Å; K378-D886 WeakPolarHBondContact CE-OD2 3.48Å; K378-D886 IonicContact NZ-OD2 3.83Å; K378-D886 PolarHBondContact NZ-OD2 3.28Å; K432-D886 CarbonylContact C-O 3.5Å; K432-D886 VanDerWaalsContact CA-O 3.29Å; K432-D886 WeakPolarHBondContact CA-O 3.39Å; K432-D886 HydrophobicContact CB-CB 4.47Å; K432-D886 WeakPolarHBondContact CE-OD1 3.41Å; K432-D886 HydrophobicContact CG-CB 3.81Å; K432-D886 WeakPolarHBondContact CG-OD1 3.4Å; I433-D886 PolarHBondContact N-O 3.41Å; E884-D886 PolarHBondContact O-N 2.13Å
887	V	54.5	Low	62.9	Low	3 Å²	3	33 Å²	33	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.8	176.9	-177.2	0	0	0	0	108.3	I433 L435 W559 T883 E885	I433-V887 WeakPolarHBondContact O-CA 3.29Å; L435-V887 HydrophobicContact CD1-CG1 4.26Å; W559-V887 HydrophobicContact CH2-CB 4.3Å; W559-V887 HydrophobicContact CH2-CG1 3.77Å; W559-V887 HydrophobicContact CZ3-CG1 4.04Å; T883-V887 PolarHBondContact N-O 3.06Å; T883-V887 PolarHBondContact OG1-O 3.28Å; E885-V887 PolarHBondContact O-N 2.85Å
888	I	63.7	Low	61.7	Low	39 Å²	39	36.6 Å²	36.6	20%	0.2	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.4	174.1	-57.7	179.3	0	0	0	107.5	I433 T434 L435 I880 K882	I433-I888 PolarHBondContact O-N 3.33Å; T434-I888 CarbonylContact C-O 3.45Å; T434-I888 WeakPolarHBondContact CA-O 3.42Å; T434-I888 HydrophobicContact CG2-CB 4.16Å; T434-I888 HydrophobicContact CG2-CG2 4.2Å; L435-I888 PolarHBondContact N-O 3.04Å; I880-I888 HydrophobicContact CG2-CG2 3.72Å; K882-I888 HydrophobicContact CG-CG1 4.22Å; K882-I888 HydrophobicContact CG-CG2 4.28Å
889	L	61.6	Low	59.9	Low	3 Å²	3	39.2 Å²	39.2	2%	0.016	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	113.7	176.6	-173.4	123.1	0	0	0	109.1	L435 F437 W559 V560 V570 F881 I891	L435-L889 WeakPolarHBondContact O-CA 3.4Å; F437-L889 HydrophobicContact CD2-CD1 3.68Å; F437-L889 HydrophobicContact CD2-CG 4.02Å; F437-L889 HydrophobicContact CE2-CD1 3.52Å; F437-L889 HydrophobicContact CE2-CG 4.33Å; W559-L889 HydrophobicContact CH2-CB 4.3Å; W559-L889 HydrophobicContact CH2-CD1 4.49Å; W559-L889 HydrophobicContact CZ3-CD1 4.03Å; V560-L889 HydrophobicContact CG2-CD1 4Å; V570-L889 HydrophobicContact CG2-CD2 4.3Å; F881-L889 HydrophobicContact CB-CB 4.28Å; F881-L889 HydrophobicContact CB-CD2 4.29Å; F881-L889 PolarHBondContact N-O 3.35Å; F881-L889 PolarHBondContact O-N 2.87Å; L889-I891 HydrophobicContact CD2-CD1 3.51Å; L889-I891 HydrophobicContact CD2-CG1 3.49Å; L889-I891 VanDerWaalsContact CD2-CG1 3.49Å; L889-I891 HydrophobicContact CG-CG1 4.44Å
890	T	66	Low	57.9	Low	21 Å²	21	46.3 Å²	46.3	13%	0.129	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123	177.5	-55.7	0	0	0	0	108.8	L435 L436 F437 T878 I879 I880	L435-T890 PolarHBondContact O-N 3.34Å; L436-T890 HydrophobicContact CD1-CG2 3.47Å; L436-T890 VanDerWaalsContact CD1-CG2 3.47Å; F437-T890 PolarHBondContact N-O 3.5Å; T878-T890 HydrophobicContact CG2-CG2 3.39Å; I879-T890 CarbonylContact O-C 3.42Å; I879-T890 WeakPolarHBondContact O-CA 3.3Å; I880-T890 HydrophobicContact CG1-CG2 4.29Å
891	I	64.8	Low	55.6	Low	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	107.5	-179.5	-56.8	165.1	0	0	0	109	F437 V439 L568 V570 I579 T878 I879 L889 C893	F437-I891 CarbonylContact O-C 3.58Å; F437-I891 WeakPolarHBondContact O-CA 3.45Å; V439-I891 HydrophobicContact CB-CG2 4.12Å; V439-I891 HydrophobicContact CG2-CG2 3.67Å; L568-I891 HydrophobicContact CD2-CD1 3.95Å; L568-I891 HydrophobicContact CD2-CG1 4.49Å; L568-I891 HydrophobicContact CD2-CG2 4.17Å; V570-I891 HydrophobicContact CG2-CD1 3.92Å; I579-I891 HydrophobicContact CD1-CD1 4.18Å; T878-I891 CarbonylContact C-O 3.42Å; T878-I891 WeakPolarHBondContact CA-O 3.41Å; I879-I891 HydrophobicContact CB-CB 4.29Å; I879-I891 PolarHBondContact N-O 3.4Å; I879-I891 PolarHBondContact O-N 2.93Å; L889-I891 HydrophobicContact CD2-CD1 3.51Å; L889-I891 HydrophobicContact CD2-CG1 3.49Å; L889-I891 VanDerWaalsContact CD2-CG1 3.49Å; L889-I891 HydrophobicContact CG-CG1 4.44Å; I891-C893 PolarHBondContact O-N 3.03Å
892	D	67.3	Low	53.1	Low	33 Å²	33	57 Å²	57	18%	0.176	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108.9	171.7	-64.2	-14.5	0	0	0	109.4	F437 K438 V439 T878	F437-D892 PolarHBondContact O-N 2.82Å; K438-D892 WeakPolarHBondContact CE-OD2 3.43Å; K438-D892 HydrophobicContact CG-CB 4.1Å; V439-D892 PolarHBondContact N-O 3.19Å; T878-D892 VanDerWaalsContact CG2-OD1 3.29Å; T878-D892 WeakPolarHBondContact CG2-OD1 3.09Å; T878-D892 PolarHBondContact OG1-OD1 2.98Å
893	C	67.5	Low	50.9	Low	1 Å²	1	55.8 Å²	55.8	1%	0.007	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110.6	172.9	-57.8	0	0	0	0	109.3	V439 W581 F661 L877 I891	V439-C893 WeakPolarHBondContact O-CA 3.38Å; W581-C893 VanDerWaalsContact CD1-SG 3.59Å; F661-C893 HydrophobicContact CE1-CB 4.37Å; F661-C893 HydrophobicContact CE2-CB 4.39Å; F661-C893 HydrophobicContact CZ-CB 4.14Å; L877-C893 HydrophobicContact CB-CB 4.35Å; L877-C893 HydrophobicContact CD2-CB 4.15Å; L877-C893 PolarHBondContact N-O 3.27Å; L877-C893 WeakPolarHBondContact O-CA 3.35Å; L877-C893 WeakPolarHBondContact O-CB 3.38Å; L877-C893 PolarHBondContact O-N 3.04Å; I891-C893 PolarHBondContact O-N 3.03Å
894	F	61.5	Low	48.9	Very low	45 Å²	45	64 Å²	64	20%	0.197	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.8	-178.7	61.8	-86.1	0	0	0	113	K438 V439 F441 H875 D876 N896	K438-F894 HydrophobicContact CB-CE1 4.21Å; V439-F894 WeakPolarHBondContact O-CD1 3.4Å; V439-F894 WeakPolarHBondContact O-CE1 3.38Å; V439-F894 PolarHBondContact O-N 3.04Å; F441-F894 WeakPolarHBondContact O-CE2 3.42Å; H875-F894 CarbonylContact O-C 3.58Å; H875-F894 WeakPolarHBondContact O-CA 3.12Å; D876-F894 WeakPolarHBondContact OD1-CB 3.44Å; F894-N896 WeakPolarHBondContact CD2-OD1 3.41Å; F894-N896 WeakPolarHBondContact CE2-OD1 3.48Å
895	Q	57.4	Low	47.3	Very low	21 Å²	21	64.5 Å²	64.5	10%	0.098	37%	0.366	C	S	.	.			trans	-97.4	115.4	166	-67.8	-174.6	2.3	0	0	109.6	T659 F661 P783 H875 L897	T659-Q895 PolarHBondContact O-OE1 2.89Å; T659-Q895 VanDerWaalsContact O-OE1 3.11Å; F661-Q895 HydrophobicContact CD1-CG 3.75Å; F661-Q895 HydrophobicContact CE1-CG 3.79Å; P783-Q895 PolarHBondContact O-NE2 3.15Å; H875-Q895 PolarHBondContact O-N 2.82Å; Q895-L897 PolarHBondContact O-N 3.3Å; Q895-L897 VanDerWaalsContact O-N 3.07Å
896	N	51.5	Low	45.7	Very low	45 Å²	45	66.8 Å²	66.8	24%	0.241	38%	0.381	C	S	.	.			trans	-69.9	108.4	169.4	-77.8	-12.8	0	0	0	109.4	F441 T659 F894 Y898	F441-N896 PolarHBondContact O-ND2 2.74Å; T659-N896 PolarHBondContact OG1-O 2.71Å; T659-N896 VanDerWaalsContact OG1-O 3.06Å; F894-N896 WeakPolarHBondContact CD2-OD1 3.41Å; F894-N896 WeakPolarHBondContact CE2-OD1 3.48Å; N896-Y898 HydrophobicContact CB-CD2 4.49Å; N896-Y898 HydrophobicContact CB-CE1 4.48Å; N896-Y898 HydrophobicContact CB-CE2 3.92Å; N896-Y898 PolarHBondContact ND2-OH 3.41Å; N896-Y898 PolarHBondContact O-N 3.44Å
897	L	42.8	Very low	44.3	Very low	91 Å²	91	71.8 Å²	71.8	48%	0.476	41%	0.413	S	S	.	.			trans	-74.4	112.1	157.5	-73.6	171.9	0	0	0	107.7	H875 Q895 S899	H875-L897 VanDerWaalsContact CD2-CD1 3.49Å; H875-L897 WeakPolarHBondContact CD2-CD1 3.46Å; H875-L897 WeakPolarHBondContact NE2-CD1 3.47Å; Q895-L897 PolarHBondContact O-N 3.3Å; Q895-L897 VanDerWaalsContact O-N 3.07Å; L897-S899 PolarHBondContact O-N 3.02Å
898	Y	42.5	Very low	42.8	Very low	79 Å²	79	82.2 Å²	82.2	31%	0.31	45%	0.454	S	S	.	.			trans	-83.5	102.7	167.6	-67.1	-72.5	0	0	0	108.2	R443 N896	R443-Y898 HydrophobicContact CB-CE1 4.28Å; R443-Y898 WeakPolarHBondContact CB-OH 3.22Å; R443-Y898 HydrophobicContact CG-CE1 4.1Å; R443-Y898 HydrophobicContact CG-CE2 4.15Å; R443-Y898 WeakPolarHBondContact CG-OH 3.41Å; R443-Y898 PolarHBondContact N-OH 3.43Å; N896-Y898 HydrophobicContact CB-CD2 4.49Å; N896-Y898 HydrophobicContact CB-CE1 4.48Å; N896-Y898 HydrophobicContact CB-CE2 3.92Å; N896-Y898 PolarHBondContact ND2-OH 3.41Å; N896-Y898 PolarHBondContact O-N 3.44Å
899	S	31	Very low	40.9	Very low	77 Å²	77	87.6 Å²	87.6	54%	0.538	48%	0.483	S	S	.	.			trans	-64.1	131.6	156.3	41.2	0	0	0	0	107.6	L897 D901	L897-S899 PolarHBondContact O-N 3.02Å; S899-D901 WeakPolarHBondContact CB-OD2 3.34Å; S899-D901 PolarHBondContact O-N 3.26Å; S899-D901 PolarHBondContact OG-OD2 2.85Å
900	N	30	Very low	38.9	Very low	150 Å²	150	96.2 Å²	96.2	80%	0.802	52%	0.523	S	S	*	.			trans	-72.8	68.4	165.2	-69.5	-28.6	0	0	0	107.3	S902	N900-S902 VanDerWaalsContact C-N 3.28Å; N900-S902 PolarHBondContact O-N 2.89Å
901	D	26.8	Very low	36.9	Very low	133 Å²	133	101.1 Å²	101.1	71%	0.711	56%	0.555	S	S	*	*			trans	-72.2	96.5	170.5	-68.4	-36.5	0	0	0	106.4	S899 G903	S899-D901 WeakPolarHBondContact CB-OD2 3.34Å; S899-D901 PolarHBondContact O-N 3.26Å; S899-D901 PolarHBondContact OG-OD2 2.85Å; D901-G903 PolarHBondContact O-N 3.43Å
902	S	25.7	Very low	34.9	Very low	117 Å²	117	109.2 Å²	109.2	82%	0.818	60%	0.595	S	S	*	*			trans	-59.1	82.1	161.4	51.7	0	0	0	0	107.9	N900 E904	N900-S902 VanDerWaalsContact C-N 3.28Å; N900-S902 PolarHBondContact O-N 2.89Å; S902-E904 PolarHBondContact O-N 3.43Å
903	G	24	Very low	32.9	Very low	62 Å²	62	114.5 Å²	114.5	64%	0.639	62%	0.623	S	S	*	*			trans	-60.8	121.7	166.4	0	0	0	0	0	108.7	D901 C905	D901-G903 PolarHBondContact O-N 3.43Å; G903-C905 PolarHBondContact O-N 3.18Å; G903-C905 VanDerWaalsContact O-N 3.15Å
904	E	22.3	Very low	30.9	Very low	186 Å²	186	123.7 Å²	123.7	87%	0.869	66%	0.663	S	S	*	*			trans	-31.7	109.3	169.7	-68.5	162.1	142.1	0	0	111.6	S902 D906	S902-E904 PolarHBondContact O-N 3.43Å; E904-D906 PolarHBondContact O-N 2.98Å
905	C	22.9	Very low	29.4	Very low	126 Å²	126	128.9 Å²	128.9	85%	0.851	69%	0.688	S	S	*	*			trans	-78.9	109	160.1	-81.8	0	0	0	0	107	G903 T907	G903-C905 PolarHBondContact O-N 3.18Å; G903-C905 VanDerWaalsContact O-N 3.15Å; C905-T907 PolarHBondContact O-N 2.91Å
906	D	22.7	Very low	28.8	Very low	137 Å²	137	131.6 Å²	131.6	73%	0.733	70%	0.703	S	S	*	*			trans	-43.6	123.9	165.4	-71.7	-44.3	0	0	0	110.2	E904 Y908	E904-D906 PolarHBondContact O-N 2.98Å; D906-Y908 PolarHBondContact O-N 3.44Å
907	T	23.7	Very low	28.5	Very low	136 Å²	136	137.9 Å²	137.9	83%	0.834	73%	0.729	S	S	*	*			trans	-50.4	99.9	175.2	35.8	0	0	0	0	111.1	C905	C905-T907 PolarHBondContact O-N 2.91Å
908	Y	23.2	Very low	28.7	Very low	223 Å²	223	137.1 Å²	137.1	88%	0.875	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-90.4	124.1	157.2	-88.3	-85.1	0	0	0	108.9	D906	D906-Y908 PolarHBondContact O-N 3.44Å
909	D	23.2	Very low	29.2	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-48.1	139.3	-173.1	-72.2	-55.4	0	0	0	115.3	P911	D909-P911 WeakPolarHBondContact O-CD 3.19Å
910	H	21.3	Very low	30.5	Very low	185 Å²	185	140 Å²	140	86%	0.856	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-53	122	175.4	-64.9	-75.2	0	0	0	113.9	M912	H910-M912 PolarHBondContact O-N 3.03Å
911	P	23.2	Very low	31.9	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	73%	0.728	S	S	*	*			trans	-82.1	114.8	155.8	28.1	-21.3	0	0	0	109.2	D909	D909-P911 WeakPolarHBondContact O-CD 3.19Å
912	M	22.7	Very low	33.6	Very low	172 Å²	172	136.8 Å²	136.8	85%	0.847	72%	0.715	S	S	*	*			trans	-24.5	124.7	171.2	-81.3	-82.4	-169.2	0	0	116.9	H910 F914	H910-M912 PolarHBondContact O-N 3.03Å; M912-F914 PolarHBondContact O-N 3.05Å
913	N	24.5	Very low	35.3	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	69%	0.687	S	S	*	*			trans	-68.9	93.1	166.6	-87.5	-33.4	0	0	0	111.9
914	F	27.3	Very low	37.4	Very low	193 Å²	193	137.1 Å²	137.1	85%	0.846	69%	0.687	S	S	*	*			trans	-151.3	69.7	162.8	-92.7	-77.6	0	0	0	111.8	M912	M912-F914 PolarHBondContact O-N 3.05Å
915	E	29.7	Very low	39.8	Very low	154 Å²	154	133.1 Å²	133.1	72%	0.72	67%	0.667	S	S	*	*	S	Bend	trans	-159.9	-0.8	162.9	-118.1	173.9	-158.6	0	0	117.4
916	D	45.1	Very low	41.8	Very low	79 Å²	79	127.2 Å²	127.2	42%	0.422	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	-5.6	-157.1	-79.4	-9.5	0	0	0	118.4	S918 K919 Q920	D916-S918 VanDerWaalsContact C-N 3.32Å; D916-S918 PolarHBondContact O-N 2.85Å; D916-K919 PolarHBondContact O-N 3.15Å; D916-K919 VanDerWaalsContact O-N 3.16Å; D916-K919 VanDerWaalsContact OD1-CD 3.24Å; D916-K919 WeakPolarHBondContact OD1-CD 3.04Å; D916-K919 VanDerWaalsContact OD1-CE 3.3Å; D916-K919 WeakPolarHBondContact OD1-CE 3.22Å; D916-K919 IonicContact OD1-NZ 3.76Å; D916-K919 PolarHBondContact OD1-NZ 3.15Å; D916-Q920 PolarHBondContact O-N 2.8Å
917	K	44.3	Very low	44	Very low	177 Å²	177	122.1 Å²	122.1	77%	0.77	60%	0.599	S	S	*	*	H	α-helix	trans	-62.3	-37.6	-178.8	-78	-171.6	177.9	-179.4	0	112.9	L921	K917-L921 WeakPolarHBondContact O-CD1 3.22Å; K917-L921 PolarHBondContact O-N 2.78Å
918	S	47.2	Very low	46.4	Very low	75 Å²	75	119 Å²	119	52%	0.524	58%	0.583	S	S	.	*	H	α-helix	trans	-71.1	-32.2	178.1	75.7	0	0	0	0	112.6	D916 K922	D916-S918 VanDerWaalsContact C-N 3.32Å; D916-S918 PolarHBondContact O-N 2.85Å; S918-K922 WeakPolarHBondContact O-CG 3.32Å; S918-K922 PolarHBondContact O-N 3.17Å; S918-K922 VanDerWaalsContact O-N 3.1Å
919	K	52.9	Low	48.5	Very low	84 Å²	84	112.8 Å²	112.8	37%	0.365	56%	0.561	S	S	.	*	H	α-helix	trans	-70.8	-47	179.5	-57.8	-175.3	-160.5	152.4	0	111	D916 L921 K922 Q923	D916-K919 PolarHBondContact O-N 3.15Å; D916-K919 VanDerWaalsContact O-N 3.16Å; D916-K919 VanDerWaalsContact OD1-CD 3.24Å; D916-K919 WeakPolarHBondContact OD1-CD 3.04Å; D916-K919 VanDerWaalsContact OD1-CE 3.3Å; D916-K919 WeakPolarHBondContact OD1-CE 3.22Å; D916-K919 IonicContact OD1-NZ 3.76Å; D916-K919 PolarHBondContact OD1-NZ 3.15Å; K919-L921 VanDerWaalsContact C-N 3.32Å; K919-L921 PolarHBondContact O-N 3.22Å; K919-K922 PolarHBondContact O-N 2.84Å; K919-Q923 WeakPolarHBondContact O-CB 3.38Å; K919-Q923 PolarHBondContact O-N 3.01Å
920	Q	57.1	Low	50.6	Low	133 Å²	133	106.5 Å²	106.5	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-59	-42.6	175.3	-88.2	-175.8	-16.4	0	0	111.6	D916 Q923 Q924	D916-Q920 PolarHBondContact O-N 2.8Å; Q920-Q923 PolarHBondContact O-N 3.07Å; Q920-Q924 WeakPolarHBondContact O-CB 3.46Å; Q920-Q924 PolarHBondContact O-N 2.91Å
921	L	61	Low	52.6	Low	115 Å²	115	100 Å²	100	60%	0.602	50%	0.501	S	S	*	.	H	α-helix	trans	-63.3	-44.5	177.1	-83.8	159.9	0	0	0	112.9	K917 K919 Q924 F925	K917-L921 WeakPolarHBondContact O-CD1 3.22Å; K917-L921 PolarHBondContact O-N 2.78Å; K919-L921 VanDerWaalsContact C-N 3.32Å; K919-L921 PolarHBondContact O-N 3.22Å; L921-Q924 PolarHBondContact O-N 2.91Å; L921-F925 WeakPolarHBondContact O-CB 3.39Å; L921-F925 PolarHBondContact O-N 2.73Å
922	K	61.1	Low	54.4	Low	99 Å²	99	96 Å²	96	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-43.6	177.1	-78.7	-179.2	171.8	-167	0	112	S918 K919 F925 V926	S918-K922 WeakPolarHBondContact O-CG 3.32Å; S918-K922 PolarHBondContact O-N 3.17Å; S918-K922 VanDerWaalsContact O-N 3.1Å; K919-K922 PolarHBondContact O-N 2.84Å; K922-F925 PolarHBondContact O-N 2.99Å; K922-V926 WeakPolarHBondContact O-CG2 3.48Å; K922-V926 PolarHBondContact O-N 3.31Å
923	Q	63	Low	56.2	Low	50 Å²	50	88.8 Å²	88.8	23%	0.234	44%	0.436	C	S	.	.	H	α-helix	trans	-64.3	-45.9	177.4	-167.9	174	10.9	0	0	110.8	K919 Q920 F925 V926 L927 I994	K919-Q923 WeakPolarHBondContact O-CB 3.38Å; K919-Q923 PolarHBondContact O-N 3.01Å; Q920-Q923 PolarHBondContact O-N 3.07Å; Q923-F925 VanDerWaalsContact C-N 3.31Å; Q923-F925 PolarHBondContact O-N 2.72Å; Q923-V926 PolarHBondContact O-N 2.82Å; Q923-L927 HydrophobicContact CG-CD1 4Å; Q923-L927 HydrophobicContact CG-CG 4.45Å; Q923-L927 VanDerWaalsContact O-CB 3.31Å; Q923-L927 WeakPolarHBondContact O-CB 3.19Å; Q923-L927 WeakPolarHBondContact O-CG 3.42Å; Q923-L927 PolarHBondContact O-N 3.02Å; Q923-I994 HydrophobicContact CB-CD1 4.19Å; Q923-I994 HydrophobicContact CG-CD1 4.4Å
924	Q	68.3	Low	58	Low	136 Å²	136	83.7 Å²	83.7	64%	0.636	41%	0.412	S	S	*	.	H	α-helix	trans	-62.7	-37.1	176.9	-160	176.7	17.9	0	0	111.8	Q920 L921 S928	Q920-Q924 WeakPolarHBondContact O-CB 3.46Å; Q920-Q924 PolarHBondContact O-N 2.91Å; L921-Q924 PolarHBondContact O-N 2.91Å; Q924-S928 WeakPolarHBondContact O-CB 3.3Å; Q924-S928 PolarHBondContact O-N 3.02Å
925	F	71.8	Confident	59.3	Low	103 Å²	103	75.4 Å²	75.4	45%	0.452	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-50.2	173.5	179.5	-98.2	0	0	0	112.1	L921 K922 Q923 L927 S928 K929 F986 L987	L921-F925 WeakPolarHBondContact O-CB 3.39Å; L921-F925 PolarHBondContact O-N 2.73Å; K922-F925 PolarHBondContact O-N 2.99Å; Q923-F925 VanDerWaalsContact C-N 3.31Å; Q923-F925 PolarHBondContact O-N 2.72Å; F925-L927 VanDerWaalsContact C-N 3.34Å; F925-L927 PolarHBondContact O-N 2.98Å; F925-S928 PolarHBondContact O-N 3.34Å; F925-S928 PolarHBondContact O-OG 2.86Å; F925-K929 PolarHBondContact O-N 2.82Å; F925-F986 HydrophobicContact CE1-CE1 4.31Å; F925-L987 HydrophobicContact CD1-CD2 4.4Å; F925-L987 HydrophobicContact CE1-CD2 4.09Å
926	V	65.5	Low	60.4	Low	1 Å²	1	69.8 Å²	69.8	1%	0.006	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-44.4	178	176.1	0	0	0	0	110.8	K922 Q923 S928 K929 L930 L933 L987 Q990 W991 I994	K922-V926 WeakPolarHBondContact O-CG2 3.48Å; K922-V926 PolarHBondContact O-N 3.31Å; Q923-V926 PolarHBondContact O-N 2.82Å; V926-S928 VanDerWaalsContact C-N 3.32Å; V926-S928 PolarHBondContact O-N 3.04Å; V926-K929 PolarHBondContact O-N 2.93Å; V926-L930 PolarHBondContact O-N 2.74Å; V926-L933 HydrophobicContact CG1-CD1 4.11Å; V926-L987 HydrophobicContact CB-CD2 4.46Å; V926-L987 HydrophobicContact CG1-CD2 4.44Å; V926-L987 HydrophobicContact CG2-CD2 4.14Å; V926-Q990 HydrophobicContact CG2-CB 3.95Å; V926-W991 HydrophobicContact CG1-CB 4.5Å; V926-W991 HydrophobicContact CG1-CE3 3.76Å; V926-W991 HydrophobicContact CG1-CZ3 4.32Å; V926-I994 HydrophobicContact CG2-CD1 4.41Å
927	L	68.8	Low	60.9	Low	31 Å²	31	67.3 Å²	67.3	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-31.7	178.5	-69	178	0	0	0	112.8	Q923 F925 K929 L930 P931 L933 S934 W991	Q923-L927 HydrophobicContact CG-CD1 4Å; Q923-L927 HydrophobicContact CG-CG 4.45Å; Q923-L927 VanDerWaalsContact O-CB 3.31Å; Q923-L927 WeakPolarHBondContact O-CB 3.19Å; Q923-L927 WeakPolarHBondContact O-CG 3.42Å; Q923-L927 PolarHBondContact O-N 3.02Å; F925-L927 VanDerWaalsContact C-N 3.34Å; F925-L927 PolarHBondContact O-N 2.98Å; L927-K929 VanDerWaalsContact C-N 3.31Å; L927-K929 PolarHBondContact O-N 2.83Å; L927-L930 CarbonylContact O-C 3.44Å; L927-P931 WeakPolarHBondContact O-CA 3.31Å; L927-P931 VanDerWaalsContact O-N 3.16Å; L927-L933 HydrophobicContact CD2-CB 3.93Å; L927-S934 VanDerWaalsContact CD2-CA 3.48Å; L927-S934 VanDerWaalsContact CD2-N 3.29Å; L927-W991 HydrophobicContact CD2-CH2 4.21Å; L927-W991 HydrophobicContact CD2-CZ3 4.15Å
928	S	73.5	Confident	61.3	Low	70 Å²	70	64.1 Å²	64.1	49%	0.49	33%	0.332	S	S	.	.	H	α-helix	trans	-66.5	-31.9	175.6	77.5	0	0	0	0	113.1	Q924 F925 V926	Q924-S928 WeakPolarHBondContact O-CB 3.3Å; Q924-S928 PolarHBondContact O-N 3.02Å; F925-S928 PolarHBondContact O-N 3.34Å; F925-S928 PolarHBondContact O-OG 2.86Å; V926-S928 VanDerWaalsContact C-N 3.32Å; V926-S928 PolarHBondContact O-N 3.04Å
929	K	67.9	Low	61.1	Low	93 Å²	93	63.5 Å²	63.5	40%	0.404	32%	0.323	S	S	.	.	H	α-helix	trans	-90.6	-32.4	-179.4	-66	-66.8	-176.2	175.2	0	112.7	F925 V926 L927 P931 L987	F925-K929 PolarHBondContact O-N 2.82Å; V926-K929 PolarHBondContact O-N 2.93Å; L927-K929 VanDerWaalsContact C-N 3.31Å; L927-K929 PolarHBondContact O-N 2.83Å; K929-P931 VanDerWaalsContact C-CD 3.44Å; K929-P931 WeakPolarHBondContact O-CD 3.25Å; K929-L987 HydrophobicContact CB-CD1 4.04Å; K929-L987 HydrophobicContact CB-CD2 4.19Å; K929-L987 HydrophobicContact CG-CD2 4.45Å
930	L	67.4	Low	60.4	Low	19 Å²	19	64.1 Å²	64.1	10%	0.099	34%	0.335	C	S	.	.			trans	-126.1	67.3	-179.5	-64.3	169.2	0	0	0	109.8	V926 L927 F932 L933 L960 L987	V926-L930 PolarHBondContact O-N 2.74Å; L927-L930 CarbonylContact O-C 3.44Å; L930-F932 HydrophobicContact CB-CE1 4.24Å; L930-F932 HydrophobicContact CB-CZ 4.41Å; L930-F932 HydrophobicContact CD2-CE1 3.61Å; L930-F932 HydrophobicContact CD2-CZ 3.91Å; L930-F932 PolarHBondContact O-N 3.41Å; L930-L933 HydrophobicContact CB-CD1 3.71Å; L930-L933 HydrophobicContact CB-CG 4.03Å; L930-L933 HydrophobicContact CD1-CD1 3.76Å; L930-L933 HydrophobicContact CG-CD1 4.39Å; L930-L933 WeakPolarHBondContact O-CB 3.28Å; L930-L933 PolarHBondContact O-N 3.4Å; L930-L960 HydrophobicContact CD2-CD1 3.89Å; L930-L987 HydrophobicContact CD1-CB 4.03Å; L930-L987 HydrophobicContact CD1-CD1 4.27Å; L930-L987 HydrophobicContact CG-CD1 4.47Å
931	P	62.6	Low	59.3	Low	48 Å²	48	65.1 Å²	65.1	31%	0.312	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-60.4	-21.8	-173.2	21.2	-32.8	0	0	0	113.8	L927 K929 L933 S934 S956	L927-P931 WeakPolarHBondContact O-CA 3.31Å; L927-P931 VanDerWaalsContact O-N 3.16Å; K929-P931 VanDerWaalsContact C-CD 3.44Å; K929-P931 WeakPolarHBondContact O-CD 3.25Å; P931-L933 PolarHBondContact O-N 3.46Å; P931-S934 WeakPolarHBondContact O-CB 3.43Å; P931-S934 PolarHBondContact O-N 3.42Å; P931-S934 VanDerWaalsContact O-N 3.12Å; P931-S956 WeakPolarHBondContact CD-OG 3.4Å; P931-S956 WeakPolarHBondContact CG-OG 3.39Å
932	F	61.8	Low	58	Low	40 Å²	40	65 Å²	65	18%	0.175	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-62.2	-25.9	174.1	71.7	-110	0	0	0	113	L930 S934 S935 M948 R952 K953 S956	L930-F932 HydrophobicContact CB-CE1 4.24Å; L930-F932 HydrophobicContact CB-CZ 4.41Å; L930-F932 HydrophobicContact CD2-CE1 3.61Å; L930-F932 HydrophobicContact CD2-CZ 3.91Å; L930-F932 PolarHBondContact O-N 3.41Å; F932-S934 VanDerWaalsContact C-N 3.26Å; F932-S934 PolarHBondContact O-N 3.1Å; F932-S935 PolarHBondContact O-OG 3.2Å; F932-M948 HydrophobicContact CB-CE 3.53Å; F932-M948 HydrophobicContact CD2-CE 3.34Å; F932-M948 HydrophobicContact CE2-CE 4.33Å; F932-M948 HydrophobicContact CG-CE 3.75Å; F932-R952 HydrophobicContact CB-CB 4.16Å; F932-K953 HydrophobicContact CD1-CG 4.49Å; F932-K953 HydrophobicContact CG-CG 4.46Å; F932-S956 WeakPolarHBondContact CD1-OG 3.39Å
933	L	59.7	Low	56.6	Low	20 Å²	20	68.6 Å²	68.6	11%	0.105	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-72.5	-15.2	176.8	-66.7	178.2	0	0	0	113.3	V926 L927 L930 P931 S935 V936 V937 W991	V926-L933 HydrophobicContact CG1-CD1 4.11Å; L927-L933 HydrophobicContact CD2-CB 3.93Å; L930-L933 HydrophobicContact CB-CD1 3.71Å; L930-L933 HydrophobicContact CB-CG 4.03Å; L930-L933 HydrophobicContact CD1-CD1 3.76Å; L930-L933 HydrophobicContact CG-CD1 4.39Å; L930-L933 WeakPolarHBondContact O-CB 3.28Å; L930-L933 PolarHBondContact O-N 3.4Å; P931-L933 PolarHBondContact O-N 3.46Å; L933-S935 PolarHBondContact O-N 3.12Å; L933-V936 WeakPolarHBondContact O-CB 3.24Å; L933-V936 PolarHBondContact O-N 2.92Å; L933-V937 PolarHBondContact O-N 3.24Å; L933-W991 HydrophobicContact CB-CH2 3.7Å; L933-W991 HydrophobicContact CB-CZ2 3.85Å; L933-W991 HydrophobicContact CB-CZ3 4.21Å; L933-W991 HydrophobicContact CD1-CD2 3.8Å; L933-W991 HydrophobicContact CD1-CE3 4.08Å; L933-W991 HydrophobicContact CD1-CG 4.07Å; L933-W991 HydrophobicContact CD1-CH2 4.42Å; L933-W991 HydrophobicContact CD1-CZ2 4.28Å; L933-W991 HydrophobicContact CD1-CZ3 4.38Å; L933-W991 HydrophobicContact CD2-CZ2 4Å; L933-W991 HydrophobicContact CG-CH2 4.49Å; L933-W991 HydrophobicContact CG-CZ2 4.27Å
934	S	63.1	Low	55.1	Low	38 Å²	38	73.4 Å²	73.4	27%	0.266	38%	0.384	S	S	.	.	H	α-helix	trans	-57.1	-41	177.1	-164.6	0	0	0	0	110.8	L927 P931 F932 V936 V937 D938	L927-S934 VanDerWaalsContact CD2-CA 3.48Å; L927-S934 VanDerWaalsContact CD2-N 3.29Å; P931-S934 WeakPolarHBondContact O-CB 3.43Å; P931-S934 PolarHBondContact O-N 3.42Å; P931-S934 VanDerWaalsContact O-N 3.12Å; F932-S934 VanDerWaalsContact C-N 3.26Å; F932-S934 PolarHBondContact O-N 3.1Å; S934-V936 PolarHBondContact O-N 2.86Å; S934-V936 VanDerWaalsContact O-N 3.08Å; S934-V937 PolarHBondContact O-N 2.86Å; S934-D938 VanDerWaalsContact O-CG 3.27Å; S934-D938 PolarHBondContact O-N 3.2Å; S934-D938 PolarHBondContact OG-OD2 3.01Å
935	S	54.6	Low	53.4	Low	19 Å²	19	75 Å²	75	13%	0.133	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-22	178.2	68.9	0	0	0	0	114.1	F932 L933 N939 L946 M948	F932-S935 PolarHBondContact O-OG 3.2Å; L933-S935 PolarHBondContact O-N 3.12Å; S935-N939 WeakPolarHBondContact O-CB 3.42Å; S935-N939 VanDerWaalsContact O-CG 3.25Å; S935-N939 PolarHBondContact O-ND2 2.72Å; S935-L946 WeakPolarHBondContact OG-CD2 3.44Å; S935-M948 PolarHBondContact OG-SD 2.97Å; S935-M948 VanDerWaalsContact OG-SD 3.34Å
936	V	52.3	Low	51.7	Low	36 Å²	36	74.6 Å²	74.6	22%	0.218	39%	0.394	C	S	.	.	H	α-helix	trans	-82.4	-38.6	176.5	-176.1	0	0	0	0	110.3	L933 S934 L946 W991 M995	L933-V936 WeakPolarHBondContact O-CB 3.24Å; L933-V936 PolarHBondContact O-N 2.92Å; S934-V936 PolarHBondContact O-N 2.86Å; S934-V936 VanDerWaalsContact O-N 3.08Å; V936-L946 HydrophobicContact CG2-CD1 4.03Å; V936-L946 HydrophobicContact CG2-CD2 3.96Å; V936-W991 HydrophobicContact CB-CZ2 4.06Å; V936-W991 HydrophobicContact CG1-CZ2 4.16Å; V936-M995 HydrophobicContact CG1-SD 4.39Å
937	V	55.9	Low	50.4	Low	27 Å²	27	82.4 Å²	82.4	16%	0.164	44%	0.435	C	S	.	.	H	α-helix	trans	-71.9	-45.8	178.2	159.6	0	0	0	0	111.8	L933 S934 N939 T940 W991	L933-V937 PolarHBondContact O-N 3.24Å; S934-V937 PolarHBondContact O-N 2.86Å; V937-N939 PolarHBondContact O-N 3.17Å; V937-T940 PolarHBondContact O-N 2.93Å; V937-T940 PolarHBondContact O-OG1 3.23Å; V937-W991 HydrophobicContact CB-CH2 4.49Å; V937-W991 HydrophobicContact CG2-CH2 3.3Å; V937-W991 HydrophobicContact CG2-CZ2 4.23Å; V937-W991 HydrophobicContact CG2-CZ3 3.86Å
938	D	52.5	Low	49.2	Very low	109 Å²	109	83.4 Å²	83.4	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-68.4	-24.7	-177.9	-59.5	-38.5	0	0	0	111.6	S934	S934-D938 VanDerWaalsContact O-CG 3.27Å; S934-D938 PolarHBondContact O-N 3.2Å; S934-D938 PolarHBondContact OG-OD2 3.01Å
939	N	42.7	Very low	47.9	Very low	62 Å²	62	83 Å²	83	33%	0.332	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	8.5	-178	-73.5	-35.5	0	0	0	114.6	S935 V937 N941 Q942	S935-N939 WeakPolarHBondContact O-CB 3.42Å; S935-N939 VanDerWaalsContact O-CG 3.25Å; S935-N939 PolarHBondContact O-ND2 2.72Å; V937-N939 PolarHBondContact O-N 3.17Å; N939-N941 PolarHBondContact O-N 3.3Å; N939-Q942 PolarHBondContact O-N 2.79Å
940	T	37.1	Very low	46.7	Very low	98 Å²	98	88.4 Å²	88.4	60%	0.601	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.9	175	51.9	0	0	0	0	112.6	V937	V937-T940 PolarHBondContact O-N 2.93Å; V937-T940 PolarHBondContact O-OG1 3.23Å
941	N	35.5	Very low	46.3	Very low	154 Å²	154	94.3 Å²	94.3	82%	0.824	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-2	175.5	-67.3	-16.9	0	0	0	115	N939	N939-N941 PolarHBondContact O-N 3.3Å
942	Q	33.8	Very low	46	Very low	113 Å²	113	98.3 Å²	98.3	53%	0.528	49%	0.488	S	S	.	.			trans	-133.5	113.8	178.8	-64.5	-149.1	-0.9	0	0	112.7	N939 K944	N939-Q942 PolarHBondContact O-N 2.79Å; Q942-K944 PolarHBondContact O-N 2.8Å
943	N	31.3	Very low	45.4	Very low	174 Å²	174	101.4 Å²	101.4	93%	0.93	50%	0.501	S	S	*	.			trans	-65.9	48.2	176	-84.5	-48.4	0	0	0	114
944	K	30	Very low	45.2	Very low	150 Å²	150	105.6 Å²	105.6	65%	0.652	52%	0.52	S	S	*	.			trans	-98.8	135.3	174.7	-73.8	-178.3	179.8	171.4	0	110.8	Q942 L946	Q942-K944 PolarHBondContact O-N 2.8Å; K944-L946 PolarHBondContact O-N 2.87Å
945	Q	33.6	Very low	45.2	Very low	169 Å²	169	108.2 Å²	108.2	79%	0.79	53%	0.529	S	S	*	.			trans	-51.4	124.8	177.5	-70.9	175.3	-9.2	0	0	111.1	L947	Q945-L947 VanDerWaalsContact C-N 3.27Å; Q945-L947 PolarHBondContact O-N 2.8Å
946	L	35.8	Very low	45.3	Very low	95 Å²	95	107.4 Å²	107.4	50%	0.497	52%	0.523	S	S	.	.			trans	-68.6	78.3	173.1	-94.9	150.7	0	0	0	110.4	S935 V936 K944 M948	S935-L946 WeakPolarHBondContact OG-CD2 3.44Å; V936-L946 HydrophobicContact CG2-CD1 4.03Å; V936-L946 HydrophobicContact CG2-CD2 3.96Å; K944-L946 PolarHBondContact O-N 2.87Å; L946-M948 VanDerWaalsContact C-N 3.25Å; L946-M948 HydrophobicContact CB-CG 4.38Å; L946-M948 HydrophobicContact CD2-CG 3.79Å; L946-M948 HydrophobicContact CD2-SD 3.66Å; L946-M948 PolarHBondContact O-N 2.97Å
947	L	37.6	Very low	45.7	Very low	165 Å²	165	109.8 Å²	109.8	86%	0.864	53%	0.534	S	S	*	.			trans	-80	81.7	164.7	-135.1	99.9	0	0	0	108.3	Q945 S949	Q945-L947 VanDerWaalsContact C-N 3.27Å; Q945-L947 PolarHBondContact O-N 2.8Å; L947-S949 PolarHBondContact O-N 3.08Å
948	M	45.3	Very low	46	Very low	52 Å²	52	113.8 Å²	113.8	26%	0.256	55%	0.55	S	S	.	*			trans	-70.6	113.2	-179.8	-71.8	-81.2	-77.7	0	0	109.9	F932 S935 L946 R950 K953	F932-M948 HydrophobicContact CB-CE 3.53Å; F932-M948 HydrophobicContact CD2-CE 3.34Å; F932-M948 HydrophobicContact CE2-CE 4.33Å; F932-M948 HydrophobicContact CG-CE 3.75Å; S935-M948 PolarHBondContact OG-SD 2.97Å; S935-M948 VanDerWaalsContact OG-SD 3.34Å; L946-M948 VanDerWaalsContact C-N 3.25Å; L946-M948 HydrophobicContact CB-CG 4.38Å; L946-M948 HydrophobicContact CD2-CG 3.79Å; L946-M948 HydrophobicContact CD2-SD 3.66Å; L946-M948 PolarHBondContact O-N 2.97Å; M948-R950 PolarHBondContact O-N 3.18Å; M948-R950 VanDerWaalsContact O-N 3.15Å; M948-K953 HydrophobicContact CE-CG 4.41Å
949	S	44.6	Very low	46.8	Very low	61 Å²	61	114.6 Å²	114.6	43%	0.427	55%	0.549	S	S	.	.			trans	-58.9	122.2	174.8	67.5	0	0	0	0	109.7	L947 K951 R952	L947-S949 PolarHBondContact O-N 3.08Å; S949-K951 PolarHBondContact O-N 2.88Å; S949-R952 PolarHBondContact O-N 2.93Å
950	R	43.8	Very low	47.5	Very low	207 Å²	207	112.7 Å²	112.7	78%	0.781	54%	0.539	S	S	*	.	H	α-helix	trans	-44.7	-39.7	176.3	-166.7	175.4	179.9	176.7	-0.9	112	M948 R952 K953 E954	M948-R950 PolarHBondContact O-N 3.18Å; M948-R950 VanDerWaalsContact O-N 3.15Å; R950-R952 PolarHBondContact O-N 2.84Å; R950-K953 PolarHBondContact O-N 3.22Å; R950-K953 VanDerWaalsContact O-N 3.16Å; R950-E954 PolarHBondContact O-N 3.3Å; R950-E954 VanDerWaalsContact O-N 3.12Å
951	K	58.3	Low	48.6	Very low	143 Å²	143	111.3 Å²	111.3	62%	0.622	52%	0.524	S	S	*	.	H	α-helix	trans	-52.4	-44.7	176.8	-166.7	173.8	-178.2	177.1	0	114.7	S949 E954 E955	S949-K951 PolarHBondContact O-N 2.88Å; K951-E954 PolarHBondContact O-N 3.12Å; K951-E955 WeakPolarHBondContact CE-OE1 3.49Å; K951-E955 WeakPolarHBondContact O-CG 3.02Å; K951-E955 PolarHBondContact O-N 2.86Å
952	R	56.2	Low	49.6	Very low	133 Å²	133	111.1 Å²	111.1	50%	0.502	52%	0.516	S	S	.	.	H	α-helix	trans	-69.2	-34.4	179.4	-79	-171.3	-166.8	173.1	4.4	113.2	F932 S949 R950 E954 S956	F932-R952 HydrophobicContact CB-CB 4.16Å; S949-R952 PolarHBondContact O-N 2.93Å; R950-R952 PolarHBondContact O-N 2.84Å; R952-E954 VanDerWaalsContact C-N 3.35Å; R952-S956 PolarHBondContact O-N 3.26Å; R952-S956 PolarHBondContact O-OG 3.5Å
953	K	50.6	Low	50.7	Low	104 Å²	104	112.1 Å²	112.1	45%	0.452	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-44.5	175.1	-71	-176.3	177.8	-179.5	0	109.8	F932 M948 R950 S956 L957	F932-K953 HydrophobicContact CD1-CG 4.49Å; F932-K953 HydrophobicContact CG-CG 4.46Å; M948-K953 HydrophobicContact CE-CG 4.41Å; R950-K953 PolarHBondContact O-N 3.22Å; R950-K953 VanDerWaalsContact O-N 3.16Å; K953-S956 PolarHBondContact O-N 3.47Å; K953-L957 WeakPolarHBondContact O-CG 3.39Å; K953-L957 PolarHBondContact O-N 2.84Å
954	E	54.4	Low	51.7	Low	108 Å²	108	107.6 Å²	107.6	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-47.1	-179.9	-159	167.9	-160.9	0	0	112.3	R950 K951 R952 S956 L957 Q958	R950-E954 PolarHBondContact O-N 3.3Å; R950-E954 VanDerWaalsContact O-N 3.12Å; K951-E954 PolarHBondContact O-N 3.12Å; R952-E954 VanDerWaalsContact C-N 3.35Å; E954-S956 VanDerWaalsContact C-N 3.25Å; E954-S956 PolarHBondContact O-N 2.83Å; E954-L957 PolarHBondContact O-N 2.88Å; E954-Q958 WeakPolarHBondContact O-CB 3.42Å; E954-Q958 WeakPolarHBondContact O-CG 3.41Å; E954-Q958 PolarHBondContact O-N 3.46Å
955	E	64	Low	52.6	Low	94 Å²	94	103.8 Å²	103.8	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-33.6	175	-74	172.6	-173.1	0	0	113	K951 K959	K951-E955 WeakPolarHBondContact CE-OE1 3.49Å; K951-E955 WeakPolarHBondContact O-CG 3.02Å; K951-E955 PolarHBondContact O-N 2.86Å; E955-K959 WeakPolarHBondContact O-CG 3.13Å; E955-K959 PolarHBondContact O-N 2.84Å
956	S	56.7	Low	53.1	Low	1 Å²	1	101.8 Å²	101.8	1%	0.007	49%	0.493	C	S	.	.	H	α-helix	trans	-75.1	-39.3	178.7	-55.8	0	0	0	0	111.9	P931 F932 R952 K953 E954 K959 L960	P931-S956 WeakPolarHBondContact CD-OG 3.4Å; P931-S956 WeakPolarHBondContact CG-OG 3.39Å; F932-S956 WeakPolarHBondContact CD1-OG 3.39Å; R952-S956 PolarHBondContact O-N 3.26Å; R952-S956 PolarHBondContact O-OG 3.5Å; K953-S956 PolarHBondContact O-N 3.47Å; E954-S956 VanDerWaalsContact C-N 3.25Å; E954-S956 PolarHBondContact O-N 2.83Å; S956-K959 PolarHBondContact O-N 3.48Å; S956-L960 PolarHBondContact O-N 2.83Å; S956-L960 VanDerWaalsContact O-N 3.1Å
957	L	59.4	Low	53.6	Low	86 Å²	86	103.5 Å²	103.5	45%	0.45	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-45.1	171.5	-72.6	167.1	0	0	0	110.4	K953 E954 K959 L960 F961	K953-L957 WeakPolarHBondContact O-CG 3.39Å; K953-L957 PolarHBondContact O-N 2.84Å; E954-L957 PolarHBondContact O-N 2.88Å; L957-K959 VanDerWaalsContact C-N 3.25Å; L957-K959 PolarHBondContact O-N 3.17Å; L957-L960 WeakPolarHBondContact O-CB 3.29Å; L957-L960 PolarHBondContact O-N 3.36Å; L957-F961 HydrophobicContact CB-CD2 4.47Å; L957-F961 HydrophobicContact CD2-CE2 4.06Å; L957-F961 WeakPolarHBondContact O-CD2 3.42Å; L957-F961 PolarHBondContact O-N 2.94Å
958	Q	63.6	Low	54.1	Low	111 Å²	111	103.7 Å²	103.7	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-57.8	-37.1	174.9	-74.8	-179.1	4.1	0	0	112.3	E954 F961 K962	E954-Q958 WeakPolarHBondContact O-CB 3.42Å; E954-Q958 WeakPolarHBondContact O-CG 3.41Å; E954-Q958 PolarHBondContact O-N 3.46Å; Q958-F961 CarbonylContact O-C 3.54Å; Q958-F961 PolarHBondContact O-N 2.86Å; Q958-K962 VanDerWaalsContact O-CA 3.23Å; Q958-K962 WeakPolarHBondContact O-CA 3.35Å; Q958-K962 WeakPolarHBondContact O-CB 3.13Å; Q958-K962 WeakPolarHBondContact O-CG 3.48Å; Q958-K962 PolarHBondContact O-N 2.81Å
959	K	67.6	Low	54.9	Low	127 Å²	127	105.9 Å²	105.9	55%	0.552	52%	0.517	S	S	*	.	H	α-helix	trans	-67.2	-38.1	173.9	-80.5	-180	-179.8	179	0	113.4	E955 S956 L957 F961	E955-K959 WeakPolarHBondContact O-CG 3.13Å; E955-K959 PolarHBondContact O-N 2.84Å; S956-K959 PolarHBondContact O-N 3.48Å; L957-K959 VanDerWaalsContact C-N 3.25Å; L957-K959 PolarHBondContact O-N 3.17Å; K959-F961 VanDerWaalsContact C-N 3.31Å
960	L	58.4	Low	55.7	Low	22 Å²	22	109.9 Å²	109.9	12%	0.115	53%	0.532	C	S	.	.	H	α-helix	trans	-66.2	-35.1	176	-84.7	161.1	0	0	0	111.9	L930 S956 L957 I984 L987	L930-L960 HydrophobicContact CD2-CD1 3.89Å; S956-L960 PolarHBondContact O-N 2.83Å; S956-L960 VanDerWaalsContact O-N 3.1Å; L957-L960 WeakPolarHBondContact O-CB 3.29Å; L957-L960 PolarHBondContact O-N 3.36Å; L960-I984 HydrophobicContact CD1-CG1 4.23Å; L960-I984 HydrophobicContact CD2-CG1 4.48Å; L960-L987 HydrophobicContact CD2-CD1 4.25Å
961	F	59.8	Low	56.9	Low	68 Å²	68	107.4 Å²	107.4	30%	0.298	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	10	-179	-62.3	-66.8	0	0	0	114.1	L957 Q958 K959 N963 I964 I984	L957-F961 HydrophobicContact CB-CD2 4.47Å; L957-F961 HydrophobicContact CD2-CE2 4.06Å; L957-F961 WeakPolarHBondContact O-CD2 3.42Å; L957-F961 PolarHBondContact O-N 2.94Å; Q958-F961 CarbonylContact O-C 3.54Å; Q958-F961 PolarHBondContact O-N 2.86Å; K959-F961 VanDerWaalsContact C-N 3.31Å; F961-N963 PolarHBondContact O-N 3.07Å; F961-I964 HydrophobicContact CB-CD1 4.08Å; F961-I964 HydrophobicContact CD1-CD1 4.4Å; F961-I964 PolarHBondContact O-N 3.37Å; F961-I984 HydrophobicContact CZ-CD1 4.39Å
962	K	57.7	Low	57.2	Low	151 Å²	151	103.3 Å²	103.3	66%	0.657	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	1.5	-165.3	-133.5	179.5	179.8	-175.5	0	116.3	Q958	Q958-K962 VanDerWaalsContact O-CA 3.23Å; Q958-K962 WeakPolarHBondContact O-CA 3.35Å; Q958-K962 WeakPolarHBondContact O-CB 3.13Å; Q958-K962 WeakPolarHBondContact O-CG 3.48Å; Q958-K962 PolarHBondContact O-N 2.81Å
963	N	56.3	Low	57.4	Low	134 Å²	134	100.5 Å²	100.5	72%	0.717	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	30.4	-176.6	-64.3	-26.5	0	0	0	112.1	F961 P965	F961-N963 PolarHBondContact O-N 3.07Å; N963-P965 WeakPolarHBondContact O-CD 3.49Å; N963-P965 VanDerWaalsContact O-N 3.08Å
964	I	51.1	Low	58.2	Low	79 Å²	79	98.7 Å²	98.7	41%	0.405	51%	0.514	S	S	.	.			trans	-65.7	108.1	167.1	-61	167.5	0	0	0	105.8	F961 L973	F961-I964 HydrophobicContact CB-CD1 4.08Å; F961-I964 HydrophobicContact CD1-CD1 4.4Å; F961-I964 PolarHBondContact O-N 3.37Å; I964-L973 HydrophobicContact CG2-CD1 4.02Å
965	P	48.8	Very low	59.1	Low	70 Å²	70	101.4 Å²	101.4	46%	0.455	52%	0.524	S	S	.	.			trans	-62.3	134.8	176.9	-11.7	28.1	0	0	0	107	N963 N967	N963-P965 WeakPolarHBondContact O-CD 3.49Å; N963-P965 VanDerWaalsContact O-N 3.08Å; P965-N967 PolarHBondContact O-N 3.01Å
966	P	45	Very low	59.4	Low	127 Å²	127	99.2 Å²	99.2	83%	0.825	51%	0.514	S	S	*	.	S	Bend	trans	-73.6	83.1	171.3	30.7	-29.9	0	0	0	106.5
967	N	46.8	Very low	60	Low	131 Å²	131	103.1 Å²	103.1	70%	0.701	54%	0.535	S	S	*	.			trans	-156.3	137.9	171.6	-118.3	-10.7	0	0	0	113.3	P965 D969	P965-N967 PolarHBondContact O-N 3.01Å; N967-D969 PolarHBondContact O-N 3.32Å
968	D	48.5	Very low	60.6	Low	168 Å²	168	102.3 Å²	102.3	90%	0.898	53%	0.533	S	S	*	.			trans	-71.1	22	-155	-62	-51.1	0	0	0	117.2
969	D	61.8	Low	61.1	Low	98 Å²	98	101.8 Å²	101.8	52%	0.524	53%	0.531	S	S	.	.			trans	-97.7	106.1	-179.5	-153	-10.7	0	0	0	111.5	N967 Q971 S972 L973	N967-D969 PolarHBondContact O-N 3.32Å; D969-Q971 PolarHBondContact O-N 3.05Å; D969-Q971 VanDerWaalsContact O-N 3.12Å; D969-S972 WeakPolarHBondContact O-CA 3.25Å; D969-S972 VanDerWaalsContact O-CB 3.28Å; D969-S972 WeakPolarHBondContact O-CB 3.01Å; D969-S972 PolarHBondContact O-N 3.41Å; D969-L973 PolarHBondContact O-N 2.82Å; D969-L973 VanDerWaalsContact O-N 3.13Å
970	L	61.3	Low	61.2	Low	145 Å²	145	96.1 Å²	96.1	76%	0.759	51%	0.507	S	S	*	.	H	α-helix	trans	-58	-28.1	-177.6	-152	136.7	0	0	0	111.7	S974	L970-S974 VanDerWaalsContact O-CB 3.29Å; L970-S974 WeakPolarHBondContact O-CB 3.49Å; L970-S974 PolarHBondContact O-N 3.39Å
971	Q	69.3	Low	61.6	Low	156 Å²	156	101.7 Å²	101.7	73%	0.729	53%	0.534	S	S	*	.	H	α-helix	trans	-68.9	-40	172.4	-72.2	-167.1	1.3	0	0	112.9	D969 S974 K975	D969-Q971 PolarHBondContact O-N 3.05Å; D969-Q971 VanDerWaalsContact O-N 3.12Å; Q971-S974 PolarHBondContact O-N 3.07Å; Q971-K975 WeakPolarHBondContact O-CB 3.45Å; Q971-K975 PolarHBondContact O-N 3.04Å
972	S	63.1	Low	62.3	Low	57 Å²	57	104.3 Å²	104.3	40%	0.399	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-45.9	176.1	174.2	0	0	0	0	110.6	D969 K975 H976	D969-S972 WeakPolarHBondContact O-CA 3.25Å; D969-S972 VanDerWaalsContact O-CB 3.28Å; D969-S972 WeakPolarHBondContact O-CB 3.01Å; D969-S972 PolarHBondContact O-N 3.41Å; S972-K975 PolarHBondContact O-N 3.32Å; S972-H976 WeakPolarHBondContact O-CB 3.19Å; S972-H976 PolarHBondContact O-N 3.47Å
973	L	60.1	Low	62.9	Low	74 Å²	74	101.2 Å²	101.2	39%	0.387	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-46.9	176.9	-175	66.8	0	0	0	111.8	I964 D969 K975 H976 L977	I964-L973 HydrophobicContact CG2-CD1 4.02Å; D969-L973 PolarHBondContact O-N 2.82Å; D969-L973 VanDerWaalsContact O-N 3.13Å; L973-K975 VanDerWaalsContact C-N 3.33Å; L973-K975 PolarHBondContact O-N 2.59Å; L973-H976 PolarHBondContact O-N 2.86Å; L973-L977 HydrophobicContact CD1-CG 4.47Å; L973-L977 HydrophobicContact CG-CD1 4.07Å; L973-L977 HydrophobicContact CG-CG 4.43Å; L973-L977 WeakPolarHBondContact O-CB 3.28Å; L973-L977 WeakPolarHBondContact O-CG 3.44Å; L973-L977 PolarHBondContact O-N 3.43Å
974	S	68.1	Low	63.4	Low	66 Å²	66	97.5 Å²	97.5	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-55.5	-46.6	174.9	161.1	0	0	0	0	112.1	L970 Q971 H976 L977 T978	L970-S974 VanDerWaalsContact O-CB 3.29Å; L970-S974 WeakPolarHBondContact O-CB 3.49Å; L970-S974 PolarHBondContact O-N 3.39Å; Q971-S974 PolarHBondContact O-N 3.07Å; S974-H976 PolarHBondContact O-N 3.13Å; S974-L977 PolarHBondContact O-N 3.29Å; S974-T978 WeakPolarHBondContact O-CB 3.49Å; S974-T978 PolarHBondContact O-N 2.99Å; S974-T978 PolarHBondContact O-OG1 3.17Å
975	K	74.2	Confident	64.1	Low	164 Å²	164	96.8 Å²	96.8	71%	0.713	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-40.4	178.4	-163	176.5	-174.9	178.7	0	111.4	Q971 S972 L973 E979	Q971-K975 WeakPolarHBondContact O-CB 3.45Å; Q971-K975 PolarHBondContact O-N 3.04Å; S972-K975 PolarHBondContact O-N 3.32Å; L973-K975 VanDerWaalsContact C-N 3.33Å; L973-K975 PolarHBondContact O-N 2.59Å; K975-E979 WeakPolarHBondContact O-CB 3.2Å; K975-E979 PolarHBondContact O-N 3.43Å
976	H	70.4	Confident	65.4	Low	49 Å²	49	98.8 Å²	98.8	23%	0.227	52%	0.516	C	S	.	.	H	α-helix	trans	-64.5	-49.3	176	-167	84.5	0	0	0	111.7	S972 L973 S974 T978 E979 S980	S972-H976 WeakPolarHBondContact O-CB 3.19Å; S972-H976 PolarHBondContact O-N 3.47Å; L973-H976 PolarHBondContact O-N 2.86Å; S974-H976 PolarHBondContact O-N 3.13Å; H976-T978 VanDerWaalsContact C-N 3.3Å; H976-T978 PolarHBondContact O-N 3.47Å; H976-E979 PolarHBondContact O-N 3.1Å; H976-E979 VanDerWaalsContact O-N 3.12Å; H976-S980 PolarHBondContact O-N 3.07Å; H976-S980 PolarHBondContact O-OG 3.08Å; H976-S980 VanDerWaalsContact O-OG 3.06Å
977	L	67.8	Low	66.6	Low	83 Å²	83	93 Å²	93	44%	0.435	48%	0.478	S	S	.	.	H	α-helix	trans	-59.1	-41.6	177.4	-72.7	171.7	0	0	0	111.8	L973 S974 E979 S980 M981	L973-L977 HydrophobicContact CD1-CG 4.47Å; L973-L977 HydrophobicContact CG-CD1 4.07Å; L973-L977 HydrophobicContact CG-CG 4.43Å; L973-L977 WeakPolarHBondContact O-CB 3.28Å; L973-L977 WeakPolarHBondContact O-CG 3.44Å; L973-L977 PolarHBondContact O-N 3.43Å; S974-L977 PolarHBondContact O-N 3.29Å; L977-E979 VanDerWaalsContact C-N 3.33Å; L977-E979 PolarHBondContact O-N 3.41Å; L977-S980 PolarHBondContact O-N 2.95Å; L977-M981 WeakPolarHBondContact O-CB 3.23Å; L977-M981 PolarHBondContact O-N 3.35Å
978	T	72.2	Confident	67.5	Low	69 Å²	69	89.7 Å²	89.7	42%	0.423	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-42.1	176.2	-56.3	0	0	0	0	111.4	S974 H976 M981 K982	S974-T978 WeakPolarHBondContact O-CB 3.49Å; S974-T978 PolarHBondContact O-N 2.99Å; S974-T978 PolarHBondContact O-OG1 3.17Å; H976-T978 VanDerWaalsContact C-N 3.3Å; H976-T978 PolarHBondContact O-N 3.47Å; T978-M981 PolarHBondContact O-N 3.28Å; T978-K982 WeakPolarHBondContact O-CG 3.48Å; T978-K982 PolarHBondContact O-N 2.94Å; T978-K982 VanDerWaalsContact O-N 3.08Å
979	E	75.1	Confident	68.4	Low	100 Å²	100	86.2 Å²	86.2	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-70.8	-39.5	178.3	-164.2	59.2	-154.7	0	0	112.1	K975 H976 L977 K982 Q983	K975-E979 WeakPolarHBondContact O-CB 3.2Å; K975-E979 PolarHBondContact O-N 3.43Å; H976-E979 PolarHBondContact O-N 3.1Å; H976-E979 VanDerWaalsContact O-N 3.12Å; L977-E979 VanDerWaalsContact C-N 3.33Å; L977-E979 PolarHBondContact O-N 3.41Å; E979-K982 PolarHBondContact O-N 2.6Å; E979-K982 IonicContact OE2-NZ 3.88Å; E979-Q983 PolarHBondContact O-N 3.28Å
980	S	69.6	Low	68.8	Low	7 Å²	7	83 Å²	83	5%	0.049	43%	0.428	C	S	.	.	H	α-helix	trans	-61.2	-43.2	172.3	-58.1	0	0	0	0	111.5	H976 L977 K982 Q983 I984	H976-S980 PolarHBondContact O-N 3.07Å; H976-S980 PolarHBondContact O-OG 3.08Å; H976-S980 VanDerWaalsContact O-OG 3.06Å; L977-S980 PolarHBondContact O-N 2.95Å; S980-K982 PolarHBondContact O-N 3.11Å; S980-Q983 PolarHBondContact O-N 3.06Å; S980-I984 VanDerWaalsContact O-CG1 3.28Å; S980-I984 WeakPolarHBondContact O-CG1 3.48Å; S980-I984 PolarHBondContact O-N 3.32Å
981	M	67.4	Low	69.1	Low	139 Å²	139	77.6 Å²	77.6	69%	0.685	40%	0.398	S	S	*	.	H	α-helix	trans	-59.4	-44.4	174.3	-97.1	-177.6	65.3	0	0	111.9	L977 T978 I984 S985	L977-M981 WeakPolarHBondContact O-CB 3.23Å; L977-M981 PolarHBondContact O-N 3.35Å; T978-M981 PolarHBondContact O-N 3.28Å; M981-I984 PolarHBondContact O-N 3.06Å; M981-S985 WeakPolarHBondContact O-CB 3.44Å; M981-S985 PolarHBondContact O-N 2.86Å
982	K	73.1	Confident	68.7	Low	124 Å²	124	74 Å²	74	54%	0.539	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-43.9	175.9	-73.4	174.9	-174.5	171.5	0	111.7	T978 E979 S980 S985 F986	T978-K982 WeakPolarHBondContact O-CG 3.48Å; T978-K982 PolarHBondContact O-N 2.94Å; T978-K982 VanDerWaalsContact O-N 3.08Å; E979-K982 PolarHBondContact O-N 2.6Å; E979-K982 IonicContact OE2-NZ 3.88Å; S980-K982 PolarHBondContact O-N 3.11Å; K982-S985 PolarHBondContact O-N 2.99Å; K982-F986 WeakPolarHBondContact O-CB 3.37Å; K982-F986 PolarHBondContact O-N 3.14Å
983	Q	71	Confident	68.5	Low	86 Å²	86	75.5 Å²	75.5	40%	0.402	38%	0.384	S	S	.	.	H	α-helix	trans	-63.2	-44	176.2	-84.7	-173.4	2.4	0	0	112.6	E979 S980 F986 L987	E979-Q983 PolarHBondContact O-N 3.28Å; S980-Q983 PolarHBondContact O-N 3.06Å; Q983-F986 PolarHBondContact O-N 3.01Å; Q983-L987 WeakPolarHBondContact O-CB 3.39Å; Q983-L987 WeakPolarHBondContact O-CG 3.41Å; Q983-L987 PolarHBondContact O-N 3.34Å
984	I	66.1	Low	68.4	Low	56 Å²	56	73.2 Å²	73.2	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-62.6	-45.6	177.8	-69	166.2	0	0	0	110.1	L960 F961 S980 M981 F986 L987 C988	L960-I984 HydrophobicContact CD1-CG1 4.23Å; L960-I984 HydrophobicContact CD2-CG1 4.48Å; F961-I984 HydrophobicContact CZ-CD1 4.39Å; S980-I984 VanDerWaalsContact O-CG1 3.28Å; S980-I984 WeakPolarHBondContact O-CG1 3.48Å; S980-I984 PolarHBondContact O-N 3.32Å; M981-I984 PolarHBondContact O-N 3.06Å; I984-F986 PolarHBondContact O-N 3.03Å; I984-L987 PolarHBondContact O-N 3.44Å; I984-C988 WeakPolarHBondContact O-CB 3.42Å; I984-C988 PolarHBondContact O-N 3.34Å; I984-C988 PolarHBondContact O-SG 3.3Å
985	S	66.5	Low	67.4	Low	63 Å²	63	72.9 Å²	72.9	44%	0.441	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-43.6	176.6	177.3	0	0	0	0	111.9	M981 K982 C988 N989	M981-S985 WeakPolarHBondContact O-CB 3.44Å; M981-S985 PolarHBondContact O-N 2.86Å; K982-S985 PolarHBondContact O-N 2.99Å; S985-C988 PolarHBondContact O-N 2.68Å; S985-N989 WeakPolarHBondContact O-CB 3.41Å; S985-N989 PolarHBondContact O-N 2.96Å; S985-N989 PolarHBondContact O-ND2 2.81Å
986	F	75.1	Confident	66.1	Low	113 Å²	113	71.6 Å²	71.6	50%	0.496	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-47.6	176.1	176.7	-98	0	0	0	112	F925 K982 Q983 I984 N989 Q990	F925-F986 HydrophobicContact CE1-CE1 4.31Å; K982-F986 WeakPolarHBondContact O-CB 3.37Å; K982-F986 PolarHBondContact O-N 3.14Å; Q983-F986 PolarHBondContact O-N 3.01Å; I984-F986 PolarHBondContact O-N 3.03Å; F986-N989 PolarHBondContact O-N 3.13Å; F986-Q990 HydrophobicContact CE1-CG 4.07Å; F986-Q990 HydrophobicContact CE2-CG 4.32Å; F986-Q990 HydrophobicContact CZ-CG 3.96Å; F986-Q990 WeakPolarHBondContact O-CG 3.46Å; F986-Q990 PolarHBondContact O-N 3.29Å
987	L	70.2	Confident	65	Low	5 Å²	5	75.9 Å²	75.9	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-42.5	177.2	-75.2	165.4	0	0	0	111.9	F925 V926 K929 L930 L960 Q983 I984 Q990 W991	F925-L987 HydrophobicContact CD1-CD2 4.4Å; F925-L987 HydrophobicContact CE1-CD2 4.09Å; V926-L987 HydrophobicContact CB-CD2 4.46Å; V926-L987 HydrophobicContact CG1-CD2 4.44Å; V926-L987 HydrophobicContact CG2-CD2 4.14Å; K929-L987 HydrophobicContact CB-CD1 4.04Å; K929-L987 HydrophobicContact CB-CD2 4.19Å; K929-L987 HydrophobicContact CG-CD2 4.45Å; L930-L987 HydrophobicContact CD1-CB 4.03Å; L930-L987 HydrophobicContact CD1-CD1 4.27Å; L930-L987 HydrophobicContact CG-CD1 4.47Å; L960-L987 HydrophobicContact CD2-CD1 4.25Å; Q983-L987 WeakPolarHBondContact O-CB 3.39Å; Q983-L987 WeakPolarHBondContact O-CG 3.41Å; Q983-L987 PolarHBondContact O-N 3.34Å; I984-L987 PolarHBondContact O-N 3.44Å; L987-Q990 PolarHBondContact O-N 3.16Å; L987-W991 WeakPolarHBondContact O-CB 3.48Å; L987-W991 PolarHBondContact O-N 3Å
988	C	66.5	Low	63.8	Low	62 Å²	62	75.8 Å²	75.8	42%	0.419	38%	0.379	S	S	.	.	H	α-helix	trans	-63.8	-40.7	177.2	-69.2	0	0	0	0	112	I984 S985 W991 L992	I984-C988 WeakPolarHBondContact O-CB 3.42Å; I984-C988 PolarHBondContact O-N 3.34Å; I984-C988 PolarHBondContact O-SG 3.3Å; S985-C988 PolarHBondContact O-N 2.68Å; C988-W991 PolarHBondContact O-N 3.12Å; C988-L992 WeakPolarHBondContact O-CB 3.36Å; C988-L992 PolarHBondContact O-N 3.27Å
989	N	67.3	Low	62.1	Low	94 Å²	94	78 Å²	78	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-43.6	176.8	-79.2	-31.7	0	0	0	112	S985 F986 W991 L992 E993	S985-N989 WeakPolarHBondContact O-CB 3.41Å; S985-N989 PolarHBondContact O-N 2.96Å; S985-N989 PolarHBondContact O-ND2 2.81Å; F986-N989 PolarHBondContact O-N 3.13Å; N989-W991 VanDerWaalsContact C-N 3.3Å; N989-W991 PolarHBondContact O-N 3.49Å; N989-L992 PolarHBondContact O-N 2.92Å; N989-E993 WeakPolarHBondContact O-CB 3.27Å; N989-E993 PolarHBondContact O-N 2.85Å
990	Q	70.3	Confident	60	Low	31 Å²	31	75.9 Å²	75.9	15%	0.145	39%	0.393	C	S	.	.	H	α-helix	trans	-61.5	-39.4	173.4	-73.9	-61.1	-69.8	0	0	111.5	V926 F986 L987 E993 I994	V926-Q990 HydrophobicContact CG2-CB 3.95Å; F986-Q990 HydrophobicContact CE1-CG 4.07Å; F986-Q990 HydrophobicContact CE2-CG 4.32Å; F986-Q990 HydrophobicContact CZ-CG 3.96Å; F986-Q990 WeakPolarHBondContact O-CG 3.46Å; F986-Q990 PolarHBondContact O-N 3.29Å; L987-Q990 PolarHBondContact O-N 3.16Å; Q990-E993 PolarHBondContact NE2-OE2 3.41Å; Q990-E993 VanDerWaalsContact NE2-OE2 3.08Å; Q990-E993 WeakPolarHBondContact O-CB 3.24Å; Q990-E993 PolarHBondContact O-N 3.5Å; Q990-I994 WeakPolarHBondContact O-CG1 3.37Å; Q990-I994 PolarHBondContact O-N 3.02Å
991	W	68.5	Low	58.1	Low	32 Å²	32	81 Å²	81	12%	0.121	42%	0.419	C	S	.	.	H	α-helix	trans	-66.1	-43.8	176.2	-171.3	-113.2	0	0	0	113.1	V926 L927 L933 V936 V937 L987 C988 N989 E993 I994 M995	V926-W991 HydrophobicContact CG1-CB 4.5Å; V926-W991 HydrophobicContact CG1-CE3 3.76Å; V926-W991 HydrophobicContact CG1-CZ3 4.32Å; L927-W991 HydrophobicContact CD2-CH2 4.21Å; L927-W991 HydrophobicContact CD2-CZ3 4.15Å; L933-W991 HydrophobicContact CB-CH2 3.7Å; L933-W991 HydrophobicContact CB-CZ2 3.85Å; L933-W991 HydrophobicContact CB-CZ3 4.21Å; L933-W991 HydrophobicContact CD1-CD2 3.8Å; L933-W991 HydrophobicContact CD1-CE3 4.08Å; L933-W991 HydrophobicContact CD1-CG 4.07Å; L933-W991 HydrophobicContact CD1-CH2 4.42Å; L933-W991 HydrophobicContact CD1-CZ2 4.28Å; L933-W991 HydrophobicContact CD1-CZ3 4.38Å; L933-W991 HydrophobicContact CD2-CZ2 4Å; L933-W991 HydrophobicContact CG-CH2 4.49Å; L933-W991 HydrophobicContact CG-CZ2 4.27Å; V936-W991 HydrophobicContact CB-CZ2 4.06Å; V936-W991 HydrophobicContact CG1-CZ2 4.16Å; V937-W991 HydrophobicContact CB-CH2 4.49Å; V937-W991 HydrophobicContact CG2-CH2 3.3Å; V937-W991 HydrophobicContact CG2-CZ2 4.23Å; V937-W991 HydrophobicContact CG2-CZ3 3.86Å; L987-W991 WeakPolarHBondContact O-CB 3.48Å; L987-W991 PolarHBondContact O-N 3Å; C988-W991 PolarHBondContact O-N 3.12Å; N989-W991 VanDerWaalsContact C-N 3.3Å; N989-W991 PolarHBondContact O-N 3.49Å; W991-E993 VanDerWaalsContact C-N 3.25Å; W991-E993 PolarHBondContact O-N 3.15Å; W991-I994 HydrophobicContact CE3-CD1 4.16Å; W991-I994 PolarHBondContact O-N 3.2Å; W991-M995 HydrophobicContact CD2-CG 4.48Å; W991-M995 HydrophobicContact CZ2-SD 4.35Å; W991-M995 WeakPolarHBondContact O-CB 3.38Å; W991-M995 WeakPolarHBondContact O-CG 3.49Å; W991-M995 PolarHBondContact O-N 3.15Å
992	L	60.7	Low	56.3	Low	80 Å²	80	83.2 Å²	83.2	42%	0.419	43%	0.428	S	S	.	.	H	α-helix	trans	-58.9	-38.7	173.2	-92.8	157.2	0	0	0	111.7	C988 N989 M995 R996	C988-L992 WeakPolarHBondContact O-CB 3.36Å; C988-L992 PolarHBondContact O-N 3.27Å; N989-L992 PolarHBondContact O-N 2.92Å; L992-M995 PolarHBondContact O-N 3.36Å; L992-R996 WeakPolarHBondContact O-CB 3.38Å; L992-R996 WeakPolarHBondContact O-CG 3.38Å; L992-R996 PolarHBondContact O-N 3.41Å
993	E	59.5	Low	54.1	Low	89 Å²	89	88.4 Å²	88.4	42%	0.416	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-44.9	176.3	-165.9	172.8	-160.4	0	0	111.6	N989 Q990 W991 R996 H997	N989-E993 WeakPolarHBondContact O-CB 3.27Å; N989-E993 PolarHBondContact O-N 2.85Å; Q990-E993 PolarHBondContact NE2-OE2 3.41Å; Q990-E993 VanDerWaalsContact NE2-OE2 3.08Å; Q990-E993 WeakPolarHBondContact O-CB 3.24Å; Q990-E993 PolarHBondContact O-N 3.5Å; W991-E993 VanDerWaalsContact C-N 3.25Å; W991-E993 PolarHBondContact O-N 3.15Å; E993-R996 PolarHBondContact O-N 2.9Å; E993-H997 PolarHBondContact O-N 2.86Å; E993-H997 VanDerWaalsContact O-N 3.12Å
994	I	57.7	Low	51.9	Low	25 Å²	25	93.1 Å²	93.1	13%	0.128	47%	0.466	C	S	.	.	H	α-helix	trans	-59.8	-50.8	173.6	-67	164.7	0	0	0	110.4	Q923 V926 Q990 W991 R996 H997 C998	Q923-I994 HydrophobicContact CB-CD1 4.19Å; Q923-I994 HydrophobicContact CG-CD1 4.4Å; V926-I994 HydrophobicContact CG2-CD1 4.41Å; Q990-I994 WeakPolarHBondContact O-CG1 3.37Å; Q990-I994 PolarHBondContact O-N 3.02Å; W991-I994 HydrophobicContact CE3-CD1 4.16Å; W991-I994 PolarHBondContact O-N 3.2Å; I994-R996 PolarHBondContact O-N 2.95Å; I994-H997 PolarHBondContact O-N 2.91Å; I994-H997 VanDerWaalsContact O-N 3.16Å; I994-C998 PolarHBondContact O-N 3.26Å; I994-C998 PolarHBondContact O-SG 3.26Å
995	M	47.1	Very low	49.8	Very low	60 Å²	60	101.8 Å²	101.8	30%	0.296	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-42.9	-179.7	-74.4	-63.9	-66.6	0	0	112.6	V936 W991 L992 H997 C998 L999	V936-M995 HydrophobicContact CG1-SD 4.39Å; W991-M995 HydrophobicContact CD2-CG 4.48Å; W991-M995 HydrophobicContact CZ2-SD 4.35Å; W991-M995 WeakPolarHBondContact O-CB 3.38Å; W991-M995 WeakPolarHBondContact O-CG 3.49Å; W991-M995 PolarHBondContact O-N 3.15Å; L992-M995 PolarHBondContact O-N 3.36Å; M995-H997 VanDerWaalsContact C-N 3.27Å; M995-H997 PolarHBondContact O-N 2.82Å; M995-C998 PolarHBondContact O-N 3.03Å; M995-L999 HydrophobicContact CE-CD1 4.27Å; M995-L999 WeakPolarHBondContact O-CB 3.47Å; M995-L999 VanDerWaalsContact O-CG 3.25Å; M995-L999 WeakPolarHBondContact O-CG 3.49Å; M995-L999 PolarHBondContact O-N 2.85Å
996	R	46.4	Very low	47.8	Very low	137 Å²	137	106 Å²	106	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-38.2	176.5	-74.6	174.7	-156.4	-159.3	8	111.6	L992 E993 I994 G1000 L1001	L992-R996 WeakPolarHBondContact O-CB 3.38Å; L992-R996 WeakPolarHBondContact O-CG 3.38Å; L992-R996 PolarHBondContact O-N 3.41Å; E993-R996 PolarHBondContact O-N 2.9Å; I994-R996 PolarHBondContact O-N 2.95Å; R996-G1000 PolarHBondContact O-N 2.54Å; R996-L1001 HydrophobicContact CB-CB 4.41Å; R996-L1001 HydrophobicContact CG-CD1 4.28Å; R996-L1001 WeakPolarHBondContact O-CB 3.14Å; R996-L1001 PolarHBondContact O-N 2.87Å
997	H	47.9	Very low	45.4	Very low	139 Å²	139	105.9 Å²	105.9	64%	0.644	52%	0.522	S	S	*	.	H	α-helix	trans	-70.1	-47.4	175.8	-116.7	86.2	0	0	0	112.2	E993 I994 M995 L999 G1000	E993-H997 PolarHBondContact O-N 2.86Å; E993-H997 VanDerWaalsContact O-N 3.12Å; I994-H997 PolarHBondContact O-N 2.91Å; I994-H997 VanDerWaalsContact O-N 3.16Å; M995-H997 VanDerWaalsContact C-N 3.27Å; M995-H997 PolarHBondContact O-N 2.82Å; H997-L999 PolarHBondContact O-N 2.99Å; H997-G1000 PolarHBondContact O-N 3.44Å
998	C	42.2	Very low	43.1	Very low	80 Å²	80	110.4 Å²	110.4	54%	0.541	55%	0.554	S	S	.	*	H	α-helix	trans	-59.7	-32.3	177.9	-68	0	0	0	0	112.7	I994 M995 G1000	I994-C998 PolarHBondContact O-N 3.26Å; I994-C998 PolarHBondContact O-SG 3.26Å; M995-C998 PolarHBondContact O-N 3.03Å; C998-G1000 VanDerWaalsContact C-N 3.33Å
999	L	36.9	Very low	41.1	Very low	116 Å²	116	112.8 Å²	112.8	61%	0.607	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	3.9	178	-64.8	172.2	0	0	0	113.7	M995 H997 L1001	M995-L999 HydrophobicContact CE-CD1 4.27Å; M995-L999 WeakPolarHBondContact O-CB 3.47Å; M995-L999 VanDerWaalsContact O-CG 3.25Å; M995-L999 WeakPolarHBondContact O-CG 3.49Å; M995-L999 PolarHBondContact O-N 2.85Å; H997-L999 PolarHBondContact O-N 2.99Å; L999-L1001 HydrophobicContact CB-CD1 4.22Å; L999-L1001 HydrophobicContact CB-CG 4.05Å; L999-L1001 HydrophobicContact CD1-CD1 4.47Å; L999-L1001 PolarHBondContact O-N 3.3Å
1000	G	30.1	Very low	39.2	Very low	56 Å²	56	119.6 Å²	119.6	58%	0.577	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.9	22.6	178.8	0	0	0	0	0	114.4	R996 H997 C998 Q1002	R996-G1000 PolarHBondContact O-N 2.54Å; H997-G1000 PolarHBondContact O-N 3.44Å; C998-G1000 VanDerWaalsContact C-N 3.33Å; G1000-Q1002 VanDerWaalsContact C-N 3.28Å; G1000-Q1002 PolarHBondContact O-N 3.35Å
1001	L	30.4	Very low	37.2	Very low	113 Å²	113	122 Å²	122	59%	0.592	61%	0.608	S	S	*	*			trans	-76.1	79.2	-179.6	-62.8	173.5	0	0	0	109.8	R996 L999 R1003	R996-L1001 HydrophobicContact CB-CB 4.41Å; R996-L1001 HydrophobicContact CG-CD1 4.28Å; R996-L1001 WeakPolarHBondContact O-CB 3.14Å; R996-L1001 PolarHBondContact O-N 2.87Å; L999-L1001 HydrophobicContact CB-CD1 4.22Å; L999-L1001 HydrophobicContact CB-CG 4.05Å; L999-L1001 HydrophobicContact CD1-CD1 4.47Å; L999-L1001 PolarHBondContact O-N 3.3Å; L1001-R1003 PolarHBondContact O-N 3.49Å
1002	Q	28.4	Very low	35.1	Very low	186 Å²	186	124.7 Å²	124.7	87%	0.869	64%	0.636	S	S	*	*			trans	-60.1	131.7	172.8	-77.6	-175.1	-18.5	0	0	110.4	G1000 Q1004	G1000-Q1002 VanDerWaalsContact C-N 3.28Å; G1000-Q1002 PolarHBondContact O-N 3.35Å; Q1002-Q1004 PolarHBondContact O-N 2.83Å
1003	R	27	Very low	33.6	Very low	234 Å²	234	128.7 Å²	128.7	88%	0.883	65%	0.652	S	S	*	*			trans	-59.9	108.9	172.1	-76.2	-174.5	178.7	-162.6	1.4	109.1	L1001 R1005	L1001-R1003 PolarHBondContact O-N 3.49Å; R1003-R1005 PolarHBondContact O-N 3.15Å
1004	Q	25.6	Very low	32.1	Very low	184 Å²	184	132.3 Å²	132.3	86%	0.86	67%	0.67	S	S	*	*			trans	-61.5	121.4	152.2	-81.4	-172.6	-12.6	0	0	107.1	Q1002 I1006	Q1002-Q1004 PolarHBondContact O-N 2.83Å; Q1004-I1006 PolarHBondContact O-N 3.14Å
1005	R	22.2	Very low	30.6	Very low	238 Å²	238	138.2 Å²	138.2	90%	0.898	70%	0.701	S	S	*	*			trans	-53.8	104.6	170.8	-76.1	177.5	176.1	159.8	-1.3	107.3	R1003 P1007	R1003-R1005 PolarHBondContact O-N 3.15Å; R1005-P1007 WeakPolarHBondContact O-CD 3.26Å; R1005-P1007 VanDerWaalsContact O-N 3.14Å
1006	I	24.8	Very low	29.6	Very low	152 Å²	152	142.1 Å²	142.1	78%	0.779	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-55.8	118.5	154.4	-59.1	167.6	0	0	0	103.6	Q1004 S1008	Q1004-I1006 PolarHBondContact O-N 3.14Å; I1006-S1008 PolarHBondContact O-N 2.88Å; I1006-S1008 VanDerWaalsContact O-N 3.1Å
1007	P	23	Very low	28.6	Very low	110 Å²	110	146.7 Å²	146.7	71%	0.714	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-51.2	126.1	175.6	-19.8	29.7	0	0	0	106.4	R1005 P1009	R1005-P1007 WeakPolarHBondContact O-CD 3.26Å; R1005-P1007 VanDerWaalsContact O-N 3.14Å; P1007-P1009 VanDerWaalsContact O-N 3.13Å
1008	S	22.1	Very low	27.4	Very low	100 Å²	100	150 Å²	150	70%	0.699	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-48.3	129.2	179	53.8	0	0	0	0	107.8	I1006 R1010	I1006-S1008 PolarHBondContact O-N 2.88Å; I1006-S1008 VanDerWaalsContact O-N 3.1Å; S1008-R1010 PolarHBondContact O-N 2.96Å
1009	P	25	Very low	26.5	Very low	112 Å²	112	157.2 Å²	157.2	73%	0.727	76%	0.763	S	S	*	*			trans	-58.3	106.6	-178.7	20.8	-29.6	0	0	0	106.8	P1007 S1011	P1007-P1009 VanDerWaalsContact O-N 3.13Å; P1009-S1011 PolarHBondContact O-N 2.82Å
1010	R	27.5	Very low	25.9	Very low	238 Å²	238	156.6 Å²	156.6	90%	0.898	77%	0.769	S	S	*	*	S	Bend	trans	-54.9	117.5	168.6	-84.6	-179.8	171.1	167	-3.3	105.5	S1008	S1008-R1010 PolarHBondContact O-N 2.96Å
1011	S	27.5	Very low	25.6	Very low	82 Å²	82	161 Å²	161	57%	0.573	78%	0.778	S	S	*	*			trans	56.8	106.2	177.9	61	0	0	0	0	116.8	P1009 H1013	P1009-S1011 PolarHBondContact O-N 2.82Å; S1011-H1013 PolarHBondContact O-N 3.15Å
1012	A	26	Very low	25.3	Very low	88 Å²	88	162.1 Å²	162.1	73%	0.727	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	12.1	165.3	0	0	0	0	0	115
1013	H	28.3	Very low	25	Very low	163 Å²	163	163.3 Å²	163.3	76%	0.755	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-5.9	-177.3	-95.6	-32.4	0	0	0	115.6	S1011	S1011-H1013 PolarHBondContact O-N 3.15Å
1014	Q	28.7	Very low	24.8	Very low	166 Å²	166	159.5 Å²	159.5	78%	0.776	78%	0.777	S	S	*	*	S	Bend	trans	-97.9	-13.5	177.3	-77.3	-175.8	-11.3	0	0	115.3
1015	L	25.5	Very low	24.6	Very low	149 Å²	149	157.2 Å²	157.2	78%	0.78	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-84.2	-6.1	177.7	-82.1	166.6	0	0	0	114.7	R1017	L1015-R1017 PolarHBondContact O-N 3.37Å
1016	L	26.1	Very low	24.7	Very low	141 Å²	141	155.1 Å²	155.1	74%	0.738	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-81	10	177.6	-92	156.7	0	0	0	114.7
1017	R	25.1	Very low	24.6	Very low	233 Å²	233	151 Å²	151	88%	0.879	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-107.8	0.5	175.1	-76.1	-159.7	-169.7	-178.6	5	116.2	L1015 R1019	L1015-R1017 PolarHBondContact O-N 3.37Å; R1017-R1019 VanDerWaalsContact C-N 3.32Å; R1017-R1019 PolarHBondContact O-N 3.22Å
1018	Y	23.5	Very low	24.6	Very low	210 Å²	210	157.1 Å²	157.1	82%	0.824	78%	0.778	S	S	*	*			trans	-90	80.2	162.8	-85.3	-88.5	0	0	0	108.4	S1020	Y1018-S1020 PolarHBondContact O-N 2.99Å
1019	R	23.9	Very low	24.6	Very low	230 Å²	230	154.8 Å²	154.8	87%	0.868	77%	0.77	S	S	*	*			trans	-57.6	122.5	160.2	-89.3	-175.4	176	168.8	-1.6	107	R1017 L1021	R1017-R1019 VanDerWaalsContact C-N 3.32Å; R1017-R1019 PolarHBondContact O-N 3.22Å; R1019-L1021 PolarHBondContact O-N 2.94Å
1020	S	23.5	Very low	24.4	Very low	104 Å²	104	156.4 Å²	156.4	73%	0.727	78%	0.778	S	S	*	*			trans	-44.8	103.9	162.8	-50	0	0	0	0	108.6	Y1018 D1022	Y1018-S1020 PolarHBondContact O-N 2.99Å; S1020-D1022 VanDerWaalsContact C-N 3.27Å; S1020-D1022 PolarHBondContact O-N 3.31Å
1021	L	24.2	Very low	24.1	Very low	149 Å²	149	153.9 Å²	153.9	78%	0.78	77%	0.774	S	S	*	*			trans	-85.1	85.4	170.3	-154.8	74.7	0	0	0	105.2	R1019 Y1023	R1019-L1021 PolarHBondContact O-N 2.94Å; L1021-Y1023 PolarHBondContact O-N 2.62Å; L1021-Y1023 VanDerWaalsContact O-N 3.12Å
1022	D	23.5	Very low	23.8	Very low	136 Å²	136	155.3 Å²	155.3	73%	0.727	78%	0.779	S	S	*	*			trans	-58.3	111.3	170.8	-72.7	-35.3	0	0	0	108	S1020 M1024	S1020-D1022 VanDerWaalsContact C-N 3.27Å; S1020-D1022 PolarHBondContact O-N 3.31Å; D1022-M1024 PolarHBondContact O-N 3.19Å
1023	Y	22.2	Very low	23.6	Very low	211 Å²	211	156.6 Å²	156.6	83%	0.827	78%	0.783	S	S	*	*			trans	-69.7	84.7	169	-99.6	-95	0	0	0	108.3	L1021	L1021-Y1023 PolarHBondContact O-N 2.62Å; L1021-Y1023 VanDerWaalsContact O-N 3.12Å
1024	M	23	Very low	23.2	Very low	153 Å²	153	155.5 Å²	155.5	75%	0.754	79%	0.787	S	S	*	*			trans	-88.4	107.5	158.7	-81.5	-78	106.9	0	0	108.1	D1022 K1026	D1022-M1024 PolarHBondContact O-N 3.19Å; M1024-K1026 PolarHBondContact O-N 2.79Å
1025	T	22	Very low	22.9	Very low	136 Å²	136	152.2 Å²	152.2	83%	0.834	78%	0.783	S	S	*	*			trans	-58.1	90.7	162	34.2	0	0	0	0	110
1026	K	23.9	Very low	22.7	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	79%	0.788	S	S	*	*			trans	-130.2	126.1	161.4	-87	-174.1	176.7	177.2	0	109.6	M1024	M1024-K1026 PolarHBondContact O-N 2.79Å
1027	G	22.8	Very low	22.5	Very low	64 Å²	64	149.3 Å²	149.3	66%	0.66	79%	0.785	S	S	*	*			trans	-69.5	170.2	-167	0	0	0	0	0	115.6
1028	Y	21.7	Very low	22.5	Very low	240 Å²	240	145.6 Å²	145.6	94%	0.941	78%	0.783	S	S	*	*			trans	38.3	87.1	148.3	-58.4	-77.2	0	0	0	116.1
1029	G	22.3	Very low	22.4	Very low	51 Å²	51	146.5 Å²	146.5	53%	0.526	79%	0.785	S	S	.	*			trans	-140.7	90.5	162.1	0	0	0	0	0	109	F1031	G1029-F1031 VanDerWaalsContact C-N 3.31Å; G1029-F1031 PolarHBondContact O-N 2.83Å
1030	T	20.3	Very low	22.2	Very low	145 Å²	145	141 Å²	141	89%	0.89	79%	0.789	S	S	*	*			trans	-61	91.6	168.1	-37.9	0	0	0	0	108
1031	F	21.5	Very low	22.2	Very low	186 Å²	186	139.8 Å²	139.8	82%	0.816	78%	0.78	S	S	*	*			trans	-103.5	105.2	172.7	-79.1	-76.7	0	0	0	109.8	G1029	G1029-F1031 VanDerWaalsContact C-N 3.31Å; G1029-F1031 PolarHBondContact O-N 2.83Å
1032	T	22.3	Very low	22.2	Very low	111 Å²	111	139.4 Å²	139.4	68%	0.681	78%	0.779	S	S	*	*			trans	-27.3	128.8	156.3	45.4	0	0	0	0	114.4	V1034	T1032-V1034 PolarHBondContact O-N 2.89Å
1033	S	20.2	Very low	22.1	Very low	116 Å²	116	143.9 Å²	143.9	81%	0.811	79%	0.787	S	S	*	*			trans	8.6	102.6	147	59.3	0	0	0	0	116.2
1034	V	21	Very low	22.1	Very low	139 Å²	139	142.1 Å²	142.1	84%	0.842	79%	0.792	S	S	*	*			trans	-93.1	114.8	156.2	177.6	0	0	0	0	107.5	T1032	T1032-V1034 PolarHBondContact O-N 2.89Å
1035	S	22	Very low	22.2	Very low	98 Å²	98	140 Å²	140	69%	0.685	79%	0.793	S	S	*	*			trans	-43.3	139.8	175	50.7	0	0	0	0	114.8	A1037	S1035-A1037 PolarHBondContact O-N 2.9Å
1036	T	21.4	Very low	22.2	Very low	146 Å²	146	141.7 Å²	141.7	90%	0.896	80%	0.796	S	S	*	*			trans	-46.6	109.6	158.7	46.1	0	0	0	0	112.9
1037	A	22.6	Very low	22.1	Very low	82 Å²	82	138.4 Å²	138.4	68%	0.678	79%	0.792	S	S	*	*			trans	-169.7	95.3	151.6	0	0	0	0	0	108.8	S1035	S1035-A1037 PolarHBondContact O-N 2.9Å
1038	N	23.8	Very low	22.2	Very low	156 Å²	156	144.4 Å²	144.4	83%	0.834	80%	0.802	S	S	*	*	S	Bend	trans	-168.8	94.9	147	-91.9	-31.6	0	0	0	110.9
1039	R	21.3	Very low	22.2	Very low	229 Å²	229	141.9 Å²	141.9	86%	0.864	80%	0.796	S	S	*	*			trans	38.8	90.2	144.2	-71	-179.5	172.4	129.6	-3.1	117.1
1040	A	21.4	Very low	22.1	Very low	115 Å²	115	147.4 Å²	147.4	95%	0.95	81%	0.814	S	S	*	*			trans	-82.2	100.5	139.9	0	0	0	0	0	107.8
1041	S	22.5	Very low	22.2	Very low	77 Å²	77	150.2 Å²	150.2	54%	0.538	81%	0.814	S	S	.	*			trans	-137	133	161.2	58.4	0	0	0	0	107.5
1042	D	24.3	Very low	22.1	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	82%	0.819	S	S	*	*	S	Bend	trans	78	85.4	170.8	-45.1	-29.9	0	0	0	114.7
1043	Y	21.5	Very low	22	Very low	229 Å²	229	152.4 Å²	152.4	90%	0.898	83%	0.827	S	S	*	*	S	Bend	trans	160.4	60.1	143.9	-89.8	-71.1	0	0	0	109
1044	N	23.1	Very low	21.9	Very low	174 Å²	174	151.9 Å²	151.9	93%	0.93	82%	0.822	S	S	*	*			trans	-158	71.9	163.1	-92.1	-25.3	0	0	0	108.4
1045	S	23.3	Very low	21.8	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	82%	0.819	S	S	*	*			trans	-137.8	75.3	170.3	55.7	0	0	0	0	109.4
1046	L	22.4	Very low	21.7	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	82%	0.82	S	S	*	*	S	Bend	trans	-167.2	140.2	149.2	-125.1	82	0	0	0	107.4
1047	V	22.1	Very low	21.7	Very low	126 Å²	126	154.3 Å²	154.3	76%	0.764	82%	0.817	S	S	*	*			trans	92.2	60.3	-174.2	-159.6	0	0	0	0	113.4
1048	H	25.6	Very low	21.7	Very low	190 Å²	190	158.3 Å²	158.3	88%	0.88	82%	0.822	S	S	*	*			trans	-82.7	125.2	155.6	-113.2	-78	0	0	0	108.6
1049	F	20.7	Very low	21.5	Very low	187 Å²	187	160.1 Å²	160.1	82%	0.82	83%	0.825	S	S	*	*			trans	-66.2	131.1	169.7	-93.9	-102.6	0	0	0	110.6	K1051	F1049-K1051 PolarHBondContact O-N 3.44Å
1050	D	21.4	Very low	21.6	Very low	168 Å²	168	158.7 Å²	158.7	90%	0.898	83%	0.825	S	S	*	*			trans	-64.2	105.6	170.7	-71.3	-44	0	0	0	110.6
1051	K	22.3	Very low	21.5	Very low	203 Å²	203	158.3 Å²	158.3	88%	0.883	82%	0.815	S	S	*	*			trans	-118.3	113	161.5	-100.1	-176.3	177.5	179.8	0	109.3	F1049 I1053	F1049-K1051 PolarHBondContact O-N 3.44Å; K1051-I1053 PolarHBondContact O-N 3.11Å
1052	L	18	Very low	21.4	Very low	176 Å²	176	162.8 Å²	162.8	92%	0.921	83%	0.83	S	S	*	*			trans	-49.5	117.4	170.2	-68.9	148.6	0	0	0	112
1053	I	21.8	Very low	21.2	Very low	167 Å²	167	167.3 Å²	167.3	86%	0.856	84%	0.836	S	S	*	*			trans	-139	123.7	150.3	-61.2	-175.7	0	0	0	108.4	K1051	K1051-I1053 PolarHBondContact O-N 3.11Å
1054	C	16.8	Very low	21.3	Very low	106 Å²	106	163.9 Å²	163.9	72%	0.716	83%	0.833	S	S	*	*			trans	-67.4	161.9	179.3	-82.1	0	0	0	0	114.5
1055	N	20.2	Very low	21.4	Very low	145 Å²	145	161 Å²	161	78%	0.775	83%	0.826	S	S	*	*			trans	94.9	103.7	146	-63.1	-18.8	0	0	0	120
1056	S	19.8	Very low	21.4	Very low	101 Å²	101	165.3 Å²	165.3	71%	0.706	83%	0.831	S	S	*	*				95.1	136.9	116.5	78.8	0	0	0	0	119.8
1057	F	20.9	Very low	21.4	Very low	188 Å²	188	163 Å²	163	83%	0.825	83%	0.829	S	S	*	*			trans	85.9	121	161.6	-77.3	-87.9	0	0	0	121.3
1058	E	23.3	Very low	21.5	Very low	166 Å²	166	162.6 Å²	162.6	78%	0.776	83%	0.827	S	S	*	*			trans	89.1	94	146.9	-67.4	-177.2	-172.7	0	0	121.2	K1060	E1058-K1060 PolarHBondContact O-N 3.22Å
1059	Q	19.6	Very low	21.5	Very low	193 Å²	193	159.3 Å²	159.3	90%	0.902	83%	0.825	S	S	*	*			trans	-42.7	118.2	147.7	-67.2	167.8	-15.1	0	0	112.6
1060	K	22.7	Very low	21.6	Very low	199 Å²	199	158 Å²	158	87%	0.865	82%	0.822	S	S	*	*			trans	-129.2	105.6	144.5	-83.4	-175.7	-179.6	169.9	0	109.8	E1058 M1062	E1058-K1060 PolarHBondContact O-N 3.22Å; K1060-M1062 PolarHBondContact O-N 3.45Å
1061	S	18.7	Very low	21.6	Very low	107 Å²	107	161.9 Å²	161.9	75%	0.748	82%	0.824	S	S	*	*			trans	-64.4	117.2	171	152	0	0	0	0	110.5
1062	M	21.2	Very low	21.7	Very low	172 Å²	172	158 Å²	158	85%	0.847	81%	0.813	S	S	*	*			trans	-117.1	105.9	151.5	-93.1	-176.8	76.1	0	0	108.8	K1060 L1064	K1060-M1062 PolarHBondContact O-N 3.45Å; M1062-L1064 PolarHBondContact O-N 2.92Å
1063	R	18.9	Very low	22.1	Very low	237 Å²	237	157.6 Å²	157.6	89%	0.894	81%	0.81	S	S	*	*			trans	-60.3	121.5	166	-81.8	175.3	169.1	171.7	-3.5	109
1064	L	24.5	Very low	22.3	Very low	157 Å²	157	156 Å²	156	82%	0.822	80%	0.803	S	S	*	*			trans	-122.6	127.5	154.8	-96.2	151.9	0	0	0	108.3	M1062	M1062-L1064 PolarHBondContact O-N 2.92Å
1065	S	24.5	Very low	22.6	Very low	112 Å²	112	161 Å²	161	78%	0.783	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.2	-163.4	41.7	0	0	0	0	114.5
1066	K	23.1	Very low	22.7	Very low	201 Å²	201	160 Å²	160	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-54.3	127.6	161.6	-75.5	170.4	171	176.8	0	110.8
1067	S	24.4	Very low	23	Very low	122 Å²	122	159.8 Å²	159.8	85%	0.853	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-103.1	120.3	148.5	58.1	0	0	0	0	108.4
1068	T	23.4	Very low	22.9	Very low	117 Å²	117	160.9 Å²	160.9	72%	0.718	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.5	122	-178.1	39.9	0	0	0	0	110.5
1069	S	25.9	Very low	23.1	Very low	121 Å²	121	162.5 Å²	162.5	85%	0.846	82%	0.82	S	S	*	*			trans	-141.4	87.7	146.3	69.1	0	0	0	0	109.4
1070	E	22.3	Very low	23.2	Very low	160 Å²	160	162.4 Å²	162.4	75%	0.748	82%	0.816	S	S	*	*			trans	-70	125.6	167.1	-69.6	174.4	162.9	0	0	109.1
1071	R	22.5	Very low	23.3	Very low	250 Å²	250	162.6 Å²	162.6	94%	0.943	82%	0.817	S	S	*	*			trans	-127.5	96.7	146.8	-113.1	-176.5	-167.9	162.1	4.8	108.5	I1073	R1071-I1073 PolarHBondContact O-N 2.93Å
1072	N	24	Very low	23.4	Very low	122 Å²	122	167.8 Å²	167.8	65%	0.652	82%	0.822	S	S	*	*			trans	-54.1	120.9	172.3	-75.1	-48.6	0	0	0	111.5
1073	I	26.6	Very low	23.4	Very low	167 Å²	167	165 Å²	165	86%	0.856	82%	0.817	S	S	*	*			trans	-124.4	110.1	149.5	-61.3	178.8	0	0	0	106.3	R1071 K1075	R1071-I1073 PolarHBondContact O-N 2.93Å; I1073-K1075 PolarHBondContact O-N 3.15Å
1074	N	26.2	Very low	23.5	Very low	134 Å²	134	160.4 Å²	160.4	72%	0.717	81%	0.81	S	S	*	*			trans	-61.3	119.5	-167	-65.8	-30.7	0	0	0	112.6
1075	K	21.4	Very low	23.5	Very low	209 Å²	209	158.3 Å²	158.3	91%	0.909	80%	0.804	S	S	*	*			trans	-98.9	97.8	159.4	-81	179.9	176.7	174.9	0	108.2	I1073	I1073-K1075 PolarHBondContact O-N 3.15Å
1076	T	24.1	Very low	23.4	Very low	126 Å²	126	161.9 Å²	161.9	77%	0.773	81%	0.805	S	S	*	*			trans	-100.7	104.3	172.3	23	0	0	0	0	111.6
1077	S	24.6	Very low	23.3	Very low	95 Å²	95	162 Å²	162	66%	0.664	81%	0.807	S	S	*	*			trans	30.8	108.3	145.1	61.8	0	0	0	0	121	K1079	S1077-K1079 PolarHBondContact O-N 2.84Å
1078	F	20.2	Very low	23.4	Very low	212 Å²	212	162.7 Å²	162.7	93%	0.93	81%	0.806	S	S	*	*			trans	-62.2	113.7	150.5	-89.1	-101.2	0	0	0	110.3
1079	K	26.1	Very low	23.2	Very low	199 Å²	199	163.8 Å²	163.8	87%	0.865	81%	0.807	S	S	*	*			trans	-109.2	103	162	-89.1	-175.8	176	175.6	0	109.3	S1077	S1077-K1079 PolarHBondContact O-N 2.84Å
1080	K	21.8	Very low	23.4	Very low	192 Å²	192	165.9 Å²	165.9	84%	0.835	81%	0.809	S	S	*	*			trans	-70.6	116.5	161.4	-78	175.2	173.1	176.5	0	108.2
1081	K	24.5	Very low	23.3	Very low	202 Å²	202	166.6 Å²	166.6	88%	0.878	81%	0.809	S	S	*	*			trans	-138.8	126.8	156.8	-95.1	-171	174.1	-173.4	0	108.7
1082	Y	20.8	Very low	23.6	Very low	216 Å²	216	162 Å²	162	85%	0.847	80%	0.804	S	S	*	*			trans	-60.8	141.5	-179.2	-85.2	-100.4	0	0	0	111.3
1083	P	21.8	Very low	23.8	Very low	114 Å²	114	166.2 Å²	166.2	74%	0.74	82%	0.816	S	S	*	*			trans	-93.9	115.6	174.9	33.7	-23.8	0	0	0	109
1084	D	21.9	Very low	23.7	Very low	141 Å²	141	162.7 Å²	162.7	75%	0.754	81%	0.812	S	S	*	*			trans	-148.6	124.5	167.9	-94.2	-34.6	0	0	0	110.6
1085	T	23.6	Very low	23.6	Very low	113 Å²	113	161.7 Å²	161.7	69%	0.693	81%	0.813	S	S	*	*			trans	90.6	132.7	150.7	67.9	0	0	0	0	121.6
1086	F	22.6	Very low	23.7	Very low	186 Å²	186	160.2 Å²	160.2	82%	0.816	81%	0.814	S	S	*	*			trans	92.8	98.1	157.3	-61.6	-68.8	0	0	0	120.1
1087	F	20.6	Very low	23.6	Very low	205 Å²	205	160.7 Å²	160.7	90%	0.899	81%	0.81	S	S	*	*			trans	-39.7	128.2	149.4	-74.4	-97.5	0	0	0	113.2
1088	T	27.3	Very low	23.6	Very low	136 Å²	136	164.3 Å²	164.3	83%	0.834	82%	0.82	S	S	*	*			trans	-136.8	118.2	146.5	49.4	0	0	0	0	109
1089	N	19.7	Very low	23.7	Very low	140 Å²	140	157.4 Å²	157.4	75%	0.749	81%	0.809	S	S	*	*			trans	-48.9	129.4	166.2	-82.9	-44.3	0	0	0	110.8
1090	D	28	Very low	23.4	Very low	164 Å²	164	155.5 Å²	155.5	88%	0.877	81%	0.808	S	S	*	*			trans	-141.2	99.5	142	-98.5	-33.5	0	0	0	109.3
1091	K	21.7	Very low	23.7	Very low	175 Å²	175	154.1 Å²	154.1	76%	0.761	81%	0.81	S	S	*	*			trans	-62.8	128.9	157.8	-65.3	174.3	175.5	178.4	0	106.4
1092	N	29	Very low	23.6	Very low	155 Å²	155	154 Å²	154	83%	0.829	81%	0.81	S	S	*	*			trans	173.5	136.9	137.4	-86.3	-29.5	0	0	0	112.3
1093	K	27.7	Very low	23.7	Very low	209 Å²	209	149.1 Å²	149.1	91%	0.909	81%	0.807	S	S	*	*			trans	100.5	106.8	162.8	-61.7	-179.2	179.7	-179.8	0	116.9
1094	A	23.3	Very low	23.8	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	81%	0.813	S	S	*	*			trans	-67	169.5	178.9	0	0	0	0	0	113.2
1095	P	25.8	Very low	23.7	Very low	113 Å²	113	152.3 Å²	152.3	73%	0.734	82%	0.821	S	S	*	*			trans	-89.3	137.4	-163.3	34.1	-29.3	0	0	0	112.4
1096	L	23.2	Very low	23.6	Very low	179 Å²	179	151.6 Å²	151.6	94%	0.937	83%	0.827	S	S	*	*			trans	-87.2	115.6	170.3	-144.4	88.2	0	0	0	109.1
1097	I	21.3	Very low	23.7	Very low	136 Å²	136	150.7 Å²	150.7	70%	0.697	83%	0.829	S	S	*	*			trans	-88	166.7	169.9	-62.1	170.6	0	0	0	107.8
1098	I	25.2	Very low	23.8	Very low	170 Å²	170	148.1 Å²	148.1	87%	0.872	82%	0.823	S	S	*	*			trans	94.4	127.5	168.4	-46.3	157.5	0	0	0	111.2
1099	G	22.3	Very low	23.4	Very low	67 Å²	67	150 Å²	150	69%	0.691	83%	0.825	S	S	*	*			cis	172.2	149.5	9	0	0	0	0	0	107
1100	N	20.3	Very low	23.6	Very low	160 Å²	160	150 Å²	150	86%	0.856	83%	0.825	S	S	*	*			trans	-56.2	137.6	177.8	-64.2	-33.1	0	0	0	111.6
1101	D	27.1	Very low	23.3	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	82%	0.818	S	S	*	*			trans	-152.3	122.4	143.7	-95	-31.9	0	0	0	113.5
1102	K	22	Very low	23.5	Very low	201 Å²	201	148 Å²	148	87%	0.874	82%	0.817	S	S	*	*			trans	-45.7	131.2	164.7	-65.3	158.8	174.6	178.6	0	113
1103	S	23.5	Very low	23.1	Very low	112 Å²	112	149 Å²	149	78%	0.783	82%	0.822	S	S	*	*			trans	171.8	115.6	135.3	54.7	0	0	0	0	110.3
1104	S	24.1	Very low	22.8	Very low	126 Å²	126	145.6 Å²	145.6	88%	0.881	82%	0.819	S	S	*	*			trans	174.9	83.1	145.7	-74.2	0	0	0	0	108.4
1105	E	19.6	Very low	22.6	Very low	197 Å²	197	152.2 Å²	152.2	92%	0.921	82%	0.824	S	S	*	*			trans	-73	165	157.5	-76.5	176.8	145	0	0	110.2
1106	A	21.5	Very low	22.4	Very low	98 Å²	98	151.6 Å²	151.6	81%	0.81	82%	0.822	S	S	*	*			trans	89.8	73	162.2	0	0	0	0	0	118.6
1107	I	23.5	Very low	22.3	Very low	167 Å²	167	150.6 Å²	150.6	86%	0.856	82%	0.817	S	S	*	*	S	Bend	trans	-136.7	110	136.6	-59.8	-176.1	0	0	0	109.8
1108	L	22.8	Very low	22.2	Very low	150 Å²	150	149.7 Å²	149.7	79%	0.785	82%	0.823	S	S	*	*			trans	32.2	105	154.7	-93.8	81.8	0	0	0	119.7	N1110	L1108-N1110 PolarHBondContact O-N 2.77Å
1109	M	20.3	Very low	22.1	Very low	177 Å²	177	146.5 Å²	146.5	87%	0.872	81%	0.811	S	S	*	*			trans	-63.1	115.9	141.2	-66.9	-77.2	-143	0	0	109.2
1110	N	24.1	Very low	22	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	82%	0.817	S	S	*	*			trans	-128.5	86.8	156.3	-154.6	2.8	0	0	0	107.4	L1108 N1112	L1108-N1110 PolarHBondContact O-N 2.77Å; N1110-N1112 PolarHBondContact O-N 3.42Å
1111	E	21.9	Very low	22.1	Very low	159 Å²	159	151.1 Å²	151.1	74%	0.743	82%	0.815	S	S	*	*			trans	-57.8	117.4	162.1	-62.8	179	146.6	0	0	107.9
1112	N	24.1	Very low	21.8	Very low	139 Å²	139	150 Å²	150	74%	0.743	81%	0.809	S	S	*	*			trans	176.3	67.9	151.4	-86.6	-34.4	0	0	0	110.1	N1110	N1110-N1112 PolarHBondContact O-N 3.42Å
1113	L	22.7	Very low	21.9	Very low	177 Å²	177	149.7 Å²	149.7	93%	0.927	81%	0.81	S	S	*	*			trans	-139.9	51.9	157.3	-132.2	115	0	0	0	110.7
1114	T	20.9	Very low	21.8	Very low	137 Å²	137	153.5 Å²	153.5	84%	0.84	81%	0.813	S	S	*	*			trans	-97.1	78.3	166.7	38.8	0	0	0	0	109
1115	R	19.6	Very low	21.6	Very low	231 Å²	231	156 Å²	156	87%	0.872	81%	0.813	S	S	*	*			trans	-143	98.7	161.3	-144.8	177.8	-147.6	170.1	8.2	111.4
1116	S	20.6	Very low	21.7	Very low	100 Å²	100	154.5 Å²	154.5	70%	0.699	81%	0.809	S	S	*	*			trans	50.1	95.6	146.2	65.1	0	0	0	0	118.2
1117	L	20.3	Very low	21.7	Very low	159 Å²	159	157.8 Å²	157.8	83%	0.832	81%	0.81	S	S	*	*				-162.4	82.7	121.7	-148.2	72.3	0	0	0	110.3	T1119	L1117-T1119 PolarHBondContact O-N 3.37Å
1118	S	19.4	Very low	21.6	Very low	117 Å²	117	153.2 Å²	153.2	82%	0.818	80%	0.804	S	S	*	*			trans	-74.5	98.6	157.6	43.1	0	0	0	0	108.4
1119	T	22.9	Very low	21.7	Very low	103 Å²	103	154.4 Å²	154.4	63%	0.632	80%	0.802	S	S	*	*			trans	-135.1	91.5	149.4	22.3	0	0	0	0	106.7	L1117 N1121	L1117-T1119 PolarHBondContact O-N 3.37Å; T1119-N1121 PolarHBondContact O-N 2.92Å
1120	E	21.5	Very low	21.7	Very low	175 Å²	175	155.1 Å²	155.1	82%	0.818	80%	0.803	S	S	*	*			trans	-57.5	88.7	166.2	-69.4	175.4	154.2	0	0	108.8	N1122	E1120-N1122 PolarHBondContact O-N 3.35Å
1121	N	21.9	Very low	21.6	Very low	149 Å²	149	158.5 Å²	158.5	80%	0.797	81%	0.807	S	S	*	*			trans	-70.5	91.1	161	-92.6	-25.9	0	0	0	107.1	T1119 Q1123	T1119-N1121 PolarHBondContact O-N 2.92Å; N1121-Q1123 VanDerWaalsContact C-N 3.28Å; N1121-Q1123 PolarHBondContact O-N 3.12Å
1122	N	21.8	Very low	21.6	Very low	139 Å²	139	156.7 Å²	156.7	74%	0.743	81%	0.812	S	S	*	*			trans	-51.1	94.3	164	-85.7	-53.5	0	0	0	109.3	E1120 K1124	E1120-N1122 PolarHBondContact O-N 3.35Å; N1122-K1124 PolarHBondContact O-N 2.89Å
1123	Q	22.2	Very low	21.6	Very low	194 Å²	194	154.4 Å²	154.4	91%	0.907	80%	0.799	S	S	*	*			trans	-66	75.1	165	-73.8	179.3	-14.9	0	0	108.2	N1121 M1125	N1121-Q1123 VanDerWaalsContact C-N 3.28Å; N1121-Q1123 PolarHBondContact O-N 3.12Å; Q1123-M1125 VanDerWaalsContact C-N 3.32Å; Q1123-M1125 PolarHBondContact O-N 3.2Å
1124	K	21.6	Very low	21.8	Very low	192 Å²	192	152.1 Å²	152.1	84%	0.835	79%	0.792	S	S	*	*			trans	-69.9	96.6	166.9	-104.9	178.7	177.7	173.3	0	107.9	N1122 I1126	N1122-K1124 PolarHBondContact O-N 2.89Å; K1124-I1126 PolarHBondContact O-N 2.92Å
1125	M	19.8	Very low	22.1	Very low	179 Å²	179	152.5 Å²	152.5	88%	0.882	79%	0.789	S	S	*	*			trans	-22	108.7	162.8	-135.7	172.1	170.8	0	0	112.1	Q1123 M1127	Q1123-M1125 VanDerWaalsContact C-N 3.32Å; Q1123-M1125 PolarHBondContact O-N 3.2Å; M1125-M1127 VanDerWaalsContact C-N 3.34Å; M1125-M1127 PolarHBondContact O-N 3.38Å
1126	I	23.3	Very low	22.4	Very low	164 Å²	164	143.5 Å²	143.5	84%	0.841	76%	0.764	S	S	*	*			trans	-72.9	89	177.4	-59.8	169.3	0	0	0	107.1	K1124 G1128	K1124-I1126 PolarHBondContact O-N 2.92Å; I1126-G1128 PolarHBondContact O-N 3.33Å
1127	M	21.5	Very low	22.7	Very low	168 Å²	168	141.5 Å²	141.5	83%	0.828	75%	0.754	S	S	*	*			trans	-66.4	117.9	166.6	-90.5	-155.9	178.6	0	0	108.9	M1125 K1129	M1125-M1127 VanDerWaalsContact C-N 3.34Å; M1125-M1127 PolarHBondContact O-N 3.38Å; M1127-K1129 PolarHBondContact O-N 3.09Å
1128	G	21.3	Very low	23.4	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	75%	0.749	S	S	*	*			trans	-56.1	102.5	179.2	0	0	0	0	0	111.8	I1126 H1130	I1126-G1128 PolarHBondContact O-N 3.33Å; G1128-H1130 PolarHBondContact O-N 2.99Å
1129	K	23.5	Very low	24.2	Very low	175 Å²	175	138 Å²	138	76%	0.761	73%	0.726	S	S	*	*			trans	-76.7	120.2	169.4	-71.4	-176.6	177.3	-177.9	0	108.5	M1127 Y1131	M1127-K1129 PolarHBondContact O-N 3.09Å; K1129-Y1131 WeakPolarHBondContact O-CD2 3.38Å; K1129-Y1131 WeakPolarHBondContact O-CE2 3.34Å; K1129-Y1131 PolarHBondContact O-N 3.4Å; K1129-Y1131 VanDerWaalsContact O-N 3.15Å
1130	H	21.1	Very low	25.2	Very low	193 Å²	193	135.7 Å²	135.7	89%	0.894	71%	0.707	S	S	*	*			trans	-54.5	111.6	167.9	-78	-104	0	0	0	109.4	G1128	G1128-H1130 PolarHBondContact O-N 2.99Å
1131	Y	22.1	Very low	26.7	Very low	209 Å²	209	130.7 Å²	130.7	82%	0.82	69%	0.69	S	S	*	*			trans	-81.5	121.2	179.9	-78.9	-89	0	0	0	110.4	K1129 I1133	K1129-Y1131 WeakPolarHBondContact O-CD2 3.38Å; K1129-Y1131 WeakPolarHBondContact O-CE2 3.34Å; K1129-Y1131 PolarHBondContact O-N 3.4Å; K1129-Y1131 VanDerWaalsContact O-N 3.15Å; Y1131-I1133 PolarHBondContact O-N 3.11Å
1132	S	21.5	Very low	28.3	Very low	121 Å²	121	123.7 Å²	123.7	85%	0.846	65%	0.653	S	S	*	*			trans	-75.1	110.4	172.8	-68.3	0	0	0	0	110.5	V1134	S1132-V1134 PolarHBondContact O-N 3.34Å
1133	I	24.5	Very low	30.4	Very low	90 Å²	90	117.9 Å²	117.9	46%	0.462	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-83	0.9	-168.5	-73.7	165.4	0	0	0	114.6	Y1131 N1135 A1136	Y1131-I1133 PolarHBondContact O-N 3.11Å; I1133-N1135 PolarHBondContact O-N 2.89Å; I1133-A1136 PolarHBondContact O-N 3.2Å; I1133-A1136 VanDerWaalsContact O-N 3.13Å
1134	V	25.9	Very low	33	Very low	129 Å²	129	108.6 Å²	108.6	78%	0.782	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-70.2	-25.2	-167.9	-173.7	0	0	0	0	114.4	S1132	S1132-V1134 PolarHBondContact O-N 3.34Å
1135	N	27.7	Very low	35.9	Very low	145 Å²	145	99.5 Å²	99.5	78%	0.775	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-87.7	-0.2	176	-74.9	-0.6	0	0	0	114.2	I1133	I1133-N1135 PolarHBondContact O-N 2.89Å
1136	A	25.5	Very low	38.7	Very low	42 Å²	42	93.5 Å²	93.5	35%	0.347	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-91.7	-5.6	-179.1	0	0	0	0	0	113.8	I1133 D1138 I1139	I1133-A1136 PolarHBondContact O-N 3.2Å; I1133-A1136 VanDerWaalsContact O-N 3.13Å; A1136-D1138 PolarHBondContact O-N 3.45Å; A1136-D1138 VanDerWaalsContact O-N 3.1Å; A1136-I1139 CarbonylContact O-C 3.58Å; A1136-I1139 PolarHBondContact O-N 2.89Å
1137	A	26.7	Very low	41.4	Very low	59 Å²	59	86.4 Å²	86.4	49%	0.488	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.8	-179	0	0	0	0	0	113.3	I1139 F1140	A1137-I1139 VanDerWaalsContact C-N 3.3Å; A1137-I1139 PolarHBondContact O-N 3.34Å; A1137-F1140 WeakPolarHBondContact O-CD2 3.32Å; A1137-F1140 WeakPolarHBondContact O-CE2 3.1Å
1138	D	35.1	Very low	44.3	Very low	139 Å²	139	78.4 Å²	78.4	74%	0.743	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-9.7	175.2	-71.1	-24.1	0	0	0	114	A1136 R1322	A1136-D1138 PolarHBondContact O-N 3.45Å; A1136-D1138 VanDerWaalsContact O-N 3.1Å; D1138-R1322 PolarHBondContact O-NH2 3.28Å
1139	I	36.6	Very low	47.3	Very low	63 Å²	63	78 Å²	78	32%	0.323	41%	0.413	S	S	.	.	S	Bend	trans	-116.4	63.9	174.7	-45.5	177.5	0	0	0	108.2	A1136 A1137 L1304 Y1308	A1136-I1139 CarbonylContact O-C 3.58Å; A1136-I1139 PolarHBondContact O-N 2.89Å; A1137-I1139 VanDerWaalsContact C-N 3.3Å; A1137-I1139 PolarHBondContact O-N 3.34Å; I1139-L1304 HydrophobicContact CD1-CD2 4.13Å; I1139-Y1308 HydrophobicContact CD1-CD2 4.22Å; I1139-Y1308 HydrophobicContact CD1-CE2 4.36Å
1140	F	44.9	Very low	50	Low	55 Å²	55	71.7 Å²	71.7	24%	0.241	39%	0.39	C	S	.	.			trans	-53.8	129.2	167	-83.4	-86.4	0	0	0	109.6	A1137 V1142 L1197 L1241	A1137-F1140 WeakPolarHBondContact O-CD2 3.32Å; A1137-F1140 WeakPolarHBondContact O-CE2 3.1Å; F1140-V1142 PolarHBondContact O-N 2.99Å; F1140-V1142 VanDerWaalsContact O-N 3.09Å; F1140-L1197 HydrophobicContact CD1-CD1 4.07Å; F1140-L1197 HydrophobicContact CE1-CD1 3.56Å; F1140-L1241 HydrophobicContact CB-CD2 3.92Å; F1140-L1241 HydrophobicContact CD1-CD2 3.1Å; F1140-L1241 HydrophobicContact CD2-CD2 3.81Å; F1140-L1241 HydrophobicContact CE1-CD2 3.35Å; F1140-L1241 HydrophobicContact CE2-CD2 4.04Å; F1140-L1241 HydrophobicContact CG-CD2 3.34Å; F1140-L1241 HydrophobicContact CZ-CD2 3.83Å
1141	P	51.6	Low	53.1	Low	70 Å²	70	63.3 Å²	63.3	46%	0.455	35%	0.351	S	S	.	.	S	Bend	trans	-64.4	-18.7	-177.4	22.7	-30.7	0	0	0	112.3	W1151	P1141-W1151 HydrophobicContact CG-CH2 3.85Å; P1141-W1151 HydrophobicContact CG-CZ2 4.2Å
1142	V	56.6	Low	56	Low	2 Å²	2	53.3 Å²	53.3	1%	0.012	31%	0.312	C	S	.	.			trans	-119.3	87.8	-171.7	-175.1	0	0	0	0	110.7	F1140 C1144 L1147 L1148 W1151	F1140-V1142 PolarHBondContact O-N 2.99Å; F1140-V1142 VanDerWaalsContact O-N 3.09Å; V1142-C1144 WeakPolarHBondContact CG1-O 3.41Å; V1142-L1147 VanDerWaalsContact CG1-C 3.49Å; V1142-L1147 HydrophobicContact CG1-CB 3.53Å; V1142-L1148 VanDerWaalsContact CG1-CA 3.41Å; V1142-L1148 HydrophobicContact CG1-CB 3.65Å; V1142-W1151 HydrophobicContact CG2-CD2 3.76Å; V1142-W1151 HydrophobicContact CG2-CE3 4.31Å; V1142-W1151 HydrophobicContact CG2-CG 4.04Å; V1142-W1151 HydrophobicContact CG2-CZ2 4.06Å
1143	A	64.8	Low	58.9	Low	16 Å²	16	50.8 Å²	50.8	13%	0.132	29%	0.289	C	S	.	.			trans	-89.9	-9.5	177.9	0	0	0	0	0	114.4	A1317 R1327	A1143-A1317 HydrophobicContact CB-CB 4.37Å; A1143-R1327 PolarHBondContact O-NH1 3.16Å
1144	C	77.6	Confident	61.7	Low	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-100.9	133.6	174.3	-177.8	0	0	0	0	110	V1142 I1146 L1147 L1148 C1219 C1221 C1316	V1142-C1144 WeakPolarHBondContact CG1-O 3.41Å; C1144-I1146 PolarHBondContact O-N 3.48Å; C1144-I1146 PolarHBondContact SG-N 3.48Å; C1144-I1146 VanDerWaalsContact SG-N 3.4Å; C1144-L1147 HydrophobicContact CB-CB 4.24Å; C1144-L1147 HydrophobicContact CB-CD1 4.25Å; C1144-L1147 HydrophobicContact CB-CG 4.32Å; C1144-L1147 PolarHBondContact O-N 3.39Å; C1144-L1147 VanDerWaalsContact O-N 3.17Å; C1144-L1148 PolarHBondContact O-N 2.9Å; C1144-C1219 HydrophobicContact CB-CB 3.64Å; C1144-C1221 WeakPolarHBondContact CB-SG 3.09Å; C1144-C1221 WeakPolarHBondContact SG-CB 3.36Å; C1144-C1221 CovalentContact SG-SG 2.13Å; C1144-C1221 PolarHBondContact SG-SG 3.36Å; C1144-C1316 WeakPolarHBondContact CB-SG 3.45Å; C1144-C1316 PolarHBondContact SG-SG 3.46Å
1145	P	81.5	Confident	64.3	Low	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-33.6	174.5	25.8	-35.4	0	0	0	112.4	L1147 L1148 R1149 P1227 I1229 E1233 F1237 F1329	P1145-L1147 PolarHBondContact O-N 2.79Å; P1145-L1148 CarbonylContact O-C 3.28Å; P1145-L1148 WeakPolarHBondContact O-CA 3.15Å; P1145-L1148 WeakPolarHBondContact O-CB 3.15Å; P1145-L1148 PolarHBondContact O-N 3.16Å; P1145-L1148 VanDerWaalsContact O-N 3.08Å; P1145-R1149 WeakPolarHBondContact O-CB 3.29Å; P1145-R1149 PolarHBondContact O-N 2.78Å; P1145-P1227 HydrophobicContact CG-CB 3.89Å; P1145-P1227 HydrophobicContact CG-CG 4.03Å; P1145-I1229 HydrophobicContact CB-CG1 4.27Å; P1145-E1233 HydrophobicContact CB-CG 3.99Å; P1145-F1237 HydrophobicContact CB-CD2 3.98Å; P1145-F1237 HydrophobicContact CB-CE2 4.08Å; P1145-F1237 HydrophobicContact CB-CG 4.37Å; P1145-F1237 HydrophobicContact CG-CE2 4.42Å; P1145-F1329 HydrophobicContact CG-CD1 4.06Å; P1145-F1329 HydrophobicContact CG-CE1 3.77Å
1146	I	79.8	Confident	66.8	Low	53 Å²	53	40.7 Å²	40.7	27%	0.272	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-38.4	177.7	-55.1	-179.7	0	0	0	112	C1144 L1148 S1150 C1221 P1227	C1144-I1146 PolarHBondContact O-N 3.48Å; C1144-I1146 PolarHBondContact SG-N 3.48Å; C1144-I1146 VanDerWaalsContact SG-N 3.4Å; I1146-L1148 VanDerWaalsContact C-N 3.33Å; I1146-S1150 PolarHBondContact O-N 3.42Å; I1146-S1150 VanDerWaalsContact O-N 3.07Å; I1146-S1150 PolarHBondContact O-OG 3.48Å; I1146-C1221 HydrophobicContact CD1-CB 4.16Å; I1146-P1227 HydrophobicContact CD1-CB 3.99Å; I1146-P1227 HydrophobicContact CG1-CB 4.15Å
1147	L	78.6	Confident	69.2	Low	15 Å²	15	45.1 Å²	45.1	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-36.8	173	-82	173.8	0	0	0	110.5	V1142 C1144 P1145 S1150 W1151 C1219	V1142-L1147 VanDerWaalsContact CG1-C 3.49Å; V1142-L1147 HydrophobicContact CG1-CB 3.53Å; C1144-L1147 HydrophobicContact CB-CB 4.24Å; C1144-L1147 HydrophobicContact CB-CD1 4.25Å; C1144-L1147 HydrophobicContact CB-CG 4.32Å; C1144-L1147 PolarHBondContact O-N 3.39Å; C1144-L1147 VanDerWaalsContact O-N 3.17Å; P1145-L1147 PolarHBondContact O-N 2.79Å; L1147-S1150 WeakPolarHBondContact O-CB 3.17Å; L1147-S1150 PolarHBondContact O-N 2.82Å; L1147-W1151 PolarHBondContact O-N 3.49Å; L1147-C1219 HydrophobicContact CD1-CB 3.42Å; L1147-C1219 VanDerWaalsContact CD1-CB 3.42Å; L1147-C1219 HydrophobicContact CG-CB 3.84Å
1148	L	82.7	Confident	71.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-46.5	177.4	179	61.9	0	0	0	109.9	V1142 C1144 P1145 I1146 S1150 W1151 L1152 F1193 E1233 I1236 F1237 L1241	V1142-L1148 VanDerWaalsContact CG1-CA 3.41Å; V1142-L1148 HydrophobicContact CG1-CB 3.65Å; C1144-L1148 PolarHBondContact O-N 2.9Å; P1145-L1148 CarbonylContact O-C 3.28Å; P1145-L1148 WeakPolarHBondContact O-CA 3.15Å; P1145-L1148 WeakPolarHBondContact O-CB 3.15Å; P1145-L1148 PolarHBondContact O-N 3.16Å; P1145-L1148 VanDerWaalsContact O-N 3.08Å; I1146-L1148 VanDerWaalsContact C-N 3.33Å; L1148-S1150 VanDerWaalsContact C-N 3.27Å; L1148-S1150 PolarHBondContact O-N 3.32Å; L1148-W1151 CarbonylContact O-C 3.55Å; L1148-W1151 WeakPolarHBondContact O-CA 3.43Å; L1148-W1151 WeakPolarHBondContact O-CB 3.48Å; L1148-W1151 PolarHBondContact O-N 2.91Å; L1148-W1151 VanDerWaalsContact O-N 3.07Å; L1148-L1152 HydrophobicContact CD1-CD1 4.21Å; L1148-L1152 HydrophobicContact CD1-CD2 4.43Å; L1148-L1152 HydrophobicContact CD1-CG 4.05Å; L1148-L1152 HydrophobicContact CD2-CD1 4.34Å; L1148-L1152 HydrophobicContact CG-CD1 3.84Å; L1148-L1152 HydrophobicContact CG-CG 4.14Å; L1148-L1152 WeakPolarHBondContact O-CB 3.15Å; L1148-L1152 VanDerWaalsContact O-CG 3.3Å; L1148-L1152 WeakPolarHBondContact O-CG 3.24Å; L1148-L1152 PolarHBondContact O-N 3.48Å; L1148-F1193 HydrophobicContact CD1-CD2 4.17Å; L1148-F1193 HydrophobicContact CD1-CE1 4.42Å; L1148-F1193 HydrophobicContact CD1-CE2 3.5Å; L1148-F1193 HydrophobicContact CD1-CZ 3.65Å; L1148-E1233 HydrophobicContact CB-CB 4.43Å; L1148-E1233 HydrophobicContact CD2-CB 3.71Å; L1148-E1233 HydrophobicContact CG-CB 4Å; L1148-I1236 HydrophobicContact CD1-CG2 4.45Å; L1148-I1236 HydrophobicContact CD2-CB 4.14Å; L1148-I1236 HydrophobicContact CD2-CG2 3.87Å; L1148-F1237 HydrophobicContact CD2-CB 4.05Å; L1148-F1237 HydrophobicContact CD2-CD2 4.15Å; L1148-L1241 HydrophobicContact CD1-CD1 4.25Å; L1148-L1241 HydrophobicContact CD2-CD1 3.62Å; L1148-L1241 HydrophobicContact CG-CD1 4.36Å
1149	R	84.5	Confident	72.9	Confident	62 Å²	62	44.1 Å²	44.1	23%	0.234	22%	0.217	C	C	.	.	H	α-helix	trans	-56.1	-41.4	173.4	-172.6	168.7	71	-175.8	2.7	112.6	P1145 L1152 N1153 T1230 L1232	P1145-R1149 WeakPolarHBondContact O-CB 3.29Å; P1145-R1149 PolarHBondContact O-N 2.78Å; R1149-L1152 PolarHBondContact O-N 2.93Å; R1149-N1153 WeakPolarHBondContact O-CB 3.25Å; R1149-N1153 VanDerWaalsContact O-CG 3.29Å; R1149-N1153 PolarHBondContact O-N 3.2Å; R1149-N1153 PolarHBondContact O-ND2 3.42Å; R1149-T1230 WeakPolarHBondContact CD-OG1 3.44Å; R1149-T1230 PolarHBondContact NH1-OG1 3.49Å; R1149-L1232 HydrophobicContact CG-CD2 4.15Å
1150	S	81.6	Confident	74.1	Confident	42 Å²	42	44.5 Å²	44.5	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-63.8	-41.5	175.8	-54.8	0	0	0	0	111.9	I1146 L1147 L1148 E1154	I1146-S1150 PolarHBondContact O-N 3.42Å; I1146-S1150 VanDerWaalsContact O-N 3.07Å; I1146-S1150 PolarHBondContact O-OG 3.48Å; L1147-S1150 WeakPolarHBondContact O-CB 3.17Å; L1147-S1150 PolarHBondContact O-N 2.82Å; L1148-S1150 VanDerWaalsContact C-N 3.27Å; L1148-S1150 PolarHBondContact O-N 3.32Å; S1150-E1154 WeakPolarHBondContact O-CG 3.34Å; S1150-E1154 PolarHBondContact O-N 2.96Å
1151	W	84.4	Confident	74.9	Confident	17 Å²	17	42.2 Å²	42.2	6%	0.064	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-49.4	173.2	-91.4	47.6	0	0	0	112.1	P1141 V1142 L1147 L1148 N1153 E1154 I1155 F1193 L1197 L1211 S1215	P1141-W1151 HydrophobicContact CG-CH2 3.85Å; P1141-W1151 HydrophobicContact CG-CZ2 4.2Å; V1142-W1151 HydrophobicContact CG2-CD2 3.76Å; V1142-W1151 HydrophobicContact CG2-CE3 4.31Å; V1142-W1151 HydrophobicContact CG2-CG 4.04Å; V1142-W1151 HydrophobicContact CG2-CZ2 4.06Å; L1147-W1151 PolarHBondContact O-N 3.49Å; L1148-W1151 CarbonylContact O-C 3.55Å; L1148-W1151 WeakPolarHBondContact O-CA 3.43Å; L1148-W1151 WeakPolarHBondContact O-CB 3.48Å; L1148-W1151 PolarHBondContact O-N 2.91Å; L1148-W1151 VanDerWaalsContact O-N 3.07Å; W1151-N1153 VanDerWaalsContact C-N 3.31Å; W1151-N1153 PolarHBondContact O-N 3.45Å; W1151-E1154 PolarHBondContact O-N 2.9Å; W1151-I1155 VanDerWaalsContact O-CG1 3.24Å; W1151-I1155 WeakPolarHBondContact O-CG1 3.36Å; W1151-I1155 PolarHBondContact O-N 3.2Å; W1151-F1193 HydrophobicContact CE3-CD2 4.32Å; W1151-F1193 AromaticContact CE3-CE2 3.85Å; W1151-F1193 HydrophobicContact CE3-CE2 3.85Å; W1151-F1193 HydrophobicContact CZ3-CE2 4.32Å; W1151-L1197 HydrophobicContact CZ3-CD2 4.35Å; W1151-L1211 HydrophobicContact CB-CD2 4.18Å; W1151-L1211 HydrophobicContact CD2-CB 4.3Å; W1151-L1211 HydrophobicContact CD2-CD2 3.74Å; W1151-L1211 HydrophobicContact CD2-CG 4.41Å; W1151-L1211 HydrophobicContact CE3-CD1 4.23Å; W1151-L1211 HydrophobicContact CE3-CD2 4.15Å; W1151-L1211 HydrophobicContact CG-CD2 3.75Å; W1151-L1211 HydrophobicContact CH2-CB 4.17Å; W1151-L1211 HydrophobicContact CZ2-CB 3.78Å; W1151-L1211 HydrophobicContact CZ3-CD1 4.23Å; W1151-L1211 PolarHBondContact NE1-O 2.98Å; W1151-S1215 WeakPolarHBondContact CZ2-OG 2.95Å; W1151-S1215 PolarHBondContact NE1-OG 3.46Å; W1151-S1215 VanDerWaalsContact NE1-OG 3.12Å
1152	L	83.8	Confident	75.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-38.1	-178.9	-69	176.1	0	0	0	111.7	L1148 R1149 I1155 K1156 L1189 F1193 L1232 E1233 I1236	L1148-L1152 HydrophobicContact CD1-CD1 4.21Å; L1148-L1152 HydrophobicContact CD1-CD2 4.43Å; L1148-L1152 HydrophobicContact CD1-CG 4.05Å; L1148-L1152 HydrophobicContact CD2-CD1 4.34Å; L1148-L1152 HydrophobicContact CG-CD1 3.84Å; L1148-L1152 HydrophobicContact CG-CG 4.14Å; L1148-L1152 WeakPolarHBondContact O-CB 3.15Å; L1148-L1152 VanDerWaalsContact O-CG 3.3Å; L1148-L1152 WeakPolarHBondContact O-CG 3.24Å; L1148-L1152 PolarHBondContact O-N 3.48Å; R1149-L1152 PolarHBondContact O-N 2.93Å; L1152-I1155 PolarHBondContact O-N 3.13Å; L1152-K1156 WeakPolarHBondContact O-CB 3.39Å; L1152-K1156 PolarHBondContact O-N 3.4Å; L1152-L1189 HydrophobicContact CB-CD2 4.14Å; L1152-L1189 HydrophobicContact CD2-CD2 4.11Å; L1152-L1189 HydrophobicContact CD2-CG 4.04Å; L1152-F1193 HydrophobicContact CD2-CB 4.06Å; L1152-F1193 HydrophobicContact CD2-CD2 4.1Å; L1152-F1193 HydrophobicContact CD2-CG 4.2Å; L1152-L1232 HydrophobicContact CB-CD2 3.88Å; L1152-L1232 HydrophobicContact CB-CG 4.21Å; L1152-L1232 HydrophobicContact CD1-CG 4.12Å; L1152-E1233 HydrophobicContact CD1-CB 3.89Å; L1152-I1236 HydrophobicContact CD1-CD1 3.97Å; L1152-I1236 HydrophobicContact CD2-CD1 3.82Å
1153	N	83.4	Confident	75.7	Confident	68 Å²	68	50.8 Å²	50.8	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-45.1	173.6	-76	-16.4	0	0	0	112.3	R1149 W1151 I1155 K1156 H1157 L1232	R1149-N1153 WeakPolarHBondContact O-CB 3.25Å; R1149-N1153 VanDerWaalsContact O-CG 3.29Å; R1149-N1153 PolarHBondContact O-N 3.2Å; R1149-N1153 PolarHBondContact O-ND2 3.42Å; W1151-N1153 VanDerWaalsContact C-N 3.31Å; W1151-N1153 PolarHBondContact O-N 3.45Å; N1153-I1155 VanDerWaalsContact C-N 3.31Å; N1153-I1155 PolarHBondContact O-N 3.27Å; N1153-K1156 PolarHBondContact O-N 3.2Å; N1153-H1157 PolarHBondContact O-CD2 3.42Å; N1153-H1157 PolarHBondContact O-N 3.34Å; N1153-L1232 VanDerWaalsContact OD1-CD2 3.26Å; N1153-L1232 WeakPolarHBondContact OD1-CD2 3.42Å
1154	E	81.6	Confident	75.4	Confident	74 Å²	74	53.1 Å²	53.1	35%	0.346	25%	0.246	S	C	.	.	H	α-helix	trans	-61.5	-39.6	174.8	-72.2	-61.7	149.9	0	0	112	S1150 W1151 H1157 H1158 T1210 L1211 L1214	S1150-E1154 WeakPolarHBondContact O-CG 3.34Å; S1150-E1154 PolarHBondContact O-N 2.96Å; W1151-E1154 PolarHBondContact O-N 2.9Å; E1154-H1157 PolarHBondContact O-N 3.33Å; E1154-H1158 PolarHBondContact O-N 3.35Å; E1154-H1158 VanDerWaalsContact O-N 3.15Å; E1154-T1210 HydrophobicContact CG-CG2 4.15Å; E1154-L1211 HydrophobicContact CB-CD2 4.1Å; E1154-L1214 HydrophobicContact CG-CD1 3.64Å
1155	I	81	Confident	74.4	Confident	3 Å²	3	55 Å²	55	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-43.9	176.5	-64.2	165	0	0	0	110.4	W1151 L1152 N1153 H1157 H1158 F1161 L1189 A1192 F1193 I1196	W1151-I1155 VanDerWaalsContact O-CG1 3.24Å; W1151-I1155 WeakPolarHBondContact O-CG1 3.36Å; W1151-I1155 PolarHBondContact O-N 3.2Å; L1152-I1155 PolarHBondContact O-N 3.13Å; N1153-I1155 VanDerWaalsContact C-N 3.31Å; N1153-I1155 PolarHBondContact O-N 3.27Å; I1155-H1157 PolarHBondContact O-N 2.85Å; I1155-H1158 VanDerWaalsContact O-CB 3.25Å; I1155-H1158 WeakPolarHBondContact O-CB 3.43Å; I1155-H1158 PolarHBondContact O-N 3.46Å; I1155-F1161 VanDerWaalsContact O-CB 3.23Å; I1155-F1161 WeakPolarHBondContact O-CB 3.25Å; I1155-L1189 HydrophobicContact CB-CD1 4.25Å; I1155-L1189 HydrophobicContact CG2-CD1 3.86Å; I1155-A1192 HydrophobicContact CG2-CB 3.89Å; I1155-F1193 HydrophobicContact CD1-CB 4.3Å; I1155-F1193 HydrophobicContact CD1-CD2 3.98Å; I1155-I1196 HydrophobicContact CB-CD1 4.47Å; I1155-I1196 HydrophobicContact CD1-CD1 3.56Å; I1155-I1196 HydrophobicContact CG1-CD1 3.51Å; I1155-I1196 HydrophobicContact CG2-CD1 4.14Å
1156	K	80.1	Confident	73	Confident	74 Å²	74	61.9 Å²	61.9	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-35	177.4	-171.6	165.7	-172.7	159.8	0	111.8	L1152 N1153 H1158 F1161 E1185 L1189	L1152-K1156 WeakPolarHBondContact O-CB 3.39Å; L1152-K1156 PolarHBondContact O-N 3.4Å; N1153-K1156 PolarHBondContact O-N 3.2Å; K1156-H1158 VanDerWaalsContact C-N 3.35Å; K1156-F1161 HydrophobicContact CB-CD1 4.42Å; K1156-F1161 HydrophobicContact CB-CE1 4.48Å; K1156-F1161 HydrophobicContact CG-CD1 4.05Å; K1156-F1161 HydrophobicContact CG-CE1 3.79Å; K1156-F1161 WeakPolarHBondContact O-CD1 3.36Å; K1156-E1185 IonicContact NZ-OE2 3.97Å; K1156-E1185 PolarHBondContact NZ-OE2 3.33Å; K1156-L1189 HydrophobicContact CB-CD1 4.14Å
1157	H	75.6	Confident	71.4	Confident	136 Å²	136	64.9 Å²	64.9	63%	0.63	31%	0.309	S	S	*	.	H	α-helix	trans	-78.9	-14.2	175.3	-68.5	-53.1	0	0	0	114.2	N1153 E1154 I1155	N1153-H1157 PolarHBondContact O-CD2 3.42Å; N1153-H1157 PolarHBondContact O-N 3.34Å; E1154-H1157 PolarHBondContact O-N 3.33Å; I1155-H1157 PolarHBondContact O-N 2.85Å
1158	H	74.4	Confident	69.7	Low	27 Å²	27	75.5 Å²	75.5	13%	0.125	35%	0.348	C	S	.	.	S	Bend	trans	-71.1	145.6	-178.1	-165.9	-100.9	0	0	0	112.7	E1154 I1155 K1156 Y1160 F1161 K1162 D1204 L1207	E1154-H1158 PolarHBondContact O-N 3.35Å; E1154-H1158 VanDerWaalsContact O-N 3.15Å; I1155-H1158 VanDerWaalsContact O-CB 3.25Å; I1155-H1158 WeakPolarHBondContact O-CB 3.43Å; I1155-H1158 PolarHBondContact O-N 3.46Å; K1156-H1158 VanDerWaalsContact C-N 3.35Å; H1158-Y1160 VanDerWaalsContact C-N 3.27Å; H1158-Y1160 VanDerWaalsContact ND1-CB 3.35Å; H1158-Y1160 WeakPolarHBondContact ND1-CB 3.1Å; H1158-Y1160 PolarHBondContact ND1-N 3.23Å; H1158-Y1160 PolarHBondContact O-N 3.42Å; H1158-F1161 PolarHBondContact O-N 3.3Å; H1158-K1162 PolarHBondContact O-N 3.49Å; H1158-D1204 IonicContact CE1-OD2 2.98Å; H1158-D1204 IonicContact NE2-OD2 3.44Å; H1158-L1207 HydrophobicContact CB-CD1 4.27Å; H1158-L1207 HydrophobicContact CB-CD2 4.32Å
1159	K	66.9	Low	67.5	Low	149 Å²	149	84.9 Å²	84.9	65%	0.648	39%	0.392	S	S	*	.	H	α-helix	trans	-56.1	-40.5	-179.1	-66.5	179.2	-177.7	174.1	0	112.5	F1161 K1162 H1163	K1159-F1161 VanDerWaalsContact C-N 3.34Å; K1159-F1161 PolarHBondContact O-N 2.85Å; K1159-K1162 WeakPolarHBondContact O-CB 3.46Å; K1159-K1162 PolarHBondContact O-N 3.48Å; K1159-K1162 VanDerWaalsContact O-N 3.14Å; K1159-H1163 PolarHBondContact O-CD2 2.97Å; K1159-H1163 PolarHBondContact O-N 3.2Å
1160	Y	60	Low	65	Low	72 Å²	72	89.3 Å²	89.3	28%	0.282	42%	0.42	S	S	.	.	H	α-helix	trans	-58.6	-41.8	179.7	-176.4	-98.7	0	0	0	112.9	H1158 K1162 H1163 L1164 F1203	H1158-Y1160 VanDerWaalsContact C-N 3.27Å; H1158-Y1160 VanDerWaalsContact ND1-CB 3.35Å; H1158-Y1160 WeakPolarHBondContact ND1-CB 3.1Å; H1158-Y1160 PolarHBondContact ND1-N 3.23Å; H1158-Y1160 PolarHBondContact O-N 3.42Å; Y1160-K1162 VanDerWaalsContact C-N 3.33Å; Y1160-K1162 PolarHBondContact O-N 3.46Å; Y1160-H1163 WeakPolarHBondContact O-CB 3.36Å; Y1160-H1163 PolarHBondContact O-N 2.9Å; Y1160-H1163 VanDerWaalsContact O-N 3.1Å; Y1160-L1164 HydrophobicContact CD1-CD1 3.74Å; Y1160-L1164 HydrophobicContact CD1-CG 4.31Å; Y1160-L1164 HydrophobicContact CE1-CD1 3.36Å; Y1160-L1164 HydrophobicContact CE1-CG 3.99Å; Y1160-L1164 PolarHBondContact O-N 3.11Å; Y1160-F1203 HydrophobicContact CD1-CD1 4.42Å; Y1160-F1203 AromaticContact CD1-CE1 3.4Å; Y1160-F1203 HydrophobicContact CD1-CE1 3.4Å; Y1160-F1203 VanDerWaalsContact CD1-CE1 3.4Å; Y1160-F1203 AromaticContact CD1-CZ 3.88Å; Y1160-F1203 HydrophobicContact CD1-CZ 3.88Å; Y1160-F1203 AromaticContact CE1-CE1 3.76Å; Y1160-F1203 HydrophobicContact CE1-CE1 3.76Å; Y1160-F1203 AromaticContact CE1-CZ 3.71Å; Y1160-F1203 HydrophobicContact CE1-CZ 3.71Å; Y1160-F1203 HydrophobicContact CG-CD1 4.47Å; Y1160-F1203 AromaticContact CG-CE1 3.84Å; Y1160-F1203 HydrophobicContact CG-CE1 3.84Å
1161	F	63.3	Low	62.7	Low	7 Å²	7	93.9 Å²	93.9	3%	0.031	44%	0.441	C	S	.	.	H	α-helix	trans	-63.8	-40.9	176.6	-177	-99.2	0	0	0	111.2	I1155 K1156 H1158 K1159 H1163 L1164 N1165 L1189 A1192	I1155-F1161 VanDerWaalsContact O-CB 3.23Å; I1155-F1161 WeakPolarHBondContact O-CB 3.25Å; K1156-F1161 HydrophobicContact CB-CD1 4.42Å; K1156-F1161 HydrophobicContact CB-CE1 4.48Å; K1156-F1161 HydrophobicContact CG-CD1 4.05Å; K1156-F1161 HydrophobicContact CG-CE1 3.79Å; K1156-F1161 WeakPolarHBondContact O-CD1 3.36Å; H1158-F1161 PolarHBondContact O-N 3.3Å; K1159-F1161 VanDerWaalsContact C-N 3.34Å; K1159-F1161 PolarHBondContact O-N 2.85Å; F1161-H1163 PolarHBondContact O-N 3.08Å; F1161-L1164 PolarHBondContact O-N 3.18Å; F1161-N1165 VanDerWaalsContact CE1-ND2 3.34Å; F1161-N1165 WeakPolarHBondContact CE1-ND2 3.18Å; F1161-N1165 VanDerWaalsContact CZ-ND2 3.34Å; F1161-N1165 WeakPolarHBondContact CZ-ND2 3.48Å; F1161-N1165 PolarHBondContact O-N 2.84Å; F1161-L1189 HydrophobicContact CD2-CB 4.48Å; F1161-L1189 HydrophobicContact CD2-CD1 3.79Å; F1161-L1189 HydrophobicContact CE2-CB 3.64Å; F1161-L1189 HydrophobicContact CE2-CD1 3.61Å; F1161-L1189 HydrophobicContact CE2-CG 4.24Å; F1161-L1189 HydrophobicContact CG-CD1 4.43Å; F1161-L1189 HydrophobicContact CZ-CB 4.15Å; F1161-L1189 HydrophobicContact CZ-CD1 4.09Å; F1161-A1192 HydrophobicContact CD2-CB 4.34Å
1162	K	65.9	Low	60.1	Low	135 Å²	135	102.7 Å²	102.7	59%	0.587	48%	0.483	S	S	*	.	H	α-helix	trans	-61.5	-29.8	173.3	-60.2	-173.8	-179.8	-173.9	0	113.3	H1158 K1159 Y1160 K1166	H1158-K1162 PolarHBondContact O-N 3.49Å; K1159-K1162 WeakPolarHBondContact O-CB 3.46Å; K1159-K1162 PolarHBondContact O-N 3.48Å; K1159-K1162 VanDerWaalsContact O-N 3.14Å; Y1160-K1162 VanDerWaalsContact C-N 3.33Å; Y1160-K1162 PolarHBondContact O-N 3.46Å; K1162-K1166 WeakPolarHBondContact O-CG 3.18Å; K1162-K1166 PolarHBondContact O-N 2.74Å
1163	H	58.7	Low	57.7	Low	116 Å²	116	108.9 Å²	108.9	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-74.7	-38.4	175.1	-72.9	-70.4	0	0	0	112.5	K1159 Y1160 F1161 N1165 K1166	K1159-H1163 PolarHBondContact O-CD2 2.97Å; K1159-H1163 PolarHBondContact O-N 3.2Å; Y1160-H1163 WeakPolarHBondContact O-CB 3.36Å; Y1160-H1163 PolarHBondContact O-N 2.9Å; Y1160-H1163 VanDerWaalsContact O-N 3.1Å; F1161-H1163 PolarHBondContact O-N 3.08Å; H1163-N1165 VanDerWaalsContact C-N 3.35Å; H1163-K1166 PolarHBondContact O-N 2.84Å
1164	L	57	Low	55.2	Low	65 Å²	65	111.2 Å²	111.2	34%	0.34	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-40.6	174	-74.4	169.7	0	0	0	111.7	Y1160 F1161 K1166 A1192	Y1160-L1164 HydrophobicContact CD1-CD1 3.74Å; Y1160-L1164 HydrophobicContact CD1-CG 4.31Å; Y1160-L1164 HydrophobicContact CE1-CD1 3.36Å; Y1160-L1164 HydrophobicContact CE1-CG 3.99Å; Y1160-L1164 PolarHBondContact O-N 3.11Å; F1161-L1164 PolarHBondContact O-N 3.18Å; L1164-K1166 VanDerWaalsContact C-N 3.29Å; L1164-K1166 PolarHBondContact O-N 3.48Å; L1164-A1192 HydrophobicContact CD1-CB 4.13Å
1165	N	57.9	Low	52.6	Low	41 Å²	41	115.4 Å²	115.4	22%	0.219	56%	0.561	C	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	6.7	178.4	-85.8	14.9	0	0	0	114.4	F1161 H1163 P1167 E1185 S1188	F1161-N1165 VanDerWaalsContact CE1-ND2 3.34Å; F1161-N1165 WeakPolarHBondContact CE1-ND2 3.18Å; F1161-N1165 VanDerWaalsContact CZ-ND2 3.34Å; F1161-N1165 WeakPolarHBondContact CZ-ND2 3.48Å; F1161-N1165 PolarHBondContact O-N 2.84Å; H1163-N1165 VanDerWaalsContact C-N 3.35Å; N1165-P1167 WeakPolarHBondContact O-CD 3.48Å; N1165-P1167 VanDerWaalsContact O-N 3.08Å; N1165-E1185 VanDerWaalsContact ND2-CG 3.33Å; N1165-E1185 WeakPolarHBondContact ND2-CG 3.41Å; N1165-E1185 PolarHBondContact ND2-OE1 2.98Å; N1165-S1188 WeakPolarHBondContact OD1-CB 3.29Å; N1165-S1188 PolarHBondContact OD1-OG 2.63Å
1166	K	52.3	Low	50.1	Low	143 Å²	143	123.5 Å²	123.5	62%	0.622	60%	0.599	S	S	*	*			trans	-64	116	173.5	-82	-169.1	178.1	-170.9	0	108.1	K1162 H1163 L1164 R1168	K1162-K1166 WeakPolarHBondContact O-CG 3.18Å; K1162-K1166 PolarHBondContact O-N 2.74Å; H1163-K1166 PolarHBondContact O-N 2.84Å; L1164-K1166 VanDerWaalsContact C-N 3.29Å; L1164-K1166 PolarHBondContact O-N 3.48Å; K1166-R1168 PolarHBondContact O-N 3.14Å
1167	P	45.8	Very low	47.6	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	62%	0.622	S	S	*	*			trans	-58.4	133.6	176.3	24	-31.4	0	0	0	107.9	N1165 Q1169	N1165-P1167 WeakPolarHBondContact O-CD 3.48Å; N1165-P1167 VanDerWaalsContact O-N 3.08Å; P1167-Q1169 PolarHBondContact O-N 3.11Å; P1167-Q1169 VanDerWaalsContact O-N 3.09Å
1168	R	41.7	Very low	45.1	Very low	238 Å²	238	126.8 Å²	126.8	90%	0.898	63%	0.627	S	S	*	*			trans	-50.6	122.1	167.4	-70.2	178.3	-173.1	165.6	4.5	106.2	K1166 L1170	K1166-R1168 PolarHBondContact O-N 3.14Å; R1168-L1170 PolarHBondContact O-N 2.93Å
1169	Q	37.1	Very low	42.9	Very low	198 Å²	198	130.9 Å²	130.9	93%	0.925	65%	0.654	S	S	*	*			trans	-46.8	108.6	172.5	-79	171.5	-32.6	0	0	108.2	P1167	P1167-Q1169 PolarHBondContact O-N 3.11Å; P1167-Q1169 VanDerWaalsContact O-N 3.09Å
1170	L	32.3	Very low	41	Very low	155 Å²	155	132.9 Å²	132.9	81%	0.812	67%	0.666	S	S	*	*			trans	-116.7	128.8	165.4	-146.1	81	0	0	0	105.4	R1168	R1168-L1170 PolarHBondContact O-N 2.93Å
1171	D	32.6	Very low	39.7	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	68%	0.678	S	S	*	*			trans	-49	143.4	-167.3	-66.5	-49.6	0	0	0	114.3	T1173	D1171-T1173 PolarHBondContact O-N 2.79Å
1172	E	30.2	Very low	38.9	Very low	202 Å²	202	137.1 Å²	137.1	94%	0.944	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	30.1	-171.7	-70.4	-177.2	142.8	0	0	116.5
1173	T	33.8	Very low	37.9	Very low	129 Å²	129	138.2 Å²	138.2	79%	0.791	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	4.1	-174	53.2	0	0	0	0	116.7	D1171	D1171-T1173 PolarHBondContact O-N 2.79Å
1174	T	30.5	Very low	37.8	Very low	118 Å²	118	138.7 Å²	138.7	72%	0.724	71%	0.707	S	S	*	*			trans	-118.7	76.8	172.6	18.9	0	0	0	0	111.8
1175	L	26.7	Very low	38.2	Very low	162 Å²	162	138.1 Å²	138.1	85%	0.848	70%	0.702	S	S	*	*			trans	-64.6	140.1	157.8	-161.2	77.6	0	0	0	108.4
1176	Q	28.5	Very low	38.6	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	70%	0.704	S	S	*	*			trans	96.9	28.8	168.9	-59	-175.2	-30.1	0	0	121
1177	H	27.7	Very low	39.4	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.796	70%	0.703	S	S	*	*			trans	-120.7	108.7	154.5	-77.3	-69.8	0	0	0	110.8	V1179	H1177-V1179 PolarHBondContact O-N 2.89Å
1178	S	23.3	Very low	40.7	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	68%	0.676	S	S	*	*			trans	-49.3	105.1	170.1	46.6	0	0	0	0	109.6	E1180	S1178-E1180 PolarHBondContact O-N 3.38Å
1179	V	28	Very low	42.4	Very low	113 Å²	113	122.2 Å²	122.2	69%	0.685	63%	0.633	S	S	*	*			trans	-55.5	120.1	-178.3	176.8	0	0	0	0	109.7	H1177 L1181	H1177-V1179 PolarHBondContact O-N 2.89Å; V1179-L1181 VanDerWaalsContact C-N 3.29Å; V1179-L1181 HydrophobicContact CG1-CG 4.3Å; V1179-L1181 PolarHBondContact O-N 2.7Å
1180	E	28.3	Very low	44.2	Very low	191 Å²	191	115.3 Å²	115.3	89%	0.893	60%	0.601	S	S	*	*			trans	-58.2	89	168.1	-69.4	176.9	150	0	0	109.3	S1178 N1182	S1178-E1180 PolarHBondContact O-N 3.38Å; E1180-N1182 VanDerWaalsContact C-N 3.34Å; E1180-N1182 PolarHBondContact O-N 3.27Å
1181	L	32.7	Very low	46.3	Very low	105 Å²	105	114.1 Å²	114.1	55%	0.55	59%	0.589	S	S	.	*			trans	-79.2	3.7	-160.8	-109.3	160.9	0	0	0	116.7	V1179	V1179-L1181 VanDerWaalsContact C-N 3.29Å; V1179-L1181 HydrophobicContact CG1-CG 4.3Å; V1179-L1181 PolarHBondContact O-N 2.7Å
1182	N	46.9	Very low	48.5	Very low	64 Å²	64	107.5 Å²	107.5	34%	0.342	55%	0.554	S	S	.	*	S	Bend	trans	-125.2	-21.6	-158.3	-79.7	-49.5	0	0	0	117.8	E1180 N1186 E1346	E1180-N1182 VanDerWaalsContact C-N 3.34Å; E1180-N1182 PolarHBondContact O-N 3.27Å; N1182-N1186 PolarHBondContact O-ND2 2.98Å; N1182-E1346 PolarHBondContact ND2-OE1 3.38Å
1183	H	44.9	Very low	51	Low	158 Å²	158	98 Å²	98	73%	0.731	51%	0.51	S	S	*	.	H	α-helix	trans	-82.5	-42.8	-178.8	-129.7	-18.5	0	0	0	112.5	E1187	H1183-E1187 PolarHBondContact O-N 3.34Å
1184	D	55.8	Low	52.9	Low	126 Å²	126	94.2 Å²	94.2	67%	0.674	48%	0.484	S	S	*	.	H	α-helix	trans	-67.3	-37.9	-178.4	-95.2	-15.2	0	0	0	113.3	S1188	D1184-S1188 WeakPolarHBondContact O-CB 3.39Å; D1184-S1188 PolarHBondContact O-N 2.98Å; D1184-S1188 PolarHBondContact O-OG 3.44Å
1185	E	64.4	Low	55.1	Low	52 Å²	52	90 Å²	90	24%	0.243	46%	0.457	C	S	.	.	H	α-helix	trans	-67.7	-44.2	179.8	-65.9	-144.6	140.1	0	0	112.1	K1156 N1165 S1188 L1189	K1156-E1185 IonicContact NZ-OE2 3.97Å; K1156-E1185 PolarHBondContact NZ-OE2 3.33Å; N1165-E1185 VanDerWaalsContact ND2-CG 3.33Å; N1165-E1185 WeakPolarHBondContact ND2-CG 3.41Å; N1165-E1185 PolarHBondContact ND2-OE1 2.98Å; E1185-S1188 PolarHBondContact O-N 3Å; E1185-L1189 VanDerWaalsContact O-CB 3.3Å; E1185-L1189 WeakPolarHBondContact O-CB 3.41Å; E1185-L1189 PolarHBondContact O-N 3.17Å
1186	N	66.4	Low	57.4	Low	50 Å²	50	82.7 Å²	82.7	27%	0.267	42%	0.418	S	S	.	.	H	α-helix	trans	-70.1	-39.8	-177.1	-78.8	-21.3	0	0	0	111.5	N1182 L1189 E1190	N1182-N1186 PolarHBondContact O-ND2 2.98Å; N1186-L1189 PolarHBondContact O-N 2.66Å; N1186-E1190 PolarHBondContact O-N 2.85Å
1187	E	70.3	Confident	59.4	Low	127 Å²	127	76.4 Å²	76.4	59%	0.593	39%	0.39	S	S	*	.	H	α-helix	trans	-65.2	-41.3	173.6	-170.1	177.4	170.8	0	0	111.1	H1183 L1189 E1190 K1191	H1183-E1187 PolarHBondContact O-N 3.34Å; E1187-L1189 VanDerWaalsContact C-N 3.26Å; E1187-L1189 PolarHBondContact O-N 2.97Å; E1187-E1190 PolarHBondContact O-N 3.41Å; E1187-K1191 VanDerWaalsContact O-CB 3.31Å; E1187-K1191 WeakPolarHBondContact O-CB 3.47Å; E1187-K1191 PolarHBondContact O-N 2.96Å
1188	S	73.8	Confident	61.5	Low	26 Å²	26	73.3 Å²	73.3	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-62.3	-34.6	173.7	-64.9	0	0	0	0	112.2	N1165 D1184 E1185 A1192	N1165-S1188 WeakPolarHBondContact OD1-CB 3.29Å; N1165-S1188 PolarHBondContact OD1-OG 2.63Å; D1184-S1188 WeakPolarHBondContact O-CB 3.39Å; D1184-S1188 PolarHBondContact O-N 2.98Å; D1184-S1188 PolarHBondContact O-OG 3.44Å; E1185-S1188 PolarHBondContact O-N 3Å; S1188-A1192 WeakPolarHBondContact O-CB 3.4Å; S1188-A1192 PolarHBondContact O-N 3.44Å
1189	L	76.5	Confident	63.9	Low	2 Å²	2	71 Å²	71	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-75	-42.1	179.6	-169.9	70.3	0	0	0	111.2	L1152 I1155 K1156 F1161 E1185 N1186 E1187 K1191 A1192 F1193 L1232	L1152-L1189 HydrophobicContact CB-CD2 4.14Å; L1152-L1189 HydrophobicContact CD2-CD2 4.11Å; L1152-L1189 HydrophobicContact CD2-CG 4.04Å; I1155-L1189 HydrophobicContact CB-CD1 4.25Å; I1155-L1189 HydrophobicContact CG2-CD1 3.86Å; K1156-L1189 HydrophobicContact CB-CD1 4.14Å; F1161-L1189 HydrophobicContact CD2-CB 4.48Å; F1161-L1189 HydrophobicContact CD2-CD1 3.79Å; F1161-L1189 HydrophobicContact CE2-CB 3.64Å; F1161-L1189 HydrophobicContact CE2-CD1 3.61Å; F1161-L1189 HydrophobicContact CE2-CG 4.24Å; F1161-L1189 HydrophobicContact CG-CD1 4.43Å; F1161-L1189 HydrophobicContact CZ-CB 4.15Å; F1161-L1189 HydrophobicContact CZ-CD1 4.09Å; E1185-L1189 VanDerWaalsContact O-CB 3.3Å; E1185-L1189 WeakPolarHBondContact O-CB 3.41Å; E1185-L1189 PolarHBondContact O-N 3.17Å; N1186-L1189 PolarHBondContact O-N 2.66Å; E1187-L1189 VanDerWaalsContact C-N 3.26Å; E1187-L1189 PolarHBondContact O-N 2.97Å; L1189-K1191 VanDerWaalsContact C-N 3.32Å; L1189-A1192 PolarHBondContact O-N 3.45Å; L1189-F1193 WeakPolarHBondContact O-CB 3.32Å; L1189-F1193 PolarHBondContact O-N 3.5Å; L1189-L1232 HydrophobicContact CD2-CD1 3.54Å; L1189-L1232 HydrophobicContact CD2-CG 4.28Å
1190	E	75.4	Confident	65.9	Low	53 Å²	53	67.7 Å²	67.7	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-57.7	-47.5	170.8	-179.4	177.3	173.6	0	0	110.1	N1186 E1187 A1192 F1193 I1194 I1236 K1240	N1186-E1190 PolarHBondContact O-N 2.85Å; E1187-E1190 PolarHBondContact O-N 3.41Å; E1190-A1192 PolarHBondContact O-N 2.83Å; E1190-F1193 WeakPolarHBondContact O-CB 3.38Å; E1190-F1193 PolarHBondContact O-N 3.37Å; E1190-I1194 HydrophobicContact CG-CG1 4.39Å; E1190-I1194 VanDerWaalsContact O-CG1 3.32Å; E1190-I1194 WeakPolarHBondContact O-CG1 3.4Å; E1190-I1194 PolarHBondContact O-N 3.36Å; E1190-I1236 HydrophobicContact CB-CD1 4.04Å; E1190-I1236 HydrophobicContact CB-CG1 4.18Å; E1190-I1236 HydrophobicContact CG-CD1 4.39Å; E1190-I1236 HydrophobicContact CG-CG1 4.12Å; E1190-K1240 WeakPolarHBondContact OE1-CE 3.39Å; E1190-K1240 IonicContact OE1-NZ 2.92Å
1191	K	76.5	Confident	68	Low	129 Å²	129	63.9 Å²	63.9	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-60.9	-44.7	177.8	-170.1	175.4	-176.4	175.9	0	112	E1187 L1189 I1194 D1195	E1187-K1191 VanDerWaalsContact O-CB 3.31Å; E1187-K1191 WeakPolarHBondContact O-CB 3.47Å; E1187-K1191 PolarHBondContact O-N 2.96Å; L1189-K1191 VanDerWaalsContact C-N 3.32Å; K1191-I1194 PolarHBondContact O-N 3.1Å; K1191-D1195 VanDerWaalsContact O-CB 3.29Å; K1191-D1195 WeakPolarHBondContact O-CB 3.34Å; K1191-D1195 PolarHBondContact O-N 2.96Å
1192	A	78.7	Confident	69.8	Low	0 Å²	0	65 Å²	65	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-42.1	175.7	0	0	0	0	0	112	I1155 F1161 L1164 S1188 L1189 E1190 D1195 I1196	I1155-A1192 HydrophobicContact CG2-CB 3.89Å; F1161-A1192 HydrophobicContact CD2-CB 4.34Å; L1164-A1192 HydrophobicContact CD1-CB 4.13Å; S1188-A1192 WeakPolarHBondContact O-CB 3.4Å; S1188-A1192 PolarHBondContact O-N 3.44Å; L1189-A1192 PolarHBondContact O-N 3.45Å; E1190-A1192 PolarHBondContact O-N 2.83Å; A1192-D1195 PolarHBondContact O-N 3.19Å; A1192-I1196 VanDerWaalsContact O-CG1 3.28Å; A1192-I1196 WeakPolarHBondContact O-CG1 3.41Å; A1192-I1196 PolarHBondContact O-N 3.34Å
1193	F	81.1	Confident	71.1	Confident	3 Å²	3	62.4 Å²	62.4	1%	0.013	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-47.6	176.2	173.4	-101.3	0	0	0	111.9	L1148 W1151 L1152 I1155 L1189 E1190 I1196 L1197 I1236	L1148-F1193 HydrophobicContact CD1-CD2 4.17Å; L1148-F1193 HydrophobicContact CD1-CE1 4.42Å; L1148-F1193 HydrophobicContact CD1-CE2 3.5Å; L1148-F1193 HydrophobicContact CD1-CZ 3.65Å; W1151-F1193 HydrophobicContact CE3-CD2 4.32Å; W1151-F1193 AromaticContact CE3-CE2 3.85Å; W1151-F1193 HydrophobicContact CE3-CE2 3.85Å; W1151-F1193 HydrophobicContact CZ3-CE2 4.32Å; L1152-F1193 HydrophobicContact CD2-CB 4.06Å; L1152-F1193 HydrophobicContact CD2-CD2 4.1Å; L1152-F1193 HydrophobicContact CD2-CG 4.2Å; I1155-F1193 HydrophobicContact CD1-CB 4.3Å; I1155-F1193 HydrophobicContact CD1-CD2 3.98Å; L1189-F1193 WeakPolarHBondContact O-CB 3.32Å; L1189-F1193 PolarHBondContact O-N 3.5Å; E1190-F1193 WeakPolarHBondContact O-CB 3.38Å; E1190-F1193 PolarHBondContact O-N 3.37Å; F1193-I1196 PolarHBondContact O-N 2.9Å; F1193-L1197 HydrophobicContact CD1-CD1 4.11Å; F1193-L1197 HydrophobicContact CE1-CD1 3.55Å; F1193-L1197 HydrophobicContact CE2-CD1 4.38Å; F1193-L1197 HydrophobicContact CZ-CD1 3.7Å; F1193-L1197 HydrophobicContact CZ-CG 4.46Å; F1193-L1197 WeakPolarHBondContact O-CG 3.43Å; F1193-L1197 PolarHBondContact O-N 2.88Å; F1193-I1236 HydrophobicContact CD1-CG2 3.9Å; F1193-I1236 HydrophobicContact CE1-CG2 3.78Å
1194	I	75.3	Confident	72.6	Confident	49 Å²	49	59.1 Å²	59.1	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-40.1	176.6	-64.6	-61.6	0	0	0	111.1	E1190 K1191 I1196 L1197 I1198	E1190-I1194 HydrophobicContact CG-CG1 4.39Å; E1190-I1194 VanDerWaalsContact O-CG1 3.32Å; E1190-I1194 WeakPolarHBondContact O-CG1 3.4Å; E1190-I1194 PolarHBondContact O-N 3.36Å; K1191-I1194 PolarHBondContact O-N 3.1Å; I1194-I1196 VanDerWaalsContact C-N 3.33Å; I1194-I1196 PolarHBondContact O-N 3.41Å; I1194-L1197 HydrophobicContact CD1-CD1 4.49Å; I1194-L1197 PolarHBondContact O-N 3.17Å; I1194-L1197 VanDerWaalsContact O-N 3.15Å; I1194-I1198 HydrophobicContact CG2-CD1 3.53Å; I1194-I1198 HydrophobicContact CG2-CG1 4.21Å; I1194-I1198 WeakPolarHBondContact O-CG1 3.21Å; I1194-I1198 PolarHBondContact O-N 2.96Å
1195	D	76.1	Confident	73.5	Confident	30 Å²	30	59.8 Å²	59.8	16%	0.16	31%	0.311	C	S	.	.	H	α-helix	trans	-61.5	-39.2	176.3	-89	-14.8	0	0	0	112.3	K1191 A1192 L1197 I1198 N1199 F1203	K1191-D1195 VanDerWaalsContact O-CB 3.29Å; K1191-D1195 WeakPolarHBondContact O-CB 3.34Å; K1191-D1195 PolarHBondContact O-N 2.96Å; A1192-D1195 PolarHBondContact O-N 3.19Å; D1195-L1197 VanDerWaalsContact C-N 3.31Å; D1195-L1197 PolarHBondContact O-N 2.88Å; D1195-I1198 PolarHBondContact O-N 3.19Å; D1195-N1199 CarbonylContact O-C 3.52Å; D1195-N1199 WeakPolarHBondContact O-CA 3.2Å; D1195-N1199 PolarHBondContact O-N 2.91Å; D1195-F1203 HydrophobicContact CB-CE2 4.13Å; D1195-F1203 HydrophobicContact CB-CZ 4.05Å
1196	I	75.7	Confident	74.2	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-39.8	174.9	-71	165.6	0	0	0	110.9	I1155 A1192 F1193 I1194 P1200 F1203 L1207 L1208 L1211	I1155-I1196 HydrophobicContact CB-CD1 4.47Å; I1155-I1196 HydrophobicContact CD1-CD1 3.56Å; I1155-I1196 HydrophobicContact CG1-CD1 3.51Å; I1155-I1196 HydrophobicContact CG2-CD1 4.14Å; A1192-I1196 VanDerWaalsContact O-CG1 3.28Å; A1192-I1196 WeakPolarHBondContact O-CG1 3.41Å; A1192-I1196 PolarHBondContact O-N 3.34Å; F1193-I1196 PolarHBondContact O-N 2.9Å; I1194-I1196 VanDerWaalsContact C-N 3.33Å; I1194-I1196 PolarHBondContact O-N 3.41Å; I1196-P1200 WeakPolarHBondContact O-CA 3.37Å; I1196-P1200 WeakPolarHBondContact O-CD 3.39Å; I1196-F1203 HydrophobicContact CB-CD2 4.4Å; I1196-F1203 HydrophobicContact CB-CE2 4.19Å; I1196-F1203 HydrophobicContact CB-CZ 4.48Å; I1196-F1203 HydrophobicContact CD1-CD1 4.21Å; I1196-F1203 HydrophobicContact CD1-CE1 3.99Å; I1196-F1203 HydrophobicContact CD1-CZ 4.25Å; I1196-F1203 HydrophobicContact CG1-CD1 3.78Å; I1196-F1203 HydrophobicContact CG1-CD2 3.66Å; I1196-F1203 HydrophobicContact CG1-CE1 3.54Å; I1196-F1203 HydrophobicContact CG1-CE2 3.43Å; I1196-F1203 VanDerWaalsContact CG1-CE2 3.43Å; I1196-F1203 HydrophobicContact CG1-CG 3.84Å; I1196-F1203 HydrophobicContact CG1-CZ 3.38Å; I1196-L1207 HydrophobicContact CD1-CD2 4.09Å; I1196-L1208 HydrophobicContact CG2-CD2 4.31Å; I1196-L1211 HydrophobicContact CD1-CD1 4.36Å; I1196-L1211 HydrophobicContact CG2-CD1 4Å
1197	L	69.7	Low	74.7	Confident	41 Å²	41	62.8 Å²	62.8	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-40.4	-180	-68.9	174.7	0	0	0	112.6	F1140 W1151 F1193 I1194 D1195	F1140-L1197 HydrophobicContact CD1-CD1 4.07Å; F1140-L1197 HydrophobicContact CE1-CD1 3.56Å; W1151-L1197 HydrophobicContact CZ3-CD2 4.35Å; F1193-L1197 HydrophobicContact CD1-CD1 4.11Å; F1193-L1197 HydrophobicContact CE1-CD1 3.55Å; F1193-L1197 HydrophobicContact CE2-CD1 4.38Å; F1193-L1197 HydrophobicContact CZ-CD1 3.7Å; F1193-L1197 HydrophobicContact CZ-CG 4.46Å; F1193-L1197 WeakPolarHBondContact O-CG 3.43Å; F1193-L1197 PolarHBondContact O-N 2.88Å; I1194-L1197 HydrophobicContact CD1-CD1 4.49Å; I1194-L1197 PolarHBondContact O-N 3.17Å; I1194-L1197 VanDerWaalsContact O-N 3.15Å; D1195-L1197 VanDerWaalsContact C-N 3.31Å; D1195-L1197 PolarHBondContact O-N 2.88Å
1198	I	71.6	Confident	75	Confident	106 Å²	106	58.9 Å²	58.9	54%	0.544	31%	0.306	S	S	.	.	H	α-helix	trans	-79.9	-43.4	-177.8	-62.1	174.1	0	0	0	111	I1194 D1195	I1194-I1198 HydrophobicContact CG2-CD1 3.53Å; I1194-I1198 HydrophobicContact CG2-CG1 4.21Å; I1194-I1198 WeakPolarHBondContact O-CG1 3.21Å; I1194-I1198 PolarHBondContact O-N 2.96Å; D1195-I1198 PolarHBondContact O-N 3.19Å
1199	N	74.3	Confident	75	Confident	60 Å²	60	61 Å²	61	32%	0.321	32%	0.321	S	S	.	.			trans	-131.7	65.5	-171.7	-64.9	-56	0	0	0	111.6	D1195 S1201 K1202	D1195-N1199 CarbonylContact O-C 3.52Å; D1195-N1199 WeakPolarHBondContact O-CA 3.2Å; D1195-N1199 PolarHBondContact O-N 2.91Å; N1199-S1201 PolarHBondContact O-N 2.87Å; N1199-K1202 HydrophobicContact CB-CD 4.04Å; N1199-K1202 HydrophobicContact CB-CG 4.16Å; N1199-K1202 PolarHBondContact O-N 3.25Å; N1199-K1202 VanDerWaalsContact O-N 3.11Å
1200	P	70.3	Confident	75	Confident	42 Å²	42	62.9 Å²	62.9	27%	0.273	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-57.9	-28.6	-178.9	22.7	-33.2	0	0	0	112.4	I1196 K1202 F1203 L1208	I1196-P1200 WeakPolarHBondContact O-CA 3.37Å; I1196-P1200 WeakPolarHBondContact O-CD 3.39Å; P1200-K1202 PolarHBondContact O-N 2.91Å; P1200-K1202 VanDerWaalsContact O-N 3.12Å; P1200-F1203 PolarHBondContact O-N 3.37Å; P1200-F1203 VanDerWaalsContact O-N 3.08Å; P1200-L1208 HydrophobicContact CB-CD1 4.24Å; P1200-L1208 HydrophobicContact CB-CD2 3.89Å; P1200-L1208 WeakPolarHBondContact O-CD1 3.29Å
1201	S	71.4	Confident	75.1	Confident	111 Å²	111	60.5 Å²	60.5	78%	0.776	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-62.5	-16	179.1	57.2	0	0	0	0	115.5	N1199 F1203	N1199-S1201 PolarHBondContact O-N 2.87Å; S1201-F1203 VanDerWaalsContact C-N 3.28Å
1202	K	71.2	Confident	75	Confident	128 Å²	128	57.1 Å²	57.1	56%	0.557	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-77	-14.5	175.1	-70.3	-176.8	179.4	-179.4	0	113.3	N1199 P1200	N1199-K1202 HydrophobicContact CB-CD 4.04Å; N1199-K1202 HydrophobicContact CB-CG 4.16Å; N1199-K1202 PolarHBondContact O-N 3.25Å; N1199-K1202 VanDerWaalsContact O-N 3.11Å; P1200-K1202 PolarHBondContact O-N 2.91Å; P1200-K1202 VanDerWaalsContact O-N 3.12Å
1203	F	73.5	Confident	74.8	Confident	11 Å²	11	60.1 Å²	60.1	5%	0.048	33%	0.333	C	S	.	.	S	Bend	trans	-107	153.6	-171.6	-66.1	-92.9	0	0	0	111.7	Y1160 D1195 I1196 P1200 S1201 N1205 L1207 L1208	Y1160-F1203 HydrophobicContact CD1-CD1 4.42Å; Y1160-F1203 AromaticContact CD1-CE1 3.4Å; Y1160-F1203 HydrophobicContact CD1-CE1 3.4Å; Y1160-F1203 VanDerWaalsContact CD1-CE1 3.4Å; Y1160-F1203 AromaticContact CD1-CZ 3.88Å; Y1160-F1203 HydrophobicContact CD1-CZ 3.88Å; Y1160-F1203 AromaticContact CE1-CE1 3.76Å; Y1160-F1203 HydrophobicContact CE1-CE1 3.76Å; Y1160-F1203 AromaticContact CE1-CZ 3.71Å; Y1160-F1203 HydrophobicContact CE1-CZ 3.71Å; Y1160-F1203 HydrophobicContact CG-CD1 4.47Å; Y1160-F1203 AromaticContact CG-CE1 3.84Å; Y1160-F1203 HydrophobicContact CG-CE1 3.84Å; D1195-F1203 HydrophobicContact CB-CE2 4.13Å; D1195-F1203 HydrophobicContact CB-CZ 4.05Å; I1196-F1203 HydrophobicContact CB-CD2 4.4Å; I1196-F1203 HydrophobicContact CB-CE2 4.19Å; I1196-F1203 HydrophobicContact CB-CZ 4.48Å; I1196-F1203 HydrophobicContact CD1-CD1 4.21Å; I1196-F1203 HydrophobicContact CD1-CE1 3.99Å; I1196-F1203 HydrophobicContact CD1-CZ 4.25Å; I1196-F1203 HydrophobicContact CG1-CD1 3.78Å; I1196-F1203 HydrophobicContact CG1-CD2 3.66Å; I1196-F1203 HydrophobicContact CG1-CE1 3.54Å; I1196-F1203 HydrophobicContact CG1-CE2 3.43Å; I1196-F1203 VanDerWaalsContact CG1-CE2 3.43Å; I1196-F1203 HydrophobicContact CG1-CG 3.84Å; I1196-F1203 HydrophobicContact CG1-CZ 3.38Å; P1200-F1203 PolarHBondContact O-N 3.37Å; P1200-F1203 VanDerWaalsContact O-N 3.08Å; S1201-F1203 VanDerWaalsContact C-N 3.28Å; F1203-N1205 PolarHBondContact O-N 3.35Å; F1203-L1207 HydrophobicContact CB-CD2 4.22Å; F1203-L1207 HydrophobicContact CD1-CD2 3.85Å; F1203-L1207 HydrophobicContact CG-CD2 4.36Å; F1203-L1208 HydrophobicContact CB-CD2 4.5Å
1204	D	75.9	Confident	74.4	Confident	89 Å²	89	61.4 Å²	61.4	48%	0.476	34%	0.339	S	S	.	.			trans	-59	134.7	-179.9	-68.1	-20.6	0	0	0	110.9	H1158 Q1206 L1207 L1208	H1158-D1204 IonicContact CE1-OD2 2.98Å; H1158-D1204 IonicContact NE2-OD2 3.44Å; D1204-Q1206 PolarHBondContact O-N 3.37Å; D1204-L1207 WeakPolarHBondContact O-CB 3.28Å; D1204-L1207 PolarHBondContact O-N 3.23Å; D1204-L1208 PolarHBondContact O-N 2.85Å
1205	N	75.2	Confident	74.2	Confident	140 Å²	140	59.8 Å²	59.8	75%	0.749	33%	0.332	S	S	*	.	H	α-helix	trans	-55.1	-28.2	176.7	-73.3	-29.3	0	0	0	112.5	F1203 S1209	F1203-N1205 PolarHBondContact O-N 3.35Å; N1205-S1209 VanDerWaalsContact O-CB 3.25Å; N1205-S1209 WeakPolarHBondContact O-CB 3.33Å; N1205-S1209 PolarHBondContact O-N 2.87Å
1206	Q	78.3	Confident	73.8	Confident	156 Å²	156	63.6 Å²	63.6	73%	0.729	35%	0.352	S	S	*	.	H	α-helix	trans	-64.1	-47	174.3	-173.5	178.7	0.3	0	0	111.7	D1204 S1209 T1210	D1204-Q1206 PolarHBondContact O-N 3.37Å; Q1206-S1209 PolarHBondContact O-N 3.46Å; Q1206-T1210 PolarHBondContact O-N 3.02Å; Q1206-T1210 PolarHBondContact O-OG1 2.72Å; Q1206-T1210 VanDerWaalsContact O-OG1 3.05Å
1207	L	77.6	Confident	73.4	Confident	8 Å²	8	70 Å²	70	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-49.8	177	178.5	68.9	0	0	0	110.5	H1158 I1196 F1203 D1204 S1209 T1210 L1211	H1158-L1207 HydrophobicContact CB-CD1 4.27Å; H1158-L1207 HydrophobicContact CB-CD2 4.32Å; I1196-L1207 HydrophobicContact CD1-CD2 4.09Å; F1203-L1207 HydrophobicContact CB-CD2 4.22Å; F1203-L1207 HydrophobicContact CD1-CD2 3.85Å; F1203-L1207 HydrophobicContact CG-CD2 4.36Å; D1204-L1207 WeakPolarHBondContact O-CB 3.28Å; D1204-L1207 PolarHBondContact O-N 3.23Å; L1207-S1209 VanDerWaalsContact C-N 3.25Å; L1207-S1209 PolarHBondContact O-N 3.49Å; L1207-T1210 WeakPolarHBondContact O-CB 3.39Å; L1207-T1210 PolarHBondContact O-N 2.94Å; L1207-T1210 VanDerWaalsContact O-N 3.08Å; L1207-L1211 HydrophobicContact CD1-CD1 4.4Å; L1207-L1211 HydrophobicContact CD1-CG 4.3Å; L1207-L1211 HydrophobicContact CD2-CD1 4.49Å; L1207-L1211 HydrophobicContact CG-CD1 4.06Å; L1207-L1211 HydrophobicContact CG-CG 4.32Å; L1207-L1211 WeakPolarHBondContact O-CG 3.28Å; L1207-L1211 PolarHBondContact O-N 3.45Å
1208	L	76.6	Confident	73.1	Confident	46 Å²	46	68.3 Å²	68.3	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-37.8	179.6	-64.1	174.7	0	0	0	112	I1196 P1200 F1203 D1204 L1211 S1212	I1196-L1208 HydrophobicContact CG2-CD2 4.31Å; P1200-L1208 HydrophobicContact CB-CD1 4.24Å; P1200-L1208 HydrophobicContact CB-CD2 3.89Å; P1200-L1208 WeakPolarHBondContact O-CD1 3.29Å; F1203-L1208 HydrophobicContact CB-CD2 4.5Å; D1204-L1208 PolarHBondContact O-N 2.85Å; L1208-L1211 PolarHBondContact O-N 3.03Å; L1208-S1212 VanDerWaalsContact O-CB 3.23Å; L1208-S1212 WeakPolarHBondContact O-CB 3.36Å; L1208-S1212 PolarHBondContact O-N 3.42Å
1209	S	73.4	Confident	73	Confident	70 Å²	70	63.3 Å²	63.3	49%	0.49	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-41.9	174.4	-171.3	0	0	0	0	112.1	N1205 Q1206 L1207 S1212 T1213	N1205-S1209 VanDerWaalsContact O-CB 3.25Å; N1205-S1209 WeakPolarHBondContact O-CB 3.33Å; N1205-S1209 PolarHBondContact O-N 2.87Å; Q1206-S1209 PolarHBondContact O-N 3.46Å; L1207-S1209 VanDerWaalsContact C-N 3.25Å; L1207-S1209 PolarHBondContact O-N 3.49Å; S1209-S1212 PolarHBondContact O-N 2.99Å; S1209-T1213 WeakPolarHBondContact O-CB 3.3Å; S1209-T1213 WeakPolarHBondContact O-CG2 3.45Å; S1209-T1213 PolarHBondContact O-N 3.03Å; S1209-T1213 PolarHBondContact O-OG1 3.01Å
1210	T	77.8	Confident	72.6	Confident	42 Å²	42	71.3 Å²	71.3	26%	0.258	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-46.2	174	-55.5	0	0	0	0	111.6	E1154 Q1206 L1207 S1212 T1213 L1214	E1154-T1210 HydrophobicContact CG-CG2 4.15Å; Q1206-T1210 PolarHBondContact O-N 3.02Å; Q1206-T1210 PolarHBondContact O-OG1 2.72Å; Q1206-T1210 VanDerWaalsContact O-OG1 3.05Å; L1207-T1210 WeakPolarHBondContact O-CB 3.39Å; L1207-T1210 PolarHBondContact O-N 2.94Å; L1207-T1210 VanDerWaalsContact O-N 3.08Å; T1210-S1212 VanDerWaalsContact C-N 3.35Å; T1210-S1212 PolarHBondContact O-N 2.96Å; T1210-T1213 VanDerWaalsContact CA-OG1 3.31Å; T1210-T1213 WeakPolarHBondContact CA-OG1 3.44Å; T1210-T1213 PolarHBondContact O-N 3.27Å; T1210-T1213 PolarHBondContact O-OG1 3.02Å; T1210-L1214 HydrophobicContact CG2-CD1 4.45Å; T1210-L1214 WeakPolarHBondContact O-CG 3.44Å; T1210-L1214 PolarHBondContact O-N 2.77Å
1211	L	76.6	Confident	72.9	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-39.7	177.4	-65.1	179.3	0	0	0	112.1	W1151 E1154 I1196 L1207 L1208 L1214 S1215	W1151-L1211 HydrophobicContact CB-CD2 4.18Å; W1151-L1211 HydrophobicContact CD2-CB 4.3Å; W1151-L1211 HydrophobicContact CD2-CD2 3.74Å; W1151-L1211 HydrophobicContact CD2-CG 4.41Å; W1151-L1211 HydrophobicContact CE3-CD1 4.23Å; W1151-L1211 HydrophobicContact CE3-CD2 4.15Å; W1151-L1211 HydrophobicContact CG-CD2 3.75Å; W1151-L1211 HydrophobicContact CH2-CB 4.17Å; W1151-L1211 HydrophobicContact CZ2-CB 3.78Å; W1151-L1211 HydrophobicContact CZ3-CD1 4.23Å; W1151-L1211 PolarHBondContact NE1-O 2.98Å; E1154-L1211 HydrophobicContact CB-CD2 4.1Å; I1196-L1211 HydrophobicContact CD1-CD1 4.36Å; I1196-L1211 HydrophobicContact CG2-CD1 4Å; L1207-L1211 HydrophobicContact CD1-CD1 4.4Å; L1207-L1211 HydrophobicContact CD1-CG 4.3Å; L1207-L1211 HydrophobicContact CD2-CD1 4.49Å; L1207-L1211 HydrophobicContact CG-CD1 4.06Å; L1207-L1211 HydrophobicContact CG-CG 4.32Å; L1207-L1211 WeakPolarHBondContact O-CG 3.28Å; L1207-L1211 PolarHBondContact O-N 3.45Å; L1208-L1211 PolarHBondContact O-N 3.03Å; L1211-L1214 PolarHBondContact O-N 3.18Å; L1211-S1215 PolarHBondContact O-N 2.79Å; L1211-S1215 PolarHBondContact O-OG 2.89Å
1212	S	74.7	Confident	73	Confident	57 Å²	57	66.9 Å²	66.9	40%	0.399	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-45.6	174.2	-177	0	0	0	0	111.5	L1208 S1209 T1210 L1214 S1215 N1216	L1208-S1212 VanDerWaalsContact O-CB 3.23Å; L1208-S1212 WeakPolarHBondContact O-CB 3.36Å; L1208-S1212 PolarHBondContact O-N 3.42Å; S1209-S1212 PolarHBondContact O-N 2.99Å; T1210-S1212 VanDerWaalsContact C-N 3.35Å; T1210-S1212 PolarHBondContact O-N 2.96Å; S1212-L1214 PolarHBondContact O-N 3.29Å; S1212-S1215 PolarHBondContact O-N 3.13Å; S1212-N1216 WeakPolarHBondContact O-CB 3.36Å; S1212-N1216 PolarHBondContact O-N 3.1Å; S1212-N1216 PolarHBondContact O-ND2 3.25Å; S1212-N1216 PolarHBondContact OG-ND2 2.88Å
1213	T	74	Confident	72.9	Confident	64 Å²	64	67.9 Å²	67.9	39%	0.393	34%	0.343	S	S	.	.	H	α-helix	trans	-65.5	-36.7	177.5	45.8	0	0	0	0	112.5	S1209 T1210 N1216 K1217	S1209-T1213 WeakPolarHBondContact O-CB 3.3Å; S1209-T1213 WeakPolarHBondContact O-CG2 3.45Å; S1209-T1213 PolarHBondContact O-N 3.03Å; S1209-T1213 PolarHBondContact O-OG1 3.01Å; T1210-T1213 VanDerWaalsContact CA-OG1 3.31Å; T1210-T1213 WeakPolarHBondContact CA-OG1 3.44Å; T1210-T1213 PolarHBondContact O-N 3.27Å; T1210-T1213 PolarHBondContact O-OG1 3.02Å; T1213-N1216 PolarHBondContact O-N 2.89Å; T1213-K1217 VanDerWaalsContact O-CG 3.25Å; T1213-K1217 WeakPolarHBondContact O-CG 3.42Å; T1213-K1217 PolarHBondContact O-N 2.79Å
1214	L	73	Confident	72.8	Confident	30 Å²	30	73.6 Å²	73.6	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-61.4	-43.6	171.2	-75.6	173.8	0	0	0	112	E1154 T1210 L1211 S1212	E1154-L1214 HydrophobicContact CG-CD1 3.64Å; T1210-L1214 HydrophobicContact CG2-CD1 4.45Å; T1210-L1214 WeakPolarHBondContact O-CG 3.44Å; T1210-L1214 PolarHBondContact O-N 2.77Å; L1211-L1214 PolarHBondContact O-N 3.18Å; S1212-L1214 PolarHBondContact O-N 3.29Å
1215	S	71.8	Confident	72.9	Confident	14 Å²	14	72.7 Å²	72.7	10%	0.098	37%	0.367	C	S	.	.	H	α-helix	trans	-67	-42.8	178.1	-54.1	0	0	0	0	111.7	W1151 L1211 S1212 K1217 G1218 A1311	W1151-S1215 WeakPolarHBondContact CZ2-OG 2.95Å; W1151-S1215 PolarHBondContact NE1-OG 3.46Å; W1151-S1215 VanDerWaalsContact NE1-OG 3.12Å; L1211-S1215 PolarHBondContact O-N 2.79Å; L1211-S1215 PolarHBondContact O-OG 2.89Å; S1212-S1215 PolarHBondContact O-N 3.13Å; S1215-K1217 VanDerWaalsContact C-N 3.32Å; S1215-K1217 PolarHBondContact O-N 2.82Å; S1215-G1218 WeakPolarHBondContact O-CA 3.01Å; S1215-G1218 PolarHBondContact O-N 3.04Å; S1215-A1311 WeakPolarHBondContact O-CB 3.4Å
1216	N	67.3	Low	73.3	Confident	110 Å²	110	66.2 Å²	66.2	59%	0.588	33%	0.333	S	S	*	.	H	α-helix	trans	-67.9	-28.7	-179.4	-69.5	-24.4	0	0	0	113.2	S1212 T1213 G1218	S1212-N1216 WeakPolarHBondContact O-CB 3.36Å; S1212-N1216 PolarHBondContact O-N 3.1Å; S1212-N1216 PolarHBondContact O-ND2 3.25Å; S1212-N1216 PolarHBondContact OG-ND2 2.88Å; T1213-N1216 PolarHBondContact O-N 2.89Å; N1216-G1218 PolarHBondContact O-N 3.03Å
1217	K	66.4	Low	73.6	Confident	142 Å²	142	59 Å²	59	62%	0.617	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-23.2	170.3	-76.1	168.7	-175.4	176.5	0	112	T1213 S1215	T1213-K1217 VanDerWaalsContact O-CG 3.25Å; T1213-K1217 WeakPolarHBondContact O-CG 3.42Å; T1213-K1217 PolarHBondContact O-N 2.79Å; S1215-K1217 VanDerWaalsContact C-N 3.32Å; S1215-K1217 PolarHBondContact O-N 2.82Å
1218	G	63.4	Low	73.8	Confident	5 Å²	5	59.9 Å²	59.9	5%	0.052	31%	0.308	C	S	.	.			trans	67.8	171.4	-177.6	0	0	0	0	0	113.9	S1215 N1216 A1311	S1215-G1218 WeakPolarHBondContact O-CA 3.01Å; S1215-G1218 PolarHBondContact O-N 3.04Å; N1216-G1218 PolarHBondContact O-N 3.03Å; G1218-A1311 WeakPolarHBondContact CA-O 3.16Å
1219	C	70.1	Confident	74.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.007	30%	0.296	C	S	.	.			trans	-75.1	134.9	-177.4	88.4	0	0	0	0	110.6	C1144 L1147 C1221 G1314 A1317	C1144-C1219 HydrophobicContact CB-CB 3.64Å; L1147-C1219 HydrophobicContact CD1-CB 3.42Å; L1147-C1219 VanDerWaalsContact CD1-CB 3.42Å; L1147-C1219 HydrophobicContact CG-CB 3.84Å; C1219-C1221 VanDerWaalsContact C-N 3.35Å; C1219-C1221 VanDerWaalsContact CB-SG 3.55Å; C1219-G1314 VanDerWaalsContact O-CA 3.24Å; C1219-G1314 WeakPolarHBondContact O-CA 3.41Å; C1219-G1314 PolarHBondContact O-N 3.43Å; C1219-G1314 WeakPolarHBondContact SG-CA 3.4Å; C1219-G1314 PolarHBondContact SG-O 3.16Å; C1219-A1317 HydrophobicContact CB-CB 4.31Å; C1219-A1317 VanDerWaalsContact SG-CB 3.57Å
1220	R	66.8	Low	74.6	Confident	228 Å²	228	55 Å²	55	86%	0.86	28%	0.277	S	S	*	.			trans	-99.8	20.3	173.8	-63.8	-171.8	175.8	-164.8	-1.6	112.4
1221	C	75.1	Confident	74.7	Confident	7 Å²	7	54.5 Å²	54.5	5%	0.047	27%	0.273	C	S	.	.			trans	-65.9	133.1	-175.5	-43.2	0	0	0	0	108.4	C1144 I1146 C1219 P1227 A1315 C1316	C1144-C1221 WeakPolarHBondContact CB-SG 3.09Å; C1144-C1221 WeakPolarHBondContact SG-CB 3.36Å; C1144-C1221 CovalentContact SG-SG 2.13Å; C1144-C1221 PolarHBondContact SG-SG 3.36Å; I1146-C1221 HydrophobicContact CD1-CB 4.16Å; C1219-C1221 VanDerWaalsContact C-N 3.35Å; C1219-C1221 VanDerWaalsContact CB-SG 3.55Å; C1221-P1227 HydrophobicContact CB-CB 4.5Å; C1221-A1315 PolarHBondContact O-N 2.99Å; C1221-C1316 HydrophobicContact CB-CB 4.39Å; C1221-C1316 WeakPolarHBondContact CB-SG 3.5Å; C1221-C1316 PolarHBondContact SG-SG 3.24Å
1222	S	74.3	Confident	74.7	Confident	53 Å²	53	56 Å²	56	37%	0.371	28%	0.281	S	S	.	.			trans	-58.6	148.9	-173.4	176.2	0	0	0	0	112.2	H1224 T1225 Y1273 A1315	S1222-H1224 PolarHBondContact OG-N 3.07Å; S1222-H1224 VanDerWaalsContact OG-N 3.15Å; S1222-T1225 PolarHBondContact OG-N 3.09Å; S1222-Y1273 WeakPolarHBondContact O-CE1 3.3Å; S1222-Y1273 PolarHBondContact O-OH 2.93Å; S1222-A1315 VanDerWaalsContact O-CB 3.25Å; S1222-A1315 WeakPolarHBondContact O-CB 3.48Å
1223	R	69.9	Low	75	Confident	149 Å²	149	53.3 Å²	53.3	56%	0.562	26%	0.262	S	S	*	.	S	Bend	trans	-82.3	-21.3	172.8	-66.4	-172.7	179.6	-171.8	-0.7	113.6	Q1277 T1313 A1315	R1223-Q1277 VanDerWaalsContact CB-OE1 3.23Å; R1223-Q1277 PolarHBondContact O-NE2 3.41Å; R1223-Q1277 PolarHBondContact O-OE1 2.98Å; R1223-T1313 PolarHBondContact NH2-O 3.35Å; R1223-A1315 HydrophobicContact CB-CB 4.5Å; R1223-A1315 HydrophobicContact CG-CB 4.07Å
1224	H	71.5	Confident	75.5	Confident	131 Å²	131	50.4 Å²	50.4	61%	0.606	24%	0.244	S	C	*	.	S	Bend	trans	-103.3	-21.7	-176.6	-57.8	-59.9	0	0	0	112.6	S1222 T1274	S1222-H1224 PolarHBondContact OG-N 3.07Å; S1222-H1224 VanDerWaalsContact OG-N 3.15Å; H1224-T1274 PolarHBondContact O-OG1 3.37Å
1225	T	76.5	Confident	75.8	Confident	70 Å²	70	50.7 Å²	50.7	43%	0.429	25%	0.245	S	C	.	.	S	Bend	trans	-121.2	124.7	-176.1	-41.3	0	0	0	0	109.3	S1222 Y1273 I1330	S1222-T1225 PolarHBondContact OG-N 3.09Å; T1225-Y1273 VanDerWaalsContact O-CE1 3.25Å; T1225-Y1273 WeakPolarHBondContact O-CE1 3.42Å; T1225-I1330 HydrophobicContact CG2-CD1 3.91Å
1226	P	83.5	Confident	76.2	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.032	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-56.9	148.6	173.8	-11.5	15.5	0	0	0	111.7	L1269 Y1273 F1328 I1330	P1226-L1269 HydrophobicContact CB-CD2 4Å; P1226-L1269 HydrophobicContact CG-CD2 3.18Å; P1226-Y1273 HydrophobicContact CB-CD1 4.28Å; P1226-Y1273 HydrophobicContact CB-CD2 4.28Å; P1226-Y1273 HydrophobicContact CB-CE1 4.48Å; P1226-Y1273 HydrophobicContact CB-CG 4.15Å; P1226-Y1273 HydrophobicContact CG-CD1 3.97Å; P1226-Y1273 HydrophobicContact CG-CD2 4.5Å; P1226-Y1273 HydrophobicContact CG-CG 3.9Å; P1226-F1328 HydrophobicContact CB-CB 4.28Å; P1226-I1330 HydrophobicContact CB-CD1 4.23Å; P1226-I1330 HydrophobicContact CB-CG1 3.8Å; P1226-I1330 HydrophobicContact CG-CD1 4.09Å; P1226-I1330 HydrophobicContact CG-CG1 4.02Å
1227	P	84.4	Confident	76.9	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.032	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-68.4	137.9	-178.3	25	-30.1	0	0	0	111.2	P1145 I1146 C1221 C1316 F1329 I1330	P1145-P1227 HydrophobicContact CG-CB 3.89Å; P1145-P1227 HydrophobicContact CG-CG 4.03Å; I1146-P1227 HydrophobicContact CD1-CB 3.99Å; I1146-P1227 HydrophobicContact CG1-CB 4.15Å; C1221-P1227 HydrophobicContact CB-CB 4.5Å; P1227-C1316 HydrophobicContact CG-CB 4.02Å; P1227-F1329 HydrophobicContact CG-CD1 3.83Å; P1227-F1329 HydrophobicContact CG-CE1 3.92Å; P1227-I1330 PolarHBondContact O-N 3.3Å
1228	A	82.9	Confident	77.5	Confident	25 Å²	25	38.8 Å²	38.8	21%	0.207	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-72.1	131.9	172.2	0	0	0	0	0	110.2	I1330	A1228-I1330 CarbonylContact C-O 3.56Å; A1228-I1330 VanDerWaalsContact CA-O 3.22Å; A1228-I1330 WeakPolarHBondContact CA-O 3.18Å
1229	I	85.6	Confident	78.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.207	C	C	.	.			trans	-109.2	129.2	174.1	-162.3	169.6	0	0	0	109.2	P1145 E1233 F1234 F1237 I1250 F1329 I1330 Y1331	P1145-I1229 HydrophobicContact CB-CG1 4.27Å; I1229-E1233 WeakPolarHBondContact CA-OE1 3.29Å; I1229-E1233 HydrophobicContact CG1-CG 3.9Å; I1229-F1234 HydrophobicContact CD1-CD2 4.03Å; I1229-F1234 HydrophobicContact CG1-CD2 4.25Å; I1229-F1234 HydrophobicContact CG2-CD2 4.2Å; I1229-F1237 HydrophobicContact CD1-CB 4.36Å; I1229-F1237 HydrophobicContact CD1-CD1 4.37Å; I1229-I1250 HydrophobicContact CG2-CG2 4.32Å; I1229-F1329 HydrophobicContact CB-CB 4.47Å; I1229-F1329 HydrophobicContact CG2-CB 4.06Å; I1229-I1330 PolarHBondContact N-O 2.79Å; I1229-Y1331 HydrophobicContact CG2-CD2 4.17Å; I1229-Y1331 VanDerWaalsContact O-CD2 3.22Å; I1229-Y1331 WeakPolarHBondContact O-CD2 3.31Å
1230	T	81.5	Confident	78.5	Confident	13 Å²	13	47.5 Å²	47.5	8%	0.08	23%	0.228	C	C	.	.			trans	-109.8	169.6	178.7	45.5	0	0	0	0	112.1	R1149 L1232 E1233 F1234	R1149-T1230 WeakPolarHBondContact CD-OG1 3.44Å; R1149-T1230 PolarHBondContact NH1-OG1 3.49Å; T1230-L1232 PolarHBondContact O-N 3.05Å; T1230-E1233 VanDerWaalsContact N-CD 3.3Å; T1230-E1233 PolarHBondContact N-OE1 3.16Å; T1230-E1233 PolarHBondContact O-N 3.14Å; T1230-E1233 VanDerWaalsContact OG1-CD 3.24Å; T1230-E1233 PolarHBondContact OG1-OE1 2.9Å; T1230-E1233 PolarHBondContact OG1-OE2 3.43Å; T1230-F1234 WeakPolarHBondContact O-CB 3.46Å; T1230-F1234 PolarHBondContact O-N 3.41Å; T1230-F1234 VanDerWaalsContact O-N 3.12Å
1231	D	79	Confident	78.8	Confident	31 Å²	31	37.5 Å²	37.5	17%	0.166	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-30.5	-176.9	-70.6	-6.5	0	0	0	113.2	E1233 Y1331 N1336 L1349	D1231-E1233 PolarHBondContact O-N 3.43Å; D1231-Y1331 WeakPolarHBondContact OD1-CE2 3.45Å; D1231-Y1331 VanDerWaalsContact OD1-CZ 3.24Å; D1231-Y1331 PolarHBondContact OD1-OH 3.36Å; D1231-N1336 PolarHBondContact N-OD1 3.05Å; D1231-L1349 HydrophobicContact CB-CB 4.01Å; D1231-L1349 HydrophobicContact CB-CD2 4.46Å; D1231-L1349 VanDerWaalsContact OD1-CB 3.3Å; D1231-L1349 WeakPolarHBondContact OD1-CB 3.22Å; D1231-L1349 WeakPolarHBondContact OD2-CB 3.33Å; D1231-L1349 PolarHBondContact OD2-N 3.35Å
1232	L	76	Confident	78.8	Confident	36 Å²	36	38.3 Å²	38.3	19%	0.188	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-43.4	-177.6	-171.4	69.4	0	0	0	113	R1149 L1152 N1153 L1189 T1230	R1149-L1232 HydrophobicContact CG-CD2 4.15Å; L1152-L1232 HydrophobicContact CB-CD2 3.88Å; L1152-L1232 HydrophobicContact CB-CG 4.21Å; L1152-L1232 HydrophobicContact CD1-CG 4.12Å; N1153-L1232 VanDerWaalsContact OD1-CD2 3.26Å; N1153-L1232 WeakPolarHBondContact OD1-CD2 3.42Å; L1189-L1232 HydrophobicContact CD2-CD1 3.54Å; L1189-L1232 HydrophobicContact CD2-CG 4.28Å; T1230-L1232 PolarHBondContact O-N 3.05Å
1233	E	82.9	Confident	78.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-104.4	-9.5	-175.2	75.9	-84.3	-161.1	0	0	113.9	P1145 L1148 L1152 I1229 T1230 D1231 D1235 I1236 F1237	P1145-E1233 HydrophobicContact CB-CG 3.99Å; L1148-E1233 HydrophobicContact CB-CB 4.43Å; L1148-E1233 HydrophobicContact CD2-CB 3.71Å; L1148-E1233 HydrophobicContact CG-CB 4Å; L1152-E1233 HydrophobicContact CD1-CB 3.89Å; I1229-E1233 WeakPolarHBondContact CA-OE1 3.29Å; I1229-E1233 HydrophobicContact CG1-CG 3.9Å; T1230-E1233 VanDerWaalsContact N-CD 3.3Å; T1230-E1233 PolarHBondContact N-OE1 3.16Å; T1230-E1233 PolarHBondContact O-N 3.14Å; T1230-E1233 VanDerWaalsContact OG1-CD 3.24Å; T1230-E1233 PolarHBondContact OG1-OE1 2.9Å; T1230-E1233 PolarHBondContact OG1-OE2 3.43Å; D1231-E1233 PolarHBondContact O-N 3.43Å; E1233-D1235 PolarHBondContact O-N 2.87Å; E1233-I1236 PolarHBondContact O-N 2.98Å; E1233-F1237 WeakPolarHBondContact O-CB 3.33Å; E1233-F1237 PolarHBondContact O-N 3.26Å
1234	F	83.7	Confident	78.7	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.013	18%	0.184	C	C	.	.	H	α-helix	trans	-50.9	-55.1	-170.4	-173.7	-94.9	0	0	0	112.7	I1229 T1230 L1238 I1250 L1349 L1350 I1366	I1229-F1234 HydrophobicContact CD1-CD2 4.03Å; I1229-F1234 HydrophobicContact CG1-CD2 4.25Å; I1229-F1234 HydrophobicContact CG2-CD2 4.2Å; T1230-F1234 WeakPolarHBondContact O-CB 3.46Å; T1230-F1234 PolarHBondContact O-N 3.41Å; T1230-F1234 VanDerWaalsContact O-N 3.12Å; F1234-L1238 HydrophobicContact CD1-CD1 3.94Å; F1234-L1238 HydrophobicContact CD2-CD1 4.09Å; F1234-L1238 HydrophobicContact CE1-CD1 3.48Å; F1234-L1238 VanDerWaalsContact CE1-CD1 3.48Å; F1234-L1238 HydrophobicContact CE2-CD1 3.66Å; F1234-L1238 HydrophobicContact CG-CD1 4.22Å; F1234-L1238 HydrophobicContact CZ-CD1 3.32Å; F1234-L1238 WeakPolarHBondContact O-CB 3.45Å; F1234-L1238 VanDerWaalsContact O-CG 3.29Å; F1234-L1238 WeakPolarHBondContact O-CG 3.38Å; F1234-L1238 PolarHBondContact O-N 3.37Å; F1234-L1238 VanDerWaalsContact O-N 3.08Å; F1234-I1250 HydrophobicContact CE2-CD1 3.63Å; F1234-I1250 HydrophobicContact CZ-CD1 4.17Å; F1234-L1349 HydrophobicContact CB-CD2 4.31Å; F1234-L1349 HydrophobicContact CD1-CD2 4.16Å; F1234-L1350 HydrophobicContact CE1-CD2 4.08Å; F1234-L1350 HydrophobicContact CE2-CD1 4.42Å; F1234-L1350 HydrophobicContact CE2-CD2 3.98Å; F1234-L1350 HydrophobicContact CE2-CG 4.41Å; F1234-L1350 HydrophobicContact CZ-CD2 3.53Å; F1234-L1350 HydrophobicContact CZ-CG 4.39Å; F1234-I1366 HydrophobicContact CE1-CD1 4.46Å; F1234-I1366 HydrophobicContact CE2-CD1 4.47Å; F1234-I1366 HydrophobicContact CZ-CD1 3.67Å
1235	D	80	Confident	78.7	Confident	35 Å²	35	32.4 Å²	32.4	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-46.9	-176.9	-70.2	-40.9	0	0	0	113.2	E1233 F1237 L1238 N1239 R1353	E1233-D1235 PolarHBondContact O-N 2.87Å; D1235-F1237 PolarHBondContact O-N 3.39Å; D1235-L1238 PolarHBondContact O-N 3.16Å; D1235-N1239 WeakPolarHBondContact O-CB 3.12Å; D1235-N1239 PolarHBondContact O-N 2.87Å; D1235-N1239 PolarHBondContact O-ND2 3.4Å; D1235-R1353 IonicContact OD1-CZ 3.59Å; D1235-R1353 IonicContact OD1-NH1 3.58Å; D1235-R1353 PolarHBondContact OD1-NH1 3.34Å; D1235-R1353 IonicContact OD1-NH2 3.1Å; D1235-R1353 PolarHBondContact OD1-NH2 2.79Å; D1235-R1353 IonicContact OD2-CZ 2.87Å; D1235-R1353 IonicContact OD2-NH1 3.29Å; D1235-R1353 IonicContact OD2-NH2 2.63Å; D1235-R1353 PolarHBondContact OD2-NH2 3.01Å
1236	I	78.8	Confident	79.1	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.036	15%	0.151	C	C	.	.	H	α-helix	trans	-59.4	-42.8	-179	-61.2	176.1	0	0	0	108.9	L1148 L1152 E1190 F1193 E1233 K1240 L1241	L1148-I1236 HydrophobicContact CD1-CG2 4.45Å; L1148-I1236 HydrophobicContact CD2-CB 4.14Å; L1148-I1236 HydrophobicContact CD2-CG2 3.87Å; L1152-I1236 HydrophobicContact CD1-CD1 3.97Å; L1152-I1236 HydrophobicContact CD2-CD1 3.82Å; E1190-I1236 HydrophobicContact CB-CD1 4.04Å; E1190-I1236 HydrophobicContact CB-CG1 4.18Å; E1190-I1236 HydrophobicContact CG-CD1 4.39Å; E1190-I1236 HydrophobicContact CG-CG1 4.12Å; F1193-I1236 HydrophobicContact CD1-CG2 3.9Å; F1193-I1236 HydrophobicContact CE1-CG2 3.78Å; E1233-I1236 PolarHBondContact O-N 2.98Å; I1236-K1240 WeakPolarHBondContact O-CA 3.21Å; I1236-K1240 WeakPolarHBondContact O-CB 3.36Å; I1236-K1240 PolarHBondContact O-N 3.33Å; I1236-L1241 PolarHBondContact O-N 2.92Å
1237	F	81.5	Confident	79.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	I	π-helix	trans	-68.4	-51.3	-178.7	-166	-86.5	0	0	0	112.5	P1145 L1148 I1229 E1233 D1235 L1241 M1242 R1327 F1329	P1145-F1237 HydrophobicContact CB-CD2 3.98Å; P1145-F1237 HydrophobicContact CB-CE2 4.08Å; P1145-F1237 HydrophobicContact CB-CG 4.37Å; P1145-F1237 HydrophobicContact CG-CE2 4.42Å; L1148-F1237 HydrophobicContact CD2-CB 4.05Å; L1148-F1237 HydrophobicContact CD2-CD2 4.15Å; I1229-F1237 HydrophobicContact CD1-CB 4.36Å; I1229-F1237 HydrophobicContact CD1-CD1 4.37Å; E1233-F1237 WeakPolarHBondContact O-CB 3.33Å; E1233-F1237 PolarHBondContact O-N 3.26Å; D1235-F1237 PolarHBondContact O-N 3.39Å; F1237-L1241 HydrophobicContact CD2-CB 4.26Å; F1237-L1241 HydrophobicContact CD2-CD1 3.78Å; F1237-L1241 HydrophobicContact CE2-CD1 4.33Å; F1237-L1241 WeakPolarHBondContact O-CB 3.32Å; F1237-L1241 PolarHBondContact O-N 2.96Å; F1237-L1241 VanDerWaalsContact O-N 3.14Å; F1237-M1242 HydrophobicContact CD1-CG 3.81Å; F1237-M1242 HydrophobicContact CD1-SD 4.16Å; F1237-M1242 HydrophobicContact CE1-CG 3.54Å; F1237-M1242 HydrophobicContact CE1-SD 3.91Å; F1237-M1242 HydrophobicContact CZ-CG 4.5Å; F1237-M1242 PolarHBondContact O-N 3.23Å; F1237-R1327 VanDerWaalsContact CZ-NH1 3.29Å; F1237-F1329 HydrophobicContact CD1-CZ 4.17Å; F1237-F1329 AromaticContact CE1-CE1 3.96Å; F1237-F1329 HydrophobicContact CE1-CE1 3.96Å; F1237-F1329 AromaticContact CE1-CE2 3.97Å; F1237-F1329 HydrophobicContact CE1-CE2 3.97Å; F1237-F1329 AromaticContact CE1-CZ 3.3Å; F1237-F1329 HydrophobicContact CE1-CZ 3.3Å; F1237-F1329 HydrophobicContact CZ-CE1 4.19Å; F1237-F1329 AromaticContact CZ-CZ 3.84Å; F1237-F1329 HydrophobicContact CZ-CZ 3.84Å
1238	L	80.5	Confident	79.4	Confident	10 Å²	10	28.7 Å²	28.7	5%	0.052	15%	0.149	C	C	.	.	I	π-helix	trans	-70.3	-38.5	-176.1	-66.4	177.8	0	0	0	112.7	F1234 D1235 M1242 A1248 I1250 I1366	F1234-L1238 HydrophobicContact CD1-CD1 3.94Å; F1234-L1238 HydrophobicContact CD2-CD1 4.09Å; F1234-L1238 HydrophobicContact CE1-CD1 3.48Å; F1234-L1238 VanDerWaalsContact CE1-CD1 3.48Å; F1234-L1238 HydrophobicContact CE2-CD1 3.66Å; F1234-L1238 HydrophobicContact CG-CD1 4.22Å; F1234-L1238 HydrophobicContact CZ-CD1 3.32Å; F1234-L1238 WeakPolarHBondContact O-CB 3.45Å; F1234-L1238 VanDerWaalsContact O-CG 3.29Å; F1234-L1238 WeakPolarHBondContact O-CG 3.38Å; F1234-L1238 PolarHBondContact O-N 3.37Å; F1234-L1238 VanDerWaalsContact O-N 3.08Å; D1235-L1238 PolarHBondContact O-N 3.16Å; L1238-M1242 HydrophobicContact CD2-SD 3.51Å; L1238-M1242 VanDerWaalsContact CD2-SD 3.51Å; L1238-A1248 HydrophobicContact CD2-CB 3.63Å; L1238-I1250 HydrophobicContact CD1-CD1 4.31Å; L1238-I1366 HydrophobicContact CD1-CD1 3.67Å; L1238-I1366 HydrophobicContact CD1-CG2 4.32Å
1239	N	77.1	Confident	79.6	Confident	85 Å²	85	27.7 Å²	27.7	46%	0.455	14%	0.14	S	C	.	.	I	π-helix	trans	-90.2	-30	-173.4	-61.6	-28.3	0	0	0	113.2	D1235 G1369	D1235-N1239 WeakPolarHBondContact O-CB 3.12Å; D1235-N1239 PolarHBondContact O-N 2.87Å; D1235-N1239 PolarHBondContact O-ND2 3.4Å; N1239-G1369 WeakPolarHBondContact OD1-CA 3.39Å
1240	K	76.1	Confident	79.7	Confident	103 Å²	103	27.6 Å²	27.6	45%	0.448	14%	0.139	S	C	.	.	I	π-helix	trans	-113	-34.5	-174.2	-49.7	-63.3	-172	-178.5	0	114.3	E1190 I1236	E1190-K1240 WeakPolarHBondContact OE1-CE 3.39Å; E1190-K1240 IonicContact OE1-NZ 2.92Å; I1236-K1240 WeakPolarHBondContact O-CA 3.21Å; I1236-K1240 WeakPolarHBondContact O-CB 3.36Å; I1236-K1240 PolarHBondContact O-N 3.33Å
1241	L	73.5	Confident	79.8	Confident	18 Å²	18	27.2 Å²	27.2	9%	0.094	14%	0.137	C	C	.	.	I	π-helix	trans	-99.8	-27.8	-172.6	-59.4	-175.1	0	0	0	114.5	F1140 L1148 I1236 F1237	F1140-L1241 HydrophobicContact CB-CD2 3.92Å; F1140-L1241 HydrophobicContact CD1-CD2 3.1Å; F1140-L1241 HydrophobicContact CD2-CD2 3.81Å; F1140-L1241 HydrophobicContact CE1-CD2 3.35Å; F1140-L1241 HydrophobicContact CE2-CD2 4.04Å; F1140-L1241 HydrophobicContact CG-CD2 3.34Å; F1140-L1241 HydrophobicContact CZ-CD2 3.83Å; L1148-L1241 HydrophobicContact CD1-CD1 4.25Å; L1148-L1241 HydrophobicContact CD2-CD1 3.62Å; L1148-L1241 HydrophobicContact CG-CD1 4.36Å; I1236-L1241 PolarHBondContact O-N 2.92Å; F1237-L1241 HydrophobicContact CD2-CB 4.26Å; F1237-L1241 HydrophobicContact CD2-CD1 3.78Å; F1237-L1241 HydrophobicContact CE2-CD1 4.33Å; F1237-L1241 WeakPolarHBondContact O-CB 3.32Å; F1237-L1241 PolarHBondContact O-N 2.96Å; F1237-L1241 VanDerWaalsContact O-N 3.14Å
1242	M	76.1	Confident	80.1	Confident	25 Å²	25	25.7 Å²	25.7	12%	0.123	13%	0.129	C	C	.	.	S	Bend	trans	-75.5	143.2	177.2	-79.6	-163.9	56.2	0	0	112.2	F1237 L1238 Q1246 A1248 R1327 F1329	F1237-M1242 HydrophobicContact CD1-CG 3.81Å; F1237-M1242 HydrophobicContact CD1-SD 4.16Å; F1237-M1242 HydrophobicContact CE1-CG 3.54Å; F1237-M1242 HydrophobicContact CE1-SD 3.91Å; F1237-M1242 HydrophobicContact CZ-CG 4.5Å; F1237-M1242 PolarHBondContact O-N 3.23Å; L1238-M1242 HydrophobicContact CD2-SD 3.51Å; L1238-M1242 VanDerWaalsContact CD2-SD 3.51Å; M1242-Q1246 HydrophobicContact CE-CB 3.81Å; M1242-A1248 HydrophobicContact CE-CB 3.81Å; M1242-A1248 HydrophobicContact SD-CB 3.79Å; M1242-R1327 HydrophobicContact CE-CB 3.89Å; M1242-R1327 HydrophobicContact CE-CG 3.91Å; M1242-R1327 HydrophobicContact SD-CB 4.36Å; M1242-F1329 HydrophobicContact SD-CE2 3.95Å; M1242-F1329 HydrophobicContact SD-CZ 4.49Å
1243	Q	71.4	Confident	80.3	Confident	56 Å²	56	25.6 Å²	25.6	26%	0.262	13%	0.126	S	C	.	.			trans	-75.5	141	176.2	-68.9	170.8	-22.6	0	0	110.2	Y1245 Q1246 R1322	Q1243-Y1245 HydrophobicContact CB-CD1 3.85Å; Q1243-Y1245 HydrophobicContact CB-CE1 3.66Å; Q1243-Y1245 HydrophobicContact CG-CE1 4.21Å; Q1243-Y1245 PolarHBondContact O-N 3.22Å; Q1243-Y1245 PolarHBondContact OE1-OH 3.49Å; Q1243-Q1246 HydrophobicContact CB-CG 4.04Å; Q1243-Q1246 PolarHBondContact O-N 2.7Å; Q1243-R1322 PolarHBondContact OE1-O 3.2Å
1244	S	69.3	Low	80.1	Confident	63 Å²	63	26.2 Å²	26.2	44%	0.441	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.8	-172.4	54.1	0	0	0	0	115.7	Q1368	S1244-Q1368 WeakPolarHBondContact O-CG 3.43Å; S1244-Q1368 PolarHBondContact O-NE2 3.42Å; S1244-Q1368 VanDerWaalsContact O-NE2 3.13Å
1245	Y	73.3	Confident	79.8	Confident	90 Å²	90	29.1 Å²	29.1	35%	0.353	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-20.5	175.4	72.7	-95.5	0	0	0	113.2	Q1243 R1322 R1399	Q1243-Y1245 HydrophobicContact CB-CD1 3.85Å; Q1243-Y1245 HydrophobicContact CB-CE1 3.66Å; Q1243-Y1245 HydrophobicContact CG-CE1 4.21Å; Q1243-Y1245 PolarHBondContact O-N 3.22Å; Q1243-Y1245 PolarHBondContact OE1-OH 3.49Å; Y1245-R1322 PolarHBondContact OH-O 2.71Å; Y1245-R1399 PolarHBondContact O-NH2 2.88Å
1246	Q	84.6	Confident	79.5	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-76.6	140.9	-177.9	-62.2	-169.6	-64.7	0	0	110.2	M1242 Q1243 T1321 R1322 A1324 D1325	M1242-Q1246 HydrophobicContact CE-CB 3.81Å; Q1243-Q1246 HydrophobicContact CB-CG 4.04Å; Q1243-Q1246 PolarHBondContact O-N 2.7Å; Q1246-T1321 PolarHBondContact NE2-O 2.89Å; Q1246-R1322 PolarHBondContact NE2-O 2.85Å; Q1246-A1324 WeakPolarHBondContact CG-O 3.31Å; Q1246-A1324 PolarHBondContact NE2-O 3.41Å; Q1246-D1325 WeakPolarHBondContact CA-O 3.32Å
1247	A	86	Confident	79	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129	167.2	0	0	0	0	0	109.5	D1325 Y1326 R1327 I1365 I1367 V1395	A1247-D1325 PolarHBondContact N-O 3.44Å; A1247-Y1326 HydrophobicContact CB-CD1 4.2Å; A1247-Y1326 CarbonylContact O-C 3.58Å; A1247-Y1326 WeakPolarHBondContact O-CA 3.45Å; A1247-R1327 PolarHBondContact O-N 3.38Å; A1247-I1365 HydrophobicContact CB-CG2 4.37Å; A1247-I1367 HydrophobicContact CB-CD1 4.16Å; A1247-I1367 HydrophobicContact CB-CG1 3.79Å; A1247-V1395 HydrophobicContact CB-CG1 4.01Å
1248	A	87.6	Confident	77.9	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.1	168.6	0	0	0	0	0	108.9	L1238 M1242 I1250 R1327 F1329 I1365 I1366	L1238-A1248 HydrophobicContact CD2-CB 3.63Å; M1242-A1248 HydrophobicContact CE-CB 3.81Å; M1242-A1248 HydrophobicContact SD-CB 3.79Å; A1248-I1250 HydrophobicContact CB-CG1 4.41Å; A1248-R1327 CarbonylContact C-O 3.47Å; A1248-R1327 WeakPolarHBondContact CA-O 3.35Å; A1248-F1329 HydrophobicContact CB-CD2 4.32Å; A1248-F1329 HydrophobicContact CB-CE2 4.27Å; A1248-I1365 WeakPolarHBondContact O-CA 3.48Å; A1248-I1366 HydrophobicContact CB-CB 4.22Å; A1248-I1366 PolarHBondContact N-O 2.85Å; A1248-I1366 PolarHBondContact O-N 3.43Å
1249	V	88	Confident	76.7	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110.2	175.4	-176.7	0	0	0	0	106.9	L1269 R1327 F1328 F1329 L1364 L1391	V1249-L1269 HydrophobicContact CG1-CD1 3.86Å; V1249-R1327 PolarHBondContact N-O 3.41Å; V1249-F1328 HydrophobicContact CB-CD1 3.76Å; V1249-F1328 HydrophobicContact CB-CE1 3.98Å; V1249-F1328 HydrophobicContact CG1-CD1 4.08Å; V1249-F1328 HydrophobicContact CG1-CE1 4.17Å; V1249-F1328 HydrophobicContact CG2-CD1 4.37Å; V1249-F1328 HydrophobicContact CG2-CE1 4.15Å; V1249-F1328 WeakPolarHBondContact O-CA 3.35Å; V1249-F1329 PolarHBondContact O-N 3.24Å; V1249-L1364 WeakPolarHBondContact CA-O 3.36Å; V1249-L1391 HydrophobicContact CG1-CD1 4.28Å; V1249-L1391 HydrophobicContact CG2-CD1 4.03Å
1250	I	87.3	Confident	75.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.7	-172.3	-45.6	-175.3	0	0	0	108.7	I1229 F1234 L1238 A1248 F1329 L1364 I1366	I1229-I1250 HydrophobicContact CG2-CG2 4.32Å; F1234-I1250 HydrophobicContact CE2-CD1 3.63Å; F1234-I1250 HydrophobicContact CZ-CD1 4.17Å; L1238-I1250 HydrophobicContact CD1-CD1 4.31Å; A1248-I1250 HydrophobicContact CB-CG1 4.41Å; I1250-F1329 WeakPolarHBondContact CA-O 3.33Å; I1250-F1329 HydrophobicContact CG1-CB 4.19Å; I1250-F1329 HydrophobicContact CG1-CD2 4.29Å; I1250-F1329 HydrophobicContact CG2-CB 4.27Å; I1250-L1364 HydrophobicContact CB-CB 4.21Å; I1250-L1364 PolarHBondContact N-O 2.88Å; I1250-L1364 PolarHBondContact O-N 3.39Å; I1250-I1366 HydrophobicContact CD1-CD1 3.81Å
1251	I	83.7	Confident	74.1	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.6	169.4	-75.3	171.6	0	0	0	109.5	T1265 L1269 F1329 I1330 Y1331	I1251-T1265 HydrophobicContact CD1-CG2 3.65Å; I1251-T1265 VanDerWaalsContact CD1-O 3.24Å; I1251-T1265 WeakPolarHBondContact CD1-O 3.22Å; I1251-T1265 HydrophobicContact CG1-CG2 3.97Å; I1251-L1269 HydrophobicContact CB-CD1 4.3Å; I1251-L1269 HydrophobicContact CD1-CB 3.32Å; I1251-L1269 HydrophobicContact CD1-CD1 3.3Å; I1251-L1269 HydrophobicContact CD1-CD2 4.34Å; I1251-L1269 HydrophobicContact CD1-CG 3.8Å; I1251-L1269 HydrophobicContact CG1-CB 4.43Å; I1251-L1269 HydrophobicContact CG1-CD1 3.47Å; I1251-L1269 VanDerWaalsContact CG1-CD1 3.47Å; I1251-L1269 HydrophobicContact CG1-CG 4.48Å; I1251-F1329 PolarHBondContact N-O 3.27Å; I1251-F1329 VanDerWaalsContact N-O 3.08Å; I1251-I1330 HydrophobicContact CB-CG2 4.44Å; I1251-I1330 HydrophobicContact CG2-CG2 4.47Å; I1251-I1330 CarbonylContact O-C 3.6Å; I1251-I1330 WeakPolarHBondContact O-CA 3.34Å; I1251-I1330 WeakPolarHBondContact O-CG2 3.27Å; I1251-Y1331 PolarHBondContact O-N 3.13Å
1252	V	84.2	Confident	73	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.9	177.5	-177.7	0	0	0	0	108.2	Y1331 I1333 L1350 P1358 G1361 D1362 L1364	V1252-Y1331 WeakPolarHBondContact CA-O 3.39Å; V1252-Y1331 HydrophobicContact CG1-CD1 4.42Å; V1252-I1333 HydrophobicContact CG1-CD1 3.37Å; V1252-I1333 HydrophobicContact CG1-CG1 3.54Å; V1252-L1350 HydrophobicContact CG2-CD1 4.42Å; V1252-P1358 HydrophobicContact CB-CB 4.21Å; V1252-P1358 HydrophobicContact CB-CG 4.27Å; V1252-P1358 HydrophobicContact CG1-CB 4.13Å; V1252-P1358 HydrophobicContact CG1-CG 3.91Å; V1252-P1358 HydrophobicContact CG2-CB 3.79Å; V1252-P1358 HydrophobicContact CG2-CG 3.63Å; V1252-G1361 PolarHBondContact O-N 3.37Å; V1252-D1362 PolarHBondContact N-O 3.46Å; V1252-L1364 HydrophobicContact CG2-CD1 3.76Å; V1252-L1364 HydrophobicContact CG2-CG 4.07Å
1253	Y	80.5	Confident	72	Confident	34 Å²	34	50.5 Å²	50.5	13%	0.133	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	168.9	175.9	76.3	-70	0	0	0	110.1	I1261 I1330 Y1331 D1332 I1333	Y1253-I1261 HydrophobicContact CD2-CG1 4.07Å; Y1253-I1261 HydrophobicContact CE2-CG1 4.47Å; Y1253-I1330 HydrophobicContact CD1-CB 4.37Å; Y1253-I1330 HydrophobicContact CD1-CG2 3.2Å; Y1253-I1330 HydrophobicContact CE1-CB 3.95Å; Y1253-I1330 HydrophobicContact CE1-CG2 3.19Å; Y1253-I1330 HydrophobicContact CG-CG2 4.29Å; Y1253-Y1331 VanDerWaalsContact CD1-O 3.23Å; Y1253-Y1331 WeakPolarHBondContact CD1-O 3.31Å; Y1253-Y1331 PolarHBondContact N-O 3.35Å; Y1253-D1332 HydrophobicContact CD1-CB 4.4Å; Y1253-D1332 HydrophobicContact CE1-CB 3.71Å; Y1253-D1332 HydrophobicContact CE2-CB 4.23Å; Y1253-D1332 WeakPolarHBondContact O-CA 3.36Å; Y1253-I1333 PolarHBondContact O-N 3.27Å
1254	D	79.1	Confident	71.3	Confident	12 Å²	12	50 Å²	50	6%	0.064	27%	0.27	C	S	.	.			trans	-125.6	115.5	174.9	-172.6	-34.7	0	0	0	107.9	R1256 L1257 A1334 P1360	D1254-R1256 PolarHBondContact O-N 2.85Å; D1254-R1256 WeakPolarHBondContact OD1-CA 3.35Å; D1254-R1256 WeakPolarHBondContact OD1-CB 3.25Å; D1254-R1256 WeakPolarHBondContact OD1-CG 3.21Å; D1254-R1256 IonicContact OD1-CZ 2.7Å; D1254-R1256 PolarHBondContact OD1-N 3.38Å; D1254-R1256 IonicContact OD1-NE 3.17Å; D1254-R1256 PolarHBondContact OD1-NE 3.36Å; D1254-R1256 IonicContact OD1-NH2 2.66Å; D1254-R1256 IonicContact OD2-CZ 3.65Å; D1254-R1256 IonicContact OD2-NE 3.91Å; D1254-R1256 PolarHBondContact OD2-NE 3.23Å; D1254-R1256 IonicContact OD2-NH2 2.63Å; D1254-R1256 PolarHBondContact OD2-NH2 3.12Å; D1254-L1257 HydrophobicContact CB-CB 4.44Å; D1254-L1257 HydrophobicContact CB-CD1 4.04Å; D1254-L1257 HydrophobicContact CB-CG 4.23Å; D1254-L1257 PolarHBondContact O-N 3.38Å; D1254-L1257 VanDerWaalsContact O-N 3.1Å; D1254-A1334 WeakPolarHBondContact OD1-CB 3.34Å; D1254-P1360 HydrophobicContact CB-CB 4.19Å; D1254-P1360 HydrophobicContact CB-CG 3.79Å
1255	S	76	Confident	71	Confident	64 Å²	64	47.2 Å²	47.2	45%	0.448	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.5	-179.8	51.9	0	0	0	0	114.5	L1257 D1332 A1334	S1255-L1257 VanDerWaalsContact C-N 3.35Å; S1255-D1332 WeakPolarHBondContact CB-OD2 3.18Å; S1255-D1332 PolarHBondContact N-OD1 3.12Å; S1255-D1332 VanDerWaalsContact N-OD1 3.12Å; S1255-D1332 PolarHBondContact OG-OD1 2.8Å; S1255-D1332 PolarHBondContact OG-OD2 2.92Å; S1255-A1334 WeakPolarHBondContact OG-CB 3.47Å
1256	R	74.3	Confident	70.6	Confident	129 Å²	129	43.4 Å²	43.4	49%	0.487	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-18.8	173.5	-56.3	168.2	-66	-176.6	0.5	112.4	D1254 A1334	D1254-R1256 PolarHBondContact O-N 2.85Å; D1254-R1256 WeakPolarHBondContact OD1-CA 3.35Å; D1254-R1256 WeakPolarHBondContact OD1-CB 3.25Å; D1254-R1256 WeakPolarHBondContact OD1-CG 3.21Å; D1254-R1256 IonicContact OD1-CZ 2.7Å; D1254-R1256 PolarHBondContact OD1-N 3.38Å; D1254-R1256 IonicContact OD1-NE 3.17Å; D1254-R1256 PolarHBondContact OD1-NE 3.36Å; D1254-R1256 IonicContact OD1-NH2 2.66Å; D1254-R1256 IonicContact OD2-CZ 3.65Å; D1254-R1256 IonicContact OD2-NE 3.91Å; D1254-R1256 PolarHBondContact OD2-NE 3.23Å; D1254-R1256 IonicContact OD2-NH2 2.63Å; D1254-R1256 PolarHBondContact OD2-NH2 3.12Å; R1256-A1334 HydrophobicContact CG-CB 3.75Å
1257	L	69.3	Low	70	Confident	86 Å²	86	46.8 Å²	46.8	45%	0.45	26%	0.255	S	S	.	.			trans	-95.1	115.4	177.7	-67.5	174.5	0	0	0	109.5	D1254 S1255 D1259 G1260 P1360	D1254-L1257 HydrophobicContact CB-CB 4.44Å; D1254-L1257 HydrophobicContact CB-CD1 4.04Å; D1254-L1257 HydrophobicContact CB-CG 4.23Å; D1254-L1257 PolarHBondContact O-N 3.38Å; D1254-L1257 VanDerWaalsContact O-N 3.1Å; S1255-L1257 VanDerWaalsContact C-N 3.35Å; L1257-D1259 PolarHBondContact O-N 3.31Å; L1257-G1260 PolarHBondContact O-N 2.87Å; L1257-G1260 VanDerWaalsContact O-N 3.12Å; L1257-P1360 HydrophobicContact CD1-CB 4.3Å; L1257-P1360 HydrophobicContact CD1-CG 4.06Å
1258	P	57	Low	69.3	Low	105 Å²	105	48.1 Å²	48.1	68%	0.682	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-62.7	-32.2	-179.3	23.7	-31.7	0	0	0	112.5	G1260	P1258-G1260 VanDerWaalsContact C-N 3.32Å
1259	D	55.1	Low	68.8	Low	127 Å²	127	48.4 Å²	48.4	68%	0.679	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-81	-14.2	-179.9	-55.7	-30.3	0	0	0	112.8	L1257 I1261 H1262 I1263	L1257-D1259 PolarHBondContact O-N 3.31Å; D1259-I1261 VanDerWaalsContact C-N 3.26Å; D1259-I1261 PolarHBondContact O-N 2.97Å; D1259-H1262 PolarHBondContact O-N 3.5Å; D1259-H1262 VanDerWaalsContact O-N 3.11Å; D1259-I1263 PolarHBondContact O-N 3.37Å
1260	G	49.6	Very low	68.2	Low	5 Å²	5	49.5 Å²	49.5	5%	0.052	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.7	-27.8	-173.7	0	0	0	0	0	114.4	L1257 P1258 I1263	L1257-G1260 PolarHBondContact O-N 2.87Å; L1257-G1260 VanDerWaalsContact O-N 3.12Å; P1258-G1260 VanDerWaalsContact C-N 3.32Å; G1260-I1263 VanDerWaalsContact O-CD1 3.29Å; G1260-I1263 WeakPolarHBondContact O-CD1 3.43Å
1261	I	49.2	Very low	67.8	Low	83 Å²	83	54.6 Å²	54.6	43%	0.426	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-85.3	-24.3	-179.6	-58.2	173.2	0	0	0	110.9	Y1253 D1259 C1266	Y1253-I1261 HydrophobicContact CD2-CG1 4.07Å; Y1253-I1261 HydrophobicContact CE2-CG1 4.47Å; D1259-I1261 VanDerWaalsContact C-N 3.26Å; D1259-I1261 PolarHBondContact O-N 2.97Å; I1261-C1266 WeakPolarHBondContact O-CB 3.47Å
1262	H	50.7	Low	67.6	Low	137 Å²	137	55.3 Å²	55.3	63%	0.634	30%	0.299	S	S	*	.			trans	-99.2	11	-176.1	-75.9	-61.5	0	0	0	114.4	D1259 G1264	D1259-H1262 PolarHBondContact O-N 3.5Å; D1259-H1262 VanDerWaalsContact O-N 3.11Å; H1262-G1264 PolarHBondContact O-N 3.34Å; H1262-G1264 VanDerWaalsContact O-N 3.15Å
1263	I	55	Low	67.4	Low	61 Å²	61	55.5 Å²	55.5	31%	0.313	30%	0.299	S	S	.	.	S	Bend	trans	-59.6	120.9	160.2	-71.1	114.6	0	0	0	106.6	D1259 G1260 T1265 C1266	D1259-I1263 PolarHBondContact O-N 3.37Å; G1260-I1263 VanDerWaalsContact O-CD1 3.29Å; G1260-I1263 WeakPolarHBondContact O-CD1 3.43Å; I1263-T1265 VanDerWaalsContact CG2-OG1 3.29Å; I1263-T1265 WeakPolarHBondContact CG2-OG1 3.33Å; I1263-T1265 PolarHBondContact O-N 2.85Å; I1263-C1266 PolarHBondContact O-N 3.24Å
1264	G	57.1	Low	67.1	Low	45 Å²	45	55.3 Å²	55.3	46%	0.464	30%	0.302	S	S	.	.	H	α-helix	trans	-51.1	-17.6	-171	0	0	0	0	0	115.7	H1262 L1268	H1262-G1264 PolarHBondContact O-N 3.34Å; H1262-G1264 VanDerWaalsContact O-N 3.15Å; G1264-L1268 PolarHBondContact O-N 3.29Å; G1264-L1268 VanDerWaalsContact O-N 3.11Å
1265	T	62.4	Low	66.8	Low	4 Å²	4	61 Å²	61	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-55.4	-46.4	168.1	-36.8	0	0	0	0	113.3	I1251 I1263 L1268 L1269 C1363 W1386	I1251-T1265 HydrophobicContact CD1-CG2 3.65Å; I1251-T1265 VanDerWaalsContact CD1-O 3.24Å; I1251-T1265 WeakPolarHBondContact CD1-O 3.22Å; I1251-T1265 HydrophobicContact CG1-CG2 3.97Å; I1263-T1265 VanDerWaalsContact CG2-OG1 3.29Å; I1263-T1265 WeakPolarHBondContact CG2-OG1 3.33Å; I1263-T1265 PolarHBondContact O-N 2.85Å; T1265-L1268 PolarHBondContact O-N 3.26Å; T1265-L1269 WeakPolarHBondContact O-CB 3.47Å; T1265-L1269 PolarHBondContact O-N 2.95Å; T1265-C1363 HydrophobicContact CG2-CB 4.31Å; T1265-W1386 HydrophobicContact CG2-CD2 3.76Å; T1265-W1386 HydrophobicContact CG2-CE3 3.76Å; T1265-W1386 HydrophobicContact CG2-CH2 3.48Å; T1265-W1386 VanDerWaalsContact CG2-CH2 3.48Å; T1265-W1386 HydrophobicContact CG2-CZ2 3.36Å; T1265-W1386 HydrophobicContact CG2-CZ3 3.66Å; T1265-W1386 WeakPolarHBondContact OG1-CZ2 3.28Å; T1265-W1386 PolarHBondContact OG1-NE1 3.28Å; T1265-W1386 VanDerWaalsContact OG1-NE1 3.09Å
1266	C	66.2	Low	66.7	Low	11 Å²	11	59 Å²	59	7%	0.074	31%	0.31	C	S	.	.	H	α-helix	trans	-65.7	-42.5	-176.8	-168.6	0	0	0	0	111	I1261 I1263 L1269 C1270	I1261-C1266 WeakPolarHBondContact O-CB 3.47Å; I1263-C1266 PolarHBondContact O-N 3.24Å; C1266-L1269 PolarHBondContact O-N 3.08Å; C1266-C1270 WeakPolarHBondContact O-CB 3.44Å; C1266-C1270 PolarHBondContact O-N 2.97Å; C1266-C1270 PolarHBondContact O-SG 2.79Å
1267	D	70.6	Confident	66.4	Low	71 Å²	71	54.5 Å²	54.5	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-45.1	176.5	-76.5	-24.1	0	0	0	111.6	L1269 C1270 Q1271	D1267-L1269 PolarHBondContact O-N 3.37Å; D1267-C1270 PolarHBondContact O-N 3.06Å; D1267-Q1271 WeakPolarHBondContact O-CB 3.39Å; D1267-Q1271 WeakPolarHBondContact O-CG 3.48Å; D1267-Q1271 PolarHBondContact O-N 3.05Å
1268	L	72.6	Confident	66	Low	28 Å²	28	57 Å²	57	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-47.7	175.3	178	72.1	0	0	0	111.1	G1264 T1265 C1270 Q1271 L1272 W1386	G1264-L1268 PolarHBondContact O-N 3.29Å; G1264-L1268 VanDerWaalsContact O-N 3.11Å; T1265-L1268 PolarHBondContact O-N 3.26Å; L1268-C1270 VanDerWaalsContact C-N 3.35Å; L1268-C1270 PolarHBondContact O-N 2.85Å; L1268-Q1271 CarbonylContact O-C 3.45Å; L1268-Q1271 WeakPolarHBondContact O-CB 3.48Å; L1268-Q1271 PolarHBondContact O-N 3.02Å; L1268-Q1271 VanDerWaalsContact O-N 3.16Å; L1268-L1272 HydrophobicContact CD1-CD1 4.32Å; L1268-L1272 HydrophobicContact CD1-CG 4.18Å; L1268-L1272 HydrophobicContact CD2-CD1 4.17Å; L1268-L1272 HydrophobicContact CG-CD1 3.93Å; L1268-L1272 HydrophobicContact CG-CG 4.15Å; L1268-L1272 WeakPolarHBondContact O-CG 3.4Å; L1268-L1272 PolarHBondContact O-N 3.29Å; L1268-W1386 HydrophobicContact CB-CB 4.38Å; L1268-W1386 HydrophobicContact CD2-CB 3.36Å; L1268-W1386 HydrophobicContact CG-CB 4.43Å
1269	L	75.7	Confident	65.8	Low	8 Å²	8	55.4 Å²	55.4	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-38.5	-176.6	-173.6	154.8	0	0	0	111.2	P1226 V1249 I1251 T1265 C1266 D1267 Q1271 L1272 Y1273 F1328	P1226-L1269 HydrophobicContact CB-CD2 4Å; P1226-L1269 HydrophobicContact CG-CD2 3.18Å; V1249-L1269 HydrophobicContact CG1-CD1 3.86Å; I1251-L1269 HydrophobicContact CB-CD1 4.3Å; I1251-L1269 HydrophobicContact CD1-CB 3.32Å; I1251-L1269 HydrophobicContact CD1-CD1 3.3Å; I1251-L1269 HydrophobicContact CD1-CD2 4.34Å; I1251-L1269 HydrophobicContact CD1-CG 3.8Å; I1251-L1269 HydrophobicContact CG1-CB 4.43Å; I1251-L1269 HydrophobicContact CG1-CD1 3.47Å; I1251-L1269 VanDerWaalsContact CG1-CD1 3.47Å; I1251-L1269 HydrophobicContact CG1-CG 4.48Å; T1265-L1269 WeakPolarHBondContact O-CB 3.47Å; T1265-L1269 PolarHBondContact O-N 2.95Å; C1266-L1269 PolarHBondContact O-N 3.08Å; D1267-L1269 PolarHBondContact O-N 3.37Å; L1269-Q1271 VanDerWaalsContact C-N 3.33Å; L1269-Q1271 PolarHBondContact O-N 2.9Å; L1269-L1272 PolarHBondContact O-N 2.74Å; L1269-Y1273 WeakPolarHBondContact O-CB 3.37Å; L1269-Y1273 PolarHBondContact O-N 3.07Å; L1269-F1328 HydrophobicContact CD1-CD1 3.8Å; L1269-F1328 HydrophobicContact CD2-CB 3.78Å; L1269-F1328 HydrophobicContact CD2-CD1 4.2Å; L1269-F1328 HydrophobicContact CD2-CG 4.24Å; L1269-F1328 HydrophobicContact CG-CB 4.17Å; L1269-F1328 HydrophobicContact CG-CD1 3.62Å; L1269-F1328 HydrophobicContact CG-CE1 4.35Å; L1269-F1328 HydrophobicContact CG-CG 4.14Å
1270	C	76.5	Confident	65.3	Low	26 Å²	26	55 Å²	55	18%	0.176	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-41	171.2	-69.2	0	0	0	0	111.9	C1266 D1267 L1268 T1274	C1266-C1270 WeakPolarHBondContact O-CB 3.44Å; C1266-C1270 PolarHBondContact O-N 2.97Å; C1266-C1270 PolarHBondContact O-SG 2.79Å; D1267-C1270 PolarHBondContact O-N 3.06Å; L1268-C1270 VanDerWaalsContact C-N 3.35Å; L1268-C1270 PolarHBondContact O-N 2.85Å; C1270-T1274 VanDerWaalsContact O-CB 3.32Å; C1270-T1274 WeakPolarHBondContact O-CB 3.24Å; C1270-T1274 PolarHBondContact O-N 3.39Å; C1270-T1274 PolarHBondContact O-OG1 2.94Å
1271	Q	78.2	Confident	64.7	Low	107 Å²	107	55.7 Å²	55.7	50%	0.5	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.3	-72	173.7	33.8	0	0	112.1	D1267 L1268 L1269 T1274 K1275	D1267-Q1271 WeakPolarHBondContact O-CB 3.39Å; D1267-Q1271 WeakPolarHBondContact O-CG 3.48Å; D1267-Q1271 PolarHBondContact O-N 3.05Å; L1268-Q1271 CarbonylContact O-C 3.45Å; L1268-Q1271 WeakPolarHBondContact O-CB 3.48Å; L1268-Q1271 PolarHBondContact O-N 3.02Å; L1268-Q1271 VanDerWaalsContact O-N 3.16Å; L1269-Q1271 VanDerWaalsContact C-N 3.33Å; L1269-Q1271 PolarHBondContact O-N 2.9Å; Q1271-T1274 PolarHBondContact O-N 3.26Å; Q1271-K1275 WeakPolarHBondContact O-CB 3.3Å; Q1271-K1275 VanDerWaalsContact O-CG 3.29Å; Q1271-K1275 WeakPolarHBondContact O-CG 3.4Å; Q1271-K1275 PolarHBondContact O-N 3.32Å
1272	L	80	Confident	63.9	Low	19 Å²	19	55.4 Å²	55.4	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-43.9	178.1	-70.9	178.4	0	0	0	111.5	L1268 L1269 K1275 Q1276 F1328 K1388 L1391	L1268-L1272 HydrophobicContact CD1-CD1 4.32Å; L1268-L1272 HydrophobicContact CD1-CG 4.18Å; L1268-L1272 HydrophobicContact CD2-CD1 4.17Å; L1268-L1272 HydrophobicContact CG-CD1 3.93Å; L1268-L1272 HydrophobicContact CG-CG 4.15Å; L1268-L1272 WeakPolarHBondContact O-CG 3.4Å; L1268-L1272 PolarHBondContact O-N 3.29Å; L1269-L1272 PolarHBondContact O-N 2.74Å; L1272-K1275 PolarHBondContact O-N 2.78Å; L1272-Q1276 WeakPolarHBondContact O-CB 3.47Å; L1272-Q1276 PolarHBondContact O-N 2.89Å; L1272-F1328 HydrophobicContact CB-CE1 4.47Å; L1272-F1328 HydrophobicContact CB-CE2 4.13Å; L1272-F1328 HydrophobicContact CB-CZ 3.91Å; L1272-F1328 HydrophobicContact CD1-CE1 4.47Å; L1272-F1328 HydrophobicContact CD1-CZ 4.29Å; L1272-K1388 HydrophobicContact CD2-CB 3.92Å; L1272-K1388 HydrophobicContact CD2-CD 4.15Å; L1272-K1388 HydrophobicContact CD2-CG 3.84Å; L1272-L1391 HydrophobicContact CD1-CD2 3.87Å
1273	Y	80.7	Confident	62.8	Low	4 Å²	4	51.8 Å²	51.8	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-43	175.5	174.7	-107.4	0	0	0	112.2	S1222 T1225 P1226 L1269 Q1276 Q1277 A1315 F1328	S1222-Y1273 WeakPolarHBondContact O-CE1 3.3Å; S1222-Y1273 PolarHBondContact O-OH 2.93Å; T1225-Y1273 VanDerWaalsContact O-CE1 3.25Å; T1225-Y1273 WeakPolarHBondContact O-CE1 3.42Å; P1226-Y1273 HydrophobicContact CB-CD1 4.28Å; P1226-Y1273 HydrophobicContact CB-CD2 4.28Å; P1226-Y1273 HydrophobicContact CB-CE1 4.48Å; P1226-Y1273 HydrophobicContact CB-CG 4.15Å; P1226-Y1273 HydrophobicContact CG-CD1 3.97Å; P1226-Y1273 HydrophobicContact CG-CD2 4.5Å; P1226-Y1273 HydrophobicContact CG-CG 3.9Å; L1269-Y1273 WeakPolarHBondContact O-CB 3.37Å; L1269-Y1273 PolarHBondContact O-N 3.07Å; Y1273-Q1276 PolarHBondContact O-N 3.12Å; Y1273-Q1277 VanDerWaalsContact CD1-NE2 3.34Å; Y1273-Q1277 PolarHBondContact O-N 3.19Å; Y1273-Q1277 PolarHBondContact O-NE2 3.38Å; Y1273-A1315 WeakPolarHBondContact OH-CB 3.49Å; Y1273-F1328 HydrophobicContact CD2-CB 4.11Å; Y1273-F1328 HydrophobicContact CD2-CD2 4.34Å
1274	T	74	Confident	61.5	Low	30 Å²	30	52.7 Å²	52.7	18%	0.184	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-42.9	175.9	-57.3	0	0	0	0	111	H1224 C1270 Q1271 Q1276 Q1277 N1278	H1224-T1274 PolarHBondContact O-OG1 3.37Å; C1270-T1274 VanDerWaalsContact O-CB 3.32Å; C1270-T1274 WeakPolarHBondContact O-CB 3.24Å; C1270-T1274 PolarHBondContact O-N 3.39Å; C1270-T1274 PolarHBondContact O-OG1 2.94Å; Q1271-T1274 PolarHBondContact O-N 3.26Å; T1274-Q1276 PolarHBondContact O-N 3.16Å; T1274-Q1277 PolarHBondContact O-N 2.89Å; T1274-N1278 PolarHBondContact O-N 3.4Å; T1274-N1278 PolarHBondContact O-ND2 3.09Å
1275	K	73.4	Confident	60	Low	131 Å²	131	58.7 Å²	58.7	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-59.5	-46	175.2	-79.9	179.3	179.2	178.1	0	111.3	Q1271 L1272 Q1277 N1278 T1279	Q1271-K1275 WeakPolarHBondContact O-CB 3.3Å; Q1271-K1275 VanDerWaalsContact O-CG 3.29Å; Q1271-K1275 WeakPolarHBondContact O-CG 3.4Å; Q1271-K1275 PolarHBondContact O-N 3.32Å; L1272-K1275 PolarHBondContact O-N 2.78Å; K1275-Q1277 PolarHBondContact O-N 2.97Å; K1275-N1278 PolarHBondContact O-N 3.14Å; K1275-N1278 VanDerWaalsContact O-N 3.11Å; K1275-T1279 WeakPolarHBondContact O-CG2 3.48Å; K1275-T1279 PolarHBondContact O-N 3.42Å; K1275-T1279 PolarHBondContact O-OG1 3.36Å; K1275-T1279 VanDerWaalsContact O-OG1 3.08Å
1276	Q	73.3	Confident	58.2	Low	23 Å²	23	65.5 Å²	65.5	11%	0.107	35%	0.351	C	S	.	.	H	α-helix	trans	-57.8	-32.2	179.8	-177.7	-176.6	-9.3	0	0	113	L1272 Y1273 T1274 T1279 A1324 Y1326	L1272-Q1276 WeakPolarHBondContact O-CB 3.47Å; L1272-Q1276 PolarHBondContact O-N 2.89Å; Y1273-Q1276 PolarHBondContact O-N 3.12Å; T1274-Q1276 PolarHBondContact O-N 3.16Å; Q1276-T1279 VanDerWaalsContact C-OG1 3.28Å; Q1276-T1279 VanDerWaalsContact CA-OG1 3.3Å; Q1276-T1279 WeakPolarHBondContact CA-OG1 3.15Å; Q1276-T1279 PolarHBondContact O-OG1 2.84Å; Q1276-A1324 HydrophobicContact CG-CB 4.14Å; Q1276-Y1326 PolarHBondContact NE2-O 3.03Å; Q1276-Y1326 VanDerWaalsContact NE2-O 3.07Å
1277	Q	67.1	Low	56.3	Low	33 Å²	33	68.7 Å²	68.7	15%	0.154	37%	0.37	C	S	.	.	H	α-helix	trans	-79.7	-33.9	177.3	-71.6	173.2	52.3	0	0	113.8	R1223 Y1273 T1274 K1275 T1279 A1315 T1321	R1223-Q1277 VanDerWaalsContact CB-OE1 3.23Å; R1223-Q1277 PolarHBondContact O-NE2 3.41Å; R1223-Q1277 PolarHBondContact O-OE1 2.98Å; Y1273-Q1277 VanDerWaalsContact CD1-NE2 3.34Å; Y1273-Q1277 PolarHBondContact O-N 3.19Å; Y1273-Q1277 PolarHBondContact O-NE2 3.38Å; T1274-Q1277 PolarHBondContact O-N 2.89Å; K1275-Q1277 PolarHBondContact O-N 2.97Å; Q1277-T1279 VanDerWaalsContact C-N 3.28Å; Q1277-A1315 HydrophobicContact CG-CB 4.2Å; Q1277-T1321 HydrophobicContact CG-CG2 4.32Å
1278	N	62.3	Low	54.5	Low	138 Å²	138	72.1 Å²	72.1	74%	0.738	39%	0.388	S	S	*	.	H	α-helix	trans	-78.1	-17.6	177.2	-67.8	-27.3	0	0	0	112	T1274 K1275	T1274-N1278 PolarHBondContact O-N 3.4Å; T1274-N1278 PolarHBondContact O-ND2 3.09Å; K1275-N1278 PolarHBondContact O-N 3.14Å; K1275-N1278 VanDerWaalsContact O-N 3.11Å
1279	T	52.3	Low	52.5	Low	73 Å²	73	79.4 Å²	79.4	45%	0.448	43%	0.427	S	S	.	.	S	Bend	trans	-84.4	135.9	171.8	49.3	0	0	0	0	111.5	K1275 Q1276 Q1277	K1275-T1279 WeakPolarHBondContact O-CG2 3.48Å; K1275-T1279 PolarHBondContact O-N 3.42Å; K1275-T1279 PolarHBondContact O-OG1 3.36Å; K1275-T1279 VanDerWaalsContact O-OG1 3.08Å; Q1276-T1279 VanDerWaalsContact C-OG1 3.28Å; Q1276-T1279 VanDerWaalsContact CA-OG1 3.3Å; Q1276-T1279 WeakPolarHBondContact CA-OG1 3.15Å; Q1276-T1279 PolarHBondContact O-OG1 2.84Å; Q1277-T1279 VanDerWaalsContact C-N 3.28Å
1280	L	43.5	Very low	50.2	Low	117 Å²	117	85.7 Å²	85.7	61%	0.613	45%	0.454	S	S	*	.			trans	-56.6	135.8	159.6	-83.1	144	0	0	0	108.4	T1282 T1295	L1280-T1282 PolarHBondContact O-N 2.82Å; L1280-T1282 PolarHBondContact O-OG1 2.73Å; L1280-T1295 HydrophobicContact CB-CG2 4.44Å; L1280-T1295 HydrophobicContact CD1-CG2 4.2Å; L1280-T1295 HydrophobicContact CD2-CG2 4.23Å
1281	P	38.9	Very low	47.8	Very low	21 Å²	21	92 Å²	92	14%	0.136	49%	0.485	C	S	.	.			trans	-54.7	108.5	177.3	8.5	-14.6	0	0	0	108.8	C1283 A1296 I1319 M1323	P1281-C1283 PolarHBondContact O-N 3.36Å; P1281-A1296 HydrophobicContact CB-CB 4.38Å; P1281-A1296 HydrophobicContact CG-CB 3.74Å; P1281-I1319 HydrophobicContact CG-CG2 4.27Å; P1281-M1323 HydrophobicContact CB-CB 3.92Å
1282	T	30.5	Very low	45.2	Very low	77 Å²	77	92.6 Å²	92.6	47%	0.472	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-90.2	100.3	172.9	-36.8	0	0	0	0	104.4	L1280 S1284 I1293	L1280-T1282 PolarHBondContact O-N 2.82Å; L1280-T1282 PolarHBondContact O-OG1 2.73Å; T1282-S1284 PolarHBondContact O-N 2.82Å; T1282-I1293 HydrophobicContact CG2-CG2 3.98Å
1283	C	28.7	Very low	42.6	Very low	61 Å²	61	97.5 Å²	97.5	41%	0.412	51%	0.513	S	S	.	.			trans	-75.4	87.4	165.5	-159.9	0	0	0	0	105.4	P1281 R1285	P1281-C1283 PolarHBondContact O-N 3.36Å; C1283-R1285 PolarHBondContact O-N 3.37Å
1284	S	28.3	Very low	40	Very low	80 Å²	80	100.6 Å²	100.6	56%	0.559	53%	0.528	S	S	*	.			trans	-72.2	74.8	167.9	48.9	0	0	0	0	107.8	T1282	T1282-S1284 PolarHBondContact O-N 2.82Å
1285	R	25.5	Very low	37.7	Very low	170 Å²	170	102 Å²	102	64%	0.642	54%	0.537	S	S	*	.			trans	-76.8	118.2	157.3	-82.2	-178.9	168	-179.6	-3.3	106	C1283 V1287	C1283-R1285 PolarHBondContact O-N 3.37Å; R1285-V1287 HydrophobicContact CB-CG2 3.85Å; R1285-V1287 PolarHBondContact O-N 3.25Å
1286	T	23.7	Very low	35.5	Very low	147 Å²	147	97 Å²	97	90%	0.902	52%	0.52	S	S	*	.			trans	-62	93.8	161.1	48.8	0	0	0	0	107
1287	V	26.6	Very low	33.3	Very low	79 Å²	79	100.6 Å²	100.6	48%	0.479	54%	0.543	S	S	.	.	B	Isolated β-bridge	trans	-107.8	115.1	168.3	-177.7	0	0	0	0	104.9	R1285 K1290	R1285-V1287 HydrophobicContact CB-CG2 3.85Å; R1285-V1287 PolarHBondContact O-N 3.25Å; V1287-K1290 VanDerWaalsContact O-O 3.11Å
1288	D	31.8	Very low	31.5	Very low	142 Å²	142	105.6 Å²	105.6	76%	0.759	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	39.4	76.7	167.7	-61.2	-22.9	0	0	0	116.3	K1290	D1288-K1290 WeakPolarHBondContact O-CB 3.38Å; D1288-K1290 PolarHBondContact O-N 3.39Å
1289	D	32.3	Very low	29.8	Very low	181 Å²	181	105.5 Å²	105.5	97%	0.968	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	42.7	20.3	167.7	-72.6	-11.8	0	0	0	117.1
1290	K	26	Very low	28.6	Very low	140 Å²	140	104.3 Å²	104.3	61%	0.609	55%	0.55	S	S	*	*	B	Isolated β-bridge	trans	-135.3	108.9	-178.1	-76.7	179	179.7	172.7	0	105.8	V1287 D1288 H1292	V1287-K1290 VanDerWaalsContact O-O 3.11Å; D1288-K1290 WeakPolarHBondContact O-CB 3.38Å; D1288-K1290 PolarHBondContact O-N 3.39Å; K1290-H1292 PolarHBondContact O-N 3.27Å
1291	I	26.2	Very low	27.8	Very low	160 Å²	160	102.9 Å²	102.9	82%	0.821	55%	0.55	S	S	*	.			trans	-63.6	86.6	172	-56.1	171.1	0	0	0	107.3	I1293	I1291-I1293 HydrophobicContact CG2-CG1 3.98Å; I1291-I1293 PolarHBondContact O-N 2.96Å; I1291-I1293 VanDerWaalsContact O-N 3.14Å
1292	H	23.7	Very low	27.4	Very low	118 Å²	118	110 Å²	110	55%	0.546	58%	0.581	S	S	.	*			trans	-78.3	96.2	170.1	-111.1	-77.4	0	0	0	107.2	K1290 M1294	K1290-H1292 PolarHBondContact O-N 3.27Å; H1292-M1294 HydrophobicContact CB-CG 4.37Å; H1292-M1294 HydrophobicContact CB-SD 4.43Å; H1292-M1294 PolarHBondContact O-N 3.44Å
1293	I	25.2	Very low	27.3	Very low	123 Å²	123	116 Å²	116	63%	0.631	60%	0.596	S	S	*	*			trans	-69.7	78.3	165.5	-54.8	178.2	0	0	0	106.5	T1282 I1291 T1295	T1282-I1293 HydrophobicContact CG2-CG2 3.98Å; I1291-I1293 HydrophobicContact CG2-CG1 3.98Å; I1291-I1293 PolarHBondContact O-N 2.96Å; I1291-I1293 VanDerWaalsContact O-N 3.14Å; I1293-T1295 PolarHBondContact O-N 2.88Å
1294	M	26.4	Very low	27.2	Very low	69 Å²	69	116.7 Å²	116.7	34%	0.34	60%	0.595	S	S	.	*			trans	-85.3	109.7	176.7	-91.8	168.9	69.3	0	0	109.3	H1292	H1292-M1294 HydrophobicContact CB-CG 4.37Å; H1292-M1294 HydrophobicContact CB-SD 4.43Å; H1292-M1294 PolarHBondContact O-N 3.44Å
1295	T	26	Very low	27.1	Very low	60 Å²	60	118.7 Å²	118.7	37%	0.368	59%	0.591	S	S	.	*	B	Isolated β-bridge	trans	-62.5	132.6	170.5	20.8	0	0	0	0	110.5	L1280 I1293 T1297 E1298	L1280-T1295 HydrophobicContact CB-CG2 4.44Å; L1280-T1295 HydrophobicContact CD1-CG2 4.2Å; L1280-T1295 HydrophobicContact CD2-CG2 4.23Å; I1293-T1295 PolarHBondContact O-N 2.88Å; T1295-T1297 PolarHBondContact O-N 2.86Å; T1295-E1298 PolarHBondContact O-N 3.33Å
1296	A	27.2	Very low	27.4	Very low	26 Å²	26	117.2 Å²	117.2	22%	0.215	60%	0.595	C	S	.	*	G	3₁₀ helix	trans	-57.3	-6.8	-173.1	0	0	0	0	0	116.4	P1281 E1298 F1300	P1281-A1296 HydrophobicContact CB-CB 4.38Å; P1281-A1296 HydrophobicContact CG-CB 3.74Å; A1296-E1298 VanDerWaalsContact C-N 3.35Å; A1296-E1298 PolarHBondContact O-N 2.89Å; A1296-F1300 HydrophobicContact CB-CE2 4.37Å; A1296-F1300 WeakPolarHBondContact O-CD2 3.4Å; A1296-F1300 WeakPolarHBondContact O-CE2 3.3Å
1297	T	26.6	Very low	27.7	Very low	98 Å²	98	118.1 Å²	118.1	60%	0.601	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-67.5	-29.7	177	41.4	0	0	0	0	113.6	T1295 H1299	T1295-T1297 PolarHBondContact O-N 2.86Å; T1297-H1299 VanDerWaalsContact C-N 3.29Å; T1297-H1299 PolarHBondContact O-N 3.48Å
1298	E	29.3	Very low	27.8	Very low	138 Å²	138	120.1 Å²	120.1	65%	0.645	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-75.4	-14.1	-174.2	-68.8	-173.2	167.3	0	0	114.5	T1295 A1296	T1295-E1298 PolarHBondContact O-N 3.33Å; A1296-E1298 VanDerWaalsContact C-N 3.35Å; A1296-E1298 PolarHBondContact O-N 2.89Å
1299	H	26.8	Very low	27.7	Very low	136 Å²	136	122.3 Å²	122.3	63%	0.63	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-103.6	-5.6	-179.9	-95.6	-70	0	0	0	115.3	T1297 S1301	T1297-H1299 VanDerWaalsContact C-N 3.29Å; T1297-H1299 PolarHBondContact O-N 3.48Å; H1299-S1301 PolarHBondContact O-N 2.98Å
1300	F	27.4	Very low	27.9	Very low	48 Å²	48	117.3 Å²	117.3	21%	0.211	56%	0.562	C	S	.	*	S	Bend	trans	-86.4	113.5	171.4	-70.6	-76	0	0	0	109.4	A1296 E1302 L1304 Y1305 I1319 M1323	A1296-F1300 HydrophobicContact CB-CE2 4.37Å; A1296-F1300 WeakPolarHBondContact O-CD2 3.4Å; A1296-F1300 WeakPolarHBondContact O-CE2 3.3Å; F1300-E1302 PolarHBondContact O-N 3.19Å; F1300-E1302 VanDerWaalsContact O-N 3.1Å; F1300-L1304 HydrophobicContact CD1-CD1 4.37Å; F1300-Y1305 HydrophobicContact CB-CD2 4.1Å; F1300-Y1305 HydrophobicContact CB-CE2 3.72Å; F1300-Y1305 HydrophobicContact CD1-CE2 4.32Å; F1300-Y1305 AromaticContact CD2-CE2 3.93Å; F1300-Y1305 HydrophobicContact CD2-CE2 3.93Å; F1300-Y1305 HydrophobicContact CG-CD2 4.4Å; F1300-Y1305 AromaticContact CG-CE2 3.72Å; F1300-Y1305 HydrophobicContact CG-CE2 3.72Å; F1300-I1319 HydrophobicContact CE2-CD1 4.2Å; F1300-I1319 HydrophobicContact CE2-CG2 3.91Å; F1300-I1319 HydrophobicContact CZ-CD1 4.07Å; F1300-I1319 HydrophobicContact CZ-CG1 4.43Å; F1300-I1319 HydrophobicContact CZ-CG2 3.85Å; F1300-M1323 HydrophobicContact CZ-CE 4.13Å
1301	S	27.3	Very low	28.4	Very low	86 Å²	86	112.2 Å²	112.2	60%	0.601	55%	0.546	S	S	*	.			trans	-50.8	122	153.1	-88.7	0	0	0	0	107.1	H1299 R1303 L1304	H1299-S1301 PolarHBondContact O-N 2.98Å; S1301-R1303 PolarHBondContact O-N 3.46Å; S1301-L1304 PolarHBondContact O-N 2.82Å
1302	E	30.1	Very low	29.1	Very low	170 Å²	170	105.8 Å²	105.8	79%	0.794	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.2	-30.7	176	-145	166.2	-161.1	0	0	112.3	F1300 L1304 Y1305	F1300-E1302 PolarHBondContact O-N 3.19Å; F1300-E1302 VanDerWaalsContact O-N 3.1Å; E1302-L1304 VanDerWaalsContact C-N 3.33Å; E1302-L1304 PolarHBondContact O-N 2.86Å; E1302-Y1305 PolarHBondContact O-N 3.21Å
1303	R	28	Very low	30.2	Very low	205 Å²	205	105.7 Å²	105.7	77%	0.774	53%	0.527	S	S	*	.	H	α-helix	trans	-63.5	-21.3	177.1	-66.6	-176.8	177.9	170	0.3	116.5	S1301 K1307	S1301-R1303 PolarHBondContact O-N 3.46Å; R1303-K1307 PolarHBondContact O-N 3.42Å
1304	L	26.5	Very low	31.6	Very low	75 Å²	75	100.1 Å²	100.1	39%	0.393	50%	0.5	S	S	.	.	H	α-helix	trans	-80.5	-31.6	179.3	-78.7	176.2	0	0	0	112.8	I1139 F1300 S1301 E1302 D1306 Y1308	I1139-L1304 HydrophobicContact CD1-CD2 4.13Å; F1300-L1304 HydrophobicContact CD1-CD1 4.37Å; S1301-L1304 PolarHBondContact O-N 2.82Å; E1302-L1304 VanDerWaalsContact C-N 3.33Å; E1302-L1304 PolarHBondContact O-N 2.86Å; L1304-D1306 VanDerWaalsContact C-N 3.33Å; L1304-Y1308 HydrophobicContact CD2-CD2 3.9Å; L1304-Y1308 HydrophobicContact CD2-CE2 4.15Å; L1304-Y1308 PolarHBondContact O-N 2.91Å
1305	Y	27.1	Very low	33.2	Very low	121 Å²	121	97 Å²	97	48%	0.475	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-37.1	176.9	-86.6	-82.8	0	0	0	111.9	F1300 E1302 I1319	F1300-Y1305 HydrophobicContact CB-CD2 4.1Å; F1300-Y1305 HydrophobicContact CB-CE2 3.72Å; F1300-Y1305 HydrophobicContact CD1-CE2 4.32Å; F1300-Y1305 AromaticContact CD2-CE2 3.93Å; F1300-Y1305 HydrophobicContact CD2-CE2 3.93Å; F1300-Y1305 HydrophobicContact CG-CD2 4.4Å; F1300-Y1305 AromaticContact CG-CE2 3.72Å; F1300-Y1305 HydrophobicContact CG-CE2 3.72Å; E1302-Y1305 PolarHBondContact O-N 3.21Å; Y1305-I1319 HydrophobicContact CE1-CD1 4.03Å; Y1305-I1319 WeakPolarHBondContact OH-CD1 3.41Å
1306	D	31.4	Very low	35.1	Very low	139 Å²	139	94.5 Å²	94.5	74%	0.743	47%	0.47	S	S	*	.	H	α-helix	trans	-80.2	-36.2	-177.2	-75.1	-18.5	0	0	0	113.6	L1304	L1304-D1306 VanDerWaalsContact C-N 3.33Å
1307	K	28.9	Very low	36.5	Very low	167 Å²	167	93.5 Å²	93.5	73%	0.726	46%	0.462	S	S	*	.	H	α-helix	trans	-86.8	-29.3	-173.7	-79	-170.6	175.1	-176.1	0	114.5	R1303	R1303-K1307 PolarHBondContact O-N 3.42Å
1308	Y	29.9	Very low	38.4	Very low	121 Å²	121	90.3 Å²	90.3	48%	0.475	44%	0.443	S	S	.	.	S	Bend	trans	-123	90.4	177.9	-59.1	-80.4	0	0	0	107.1	I1139 L1304 I1310	I1139-Y1308 HydrophobicContact CD1-CD2 4.22Å; I1139-Y1308 HydrophobicContact CD1-CE2 4.36Å; L1304-Y1308 HydrophobicContact CD2-CD2 3.9Å; L1304-Y1308 HydrophobicContact CD2-CE2 4.15Å; L1304-Y1308 PolarHBondContact O-N 2.91Å; Y1308-I1310 PolarHBondContact O-N 3.29Å
1309	K	30.6	Very low	39.8	Very low	187 Å²	187	85.1 Å²	85.1	81%	0.813	42%	0.419	S	S	*	.			trans	-49.2	102.1	160	-73.4	180	178.5	178	0	105.7	A1311	K1309-A1311 PolarHBondContact O-N 3.43Å
1310	I	35.6	Very low	41.6	Very low	77 Å²	77	79.3 Å²	79.3	40%	0.395	39%	0.394	S	S	.	.			trans	-62.7	92.6	166.4	-67.3	163.7	0	0	0	103	Y1308 G1312 I1319	Y1308-I1310 PolarHBondContact O-N 3.29Å; I1310-G1312 VanDerWaalsContact C-N 3.26Å; I1310-G1312 PolarHBondContact O-N 2.83Å; I1310-I1319 HydrophobicContact CD1-CD1 3.91Å; I1310-I1319 HydrophobicContact CD1-CG1 3.92Å
1311	A	37.1	Very low	43.5	Very low	33 Å²	33	77.4 Å²	77.4	27%	0.273	39%	0.387	S	S	.	.			trans	-73.8	89	-171.6	0	0	0	0	0	106.2	S1215 G1218 K1309	S1215-A1311 WeakPolarHBondContact O-CB 3.4Å; G1218-A1311 WeakPolarHBondContact CA-O 3.16Å; K1309-A1311 PolarHBondContact O-N 3.43Å
1312	G	39.8	Very low	45.4	Very low	24 Å²	24	75.6 Å²	75.6	25%	0.247	37%	0.367	C	S	.	.			trans	177.4	100.1	-178	0	0	0	0	0	111.3	I1310	I1310-G1312 VanDerWaalsContact C-N 3.26Å; I1310-G1312 PolarHBondContact O-N 2.83Å
1313	T	46.5	Very low	47	Very low	117 Å²	117	70.7 Å²	70.7	72%	0.718	34%	0.344	S	S	*	.			trans	-74.1	-11.2	159.8	49.4	0	0	0	0	112	R1223	R1223-T1313 PolarHBondContact NH2-O 3.35Å
1314	G	54.2	Low	49.1	Very low	6 Å²	6	61.8 Å²	61.8	6%	0.062	32%	0.315	C	S	.	.	S	Bend	trans	-79.1	151.3	178.5	0	0	0	0	0	113.9	C1219	C1219-G1314 VanDerWaalsContact O-CA 3.24Å; C1219-G1314 WeakPolarHBondContact O-CA 3.41Å; C1219-G1314 PolarHBondContact O-N 3.43Å; C1219-G1314 WeakPolarHBondContact SG-CA 3.4Å; C1219-G1314 PolarHBondContact SG-O 3.16Å
1315	A	60	Low	51.4	Low	3 Å²	3	61 Å²	61	3%	0.025	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-57.7	-51.5	-167.9	0	0	0	0	0	115.4	C1221 S1222 R1223 Y1273 Q1277 A1317 S1318 T1321	C1221-A1315 PolarHBondContact O-N 2.99Å; S1222-A1315 VanDerWaalsContact O-CB 3.25Å; S1222-A1315 WeakPolarHBondContact O-CB 3.48Å; R1223-A1315 HydrophobicContact CB-CB 4.5Å; R1223-A1315 HydrophobicContact CG-CB 4.07Å; Y1273-A1315 WeakPolarHBondContact OH-CB 3.49Å; Q1277-A1315 HydrophobicContact CG-CB 4.2Å; A1315-A1317 VanDerWaalsContact C-N 3.3Å; A1315-A1317 PolarHBondContact O-N 3.32Å; A1315-S1318 WeakPolarHBondContact O-CB 3.27Å; A1315-S1318 PolarHBondContact O-N 3.34Å; A1315-S1318 VanDerWaalsContact O-N 3.13Å; A1315-S1318 PolarHBondContact O-OG 3.16Å; A1315-T1321 VanDerWaalsContact O-CG2 3.26Å; A1315-T1321 WeakPolarHBondContact O-CG2 3.25Å; A1315-T1321 PolarHBondContact O-OG1 2.99Å; A1315-T1321 VanDerWaalsContact O-OG1 3.07Å
1316	C	66.4	Low	54.2	Low	7 Å²	7	56.9 Å²	56.9	5%	0.047	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-74.9	-11.2	-172.1	63.7	0	0	0	0	115.6	C1144 C1221 P1227 T1321	C1144-C1316 WeakPolarHBondContact CB-SG 3.45Å; C1144-C1316 PolarHBondContact SG-SG 3.46Å; C1221-C1316 HydrophobicContact CB-CB 4.39Å; C1221-C1316 WeakPolarHBondContact CB-SG 3.5Å; C1221-C1316 PolarHBondContact SG-SG 3.24Å; P1227-C1316 HydrophobicContact CG-CB 4.02Å; C1316-T1321 WeakPolarHBondContact CA-OG1 3.44Å; C1316-T1321 PolarHBondContact O-OG1 3.08Å; C1316-T1321 VanDerWaalsContact O-OG1 3.05Å
1317	A	58	Low	56.7	Low	6 Å²	6	51 Å²	51	5%	0.05	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-97.6	-2	171.9	0	0	0	0	0	111.9	A1143 C1219 A1315	A1143-A1317 HydrophobicContact CB-CB 4.37Å; C1219-A1317 HydrophobicContact CB-CB 4.31Å; C1219-A1317 VanDerWaalsContact SG-CB 3.57Å; A1315-A1317 VanDerWaalsContact C-N 3.3Å; A1315-A1317 PolarHBondContact O-N 3.32Å
1318	S	64.7	Low	59.5	Low	30 Å²	30	43.6 Å²	43.6	21%	0.21	23%	0.23	C	C	.	.	S	Bend	trans	-65.8	152.8	179.1	69	0	0	0	0	111.5	A1315 S1320 T1321 R1322	A1315-S1318 WeakPolarHBondContact O-CB 3.27Å; A1315-S1318 PolarHBondContact O-N 3.34Å; A1315-S1318 VanDerWaalsContact O-N 3.13Å; A1315-S1318 PolarHBondContact O-OG 3.16Å; S1318-S1320 PolarHBondContact O-N 2.95Å; S1318-S1320 PolarHBondContact OG-OG 2.91Å; S1318-T1321 PolarHBondContact N-OG1 3.15Å; S1318-T1321 PolarHBondContact O-N 3.33Å; S1318-T1321 PolarHBondContact O-OG1 3.04Å; S1318-T1321 PolarHBondContact OG-N 3.41Å; S1318-T1321 PolarHBondContact OG-OG1 3Å; S1318-R1322 PolarHBondContact O-N 2.93Å
1319	I	59.9	Low	62.2	Low	29 Å²	29	38 Å²	38	15%	0.149	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-33.9	175.4	-64.2	168	0	0	0	111	P1281 F1300 Y1305 I1310 T1321 R1322 M1323	P1281-I1319 HydrophobicContact CG-CG2 4.27Å; F1300-I1319 HydrophobicContact CE2-CD1 4.2Å; F1300-I1319 HydrophobicContact CE2-CG2 3.91Å; F1300-I1319 HydrophobicContact CZ-CD1 4.07Å; F1300-I1319 HydrophobicContact CZ-CG1 4.43Å; F1300-I1319 HydrophobicContact CZ-CG2 3.85Å; Y1305-I1319 HydrophobicContact CE1-CD1 4.03Å; Y1305-I1319 WeakPolarHBondContact OH-CD1 3.41Å; I1310-I1319 HydrophobicContact CD1-CD1 3.91Å; I1310-I1319 HydrophobicContact CD1-CG1 3.92Å; I1319-T1321 PolarHBondContact O-N 3.45Å; I1319-R1322 PolarHBondContact O-N 3.25Å; I1319-M1323 HydrophobicContact CG2-CG 3.97Å; I1319-M1323 WeakPolarHBondContact O-CB 3.42Å; I1319-M1323 WeakPolarHBondContact O-CG 3.38Å; I1319-M1323 PolarHBondContact O-N 3.4Å
1320	S	64.2	Low	64.8	Low	15 Å²	15	29.7 Å²	29.7	11%	0.105	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-43.3	176.6	55.3	0	0	0	0	112.3	S1318 A1324	S1318-S1320 PolarHBondContact O-N 2.95Å; S1318-S1320 PolarHBondContact OG-OG 2.91Å; S1320-A1324 WeakPolarHBondContact O-CB 3.34Å; S1320-A1324 PolarHBondContact O-N 3.12Å
1321	T	68.1	Low	67.2	Low	8 Å²	8	26 Å²	26	5%	0.049	15%	0.154	C	C	.	.	H	α-helix	trans	-72	-38.6	175.5	55.7	0	0	0	0	113.4	Q1246 Q1277 A1315 C1316 S1318 I1319 M1323	Q1246-T1321 PolarHBondContact NE2-O 2.89Å; Q1277-T1321 HydrophobicContact CG-CG2 4.32Å; A1315-T1321 VanDerWaalsContact O-CG2 3.26Å; A1315-T1321 WeakPolarHBondContact O-CG2 3.25Å; A1315-T1321 PolarHBondContact O-OG1 2.99Å; A1315-T1321 VanDerWaalsContact O-OG1 3.07Å; C1316-T1321 WeakPolarHBondContact CA-OG1 3.44Å; C1316-T1321 PolarHBondContact O-OG1 3.08Å; C1316-T1321 VanDerWaalsContact O-OG1 3.05Å; S1318-T1321 PolarHBondContact N-OG1 3.15Å; S1318-T1321 PolarHBondContact O-N 3.33Å; S1318-T1321 PolarHBondContact O-OG1 3.04Å; S1318-T1321 PolarHBondContact OG-N 3.41Å; S1318-T1321 PolarHBondContact OG-OG1 3Å; I1319-T1321 PolarHBondContact O-N 3.45Å; T1321-M1323 VanDerWaalsContact C-N 3.31Å; T1321-M1323 PolarHBondContact O-N 3.01Å
1322	R	66.2	Low	69.4	Low	47 Å²	47	24.6 Å²	24.6	18%	0.177	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-33.3	176.8	-73.6	-170.2	73.4	-176.9	3.4	112.9	D1138 Q1243 Y1245 Q1246 S1318 I1319	D1138-R1322 PolarHBondContact O-NH2 3.28Å; Q1243-R1322 PolarHBondContact OE1-O 3.2Å; Y1245-R1322 PolarHBondContact OH-O 2.71Å; Q1246-R1322 PolarHBondContact NE2-O 2.85Å; S1318-R1322 PolarHBondContact O-N 2.93Å; I1319-R1322 PolarHBondContact O-N 3.25Å
1323	M	62.8	Low	71.1	Confident	67 Å²	67	24 Å²	24	33%	0.33	13%	0.133	S	C	.	.	H	α-helix	trans	-95.1	-5.9	-174.6	-66.1	-63.3	176.3	0	0	114.5	P1281 F1300 I1319 T1321	P1281-M1323 HydrophobicContact CB-CB 3.92Å; F1300-M1323 HydrophobicContact CZ-CE 4.13Å; I1319-M1323 HydrophobicContact CG2-CG 3.97Å; I1319-M1323 WeakPolarHBondContact O-CB 3.42Å; I1319-M1323 WeakPolarHBondContact O-CG 3.38Å; I1319-M1323 PolarHBondContact O-N 3.4Å; T1321-M1323 VanDerWaalsContact C-N 3.31Å; T1321-M1323 PolarHBondContact O-N 3.01Å
1324	A	72.2	Confident	72.4	Confident	19 Å²	19	19.1 Å²	19.1	16%	0.157	10%	0.104	C	C	.	.	S	Bend	trans	-76.4	159	-180	0	0	0	0	0	112.9	Q1246 Q1276 S1320 Y1326	Q1246-A1324 WeakPolarHBondContact CG-O 3.31Å; Q1246-A1324 PolarHBondContact NE2-O 3.41Å; Q1276-A1324 HydrophobicContact CG-CB 4.14Å; S1320-A1324 WeakPolarHBondContact O-CB 3.34Å; S1320-A1324 PolarHBondContact O-N 3.12Å; A1324-Y1326 PolarHBondContact O-N 2.96Å
1325	D	75.9	Confident	73	Confident	59 Å²	59	23.8 Å²	23.8	32%	0.316	12%	0.124	S	C	.	.	S	Bend	trans	-68.3	-22.9	173.9	-68.3	-46.7	0	0	0	113.3	Q1246 A1247	Q1246-D1325 WeakPolarHBondContact CA-O 3.32Å; A1247-D1325 PolarHBondContact N-O 3.44Å
1326	Y	84.8	Confident	73.1	Confident	33 Å²	33	24.8 Å²	24.8	13%	0.129	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.6	-175.2	-48.4	-49	0	0	0	111.5	A1247 Q1276 A1324 F1328 L1391 D1392 V1395	A1247-Y1326 HydrophobicContact CB-CD1 4.2Å; A1247-Y1326 CarbonylContact O-C 3.58Å; A1247-Y1326 WeakPolarHBondContact O-CA 3.45Å; Q1276-Y1326 PolarHBondContact NE2-O 3.03Å; Q1276-Y1326 VanDerWaalsContact NE2-O 3.07Å; A1324-Y1326 PolarHBondContact O-N 2.96Å; Y1326-F1328 HydrophobicContact CD2-CZ 4.1Å; Y1326-F1328 HydrophobicContact CG-CZ 4.21Å; Y1326-L1391 HydrophobicContact CD2-CD2 4.47Å; Y1326-L1391 HydrophobicContact CE2-CD2 4.49Å; Y1326-D1392 WeakPolarHBondContact CE2-OD1 3.34Å; Y1326-D1392 PolarHBondContact OH-OD1 3.29Å; Y1326-V1395 HydrophobicContact CD1-CG2 4.44Å; Y1326-V1395 HydrophobicContact CE1-CB 4.11Å; Y1326-V1395 HydrophobicContact CE1-CG1 3.95Å; Y1326-V1395 HydrophobicContact CE1-CG2 3.85Å
1327	R	85.4	Confident	72.7	Confident	16 Å²	16	26.9 Å²	26.9	6%	0.06	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.5	161.2	-69.8	-152.9	-177	-154.7	6.3	109.6	A1143 F1237 M1242 A1247 A1248 V1249 F1329	A1143-R1327 PolarHBondContact O-NH1 3.16Å; F1237-R1327 VanDerWaalsContact CZ-NH1 3.29Å; M1242-R1327 HydrophobicContact CE-CB 3.89Å; M1242-R1327 HydrophobicContact CE-CG 3.91Å; M1242-R1327 HydrophobicContact SD-CB 4.36Å; A1247-R1327 PolarHBondContact O-N 3.38Å; A1248-R1327 CarbonylContact C-O 3.47Å; A1248-R1327 WeakPolarHBondContact CA-O 3.35Å; V1249-R1327 PolarHBondContact N-O 3.41Å; R1327-F1329 HydrophobicContact CB-CD2 4.39Å; R1327-F1329 HydrophobicContact CB-CE2 3.45Å; R1327-F1329 VanDerWaalsContact CB-CE2 3.45Å; R1327-F1329 HydrophobicContact CB-CZ 3.68Å; R1327-F1329 HydrophobicContact CG-CZ 4.42Å
1328	F	86.8	Confident	72.3	Confident	11 Å²	11	31.6 Å²	31.6	5%	0.048	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.1	-179.2	-62.9	-67.2	0	0	0	110.9	P1226 V1249 L1269 L1272 Y1273 Y1326 L1391	P1226-F1328 HydrophobicContact CB-CB 4.28Å; V1249-F1328 HydrophobicContact CB-CD1 3.76Å; V1249-F1328 HydrophobicContact CB-CE1 3.98Å; V1249-F1328 HydrophobicContact CG1-CD1 4.08Å; V1249-F1328 HydrophobicContact CG1-CE1 4.17Å; V1249-F1328 HydrophobicContact CG2-CD1 4.37Å; V1249-F1328 HydrophobicContact CG2-CE1 4.15Å; V1249-F1328 WeakPolarHBondContact O-CA 3.35Å; L1269-F1328 HydrophobicContact CD1-CD1 3.8Å; L1269-F1328 HydrophobicContact CD2-CB 3.78Å; L1269-F1328 HydrophobicContact CD2-CD1 4.2Å; L1269-F1328 HydrophobicContact CD2-CG 4.24Å; L1269-F1328 HydrophobicContact CG-CB 4.17Å; L1269-F1328 HydrophobicContact CG-CD1 3.62Å; L1269-F1328 HydrophobicContact CG-CE1 4.35Å; L1269-F1328 HydrophobicContact CG-CG 4.14Å; L1272-F1328 HydrophobicContact CB-CE1 4.47Å; L1272-F1328 HydrophobicContact CB-CE2 4.13Å; L1272-F1328 HydrophobicContact CB-CZ 3.91Å; L1272-F1328 HydrophobicContact CD1-CE1 4.47Å; L1272-F1328 HydrophobicContact CD1-CZ 4.29Å; Y1273-F1328 HydrophobicContact CD2-CB 4.11Å; Y1273-F1328 HydrophobicContact CD2-CD2 4.34Å; Y1326-F1328 HydrophobicContact CD2-CZ 4.1Å; Y1326-F1328 HydrophobicContact CG-CZ 4.21Å; F1328-L1391 HydrophobicContact CE1-CD2 3.96Å; F1328-L1391 HydrophobicContact CZ-CD2 4.17Å
1329	F	87.2	Confident	71.1	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.8	177.5	-58.6	-69.8	0	0	0	111	P1145 P1227 I1229 F1237 M1242 A1248 V1249 I1250 I1251 R1327	P1145-F1329 HydrophobicContact CG-CD1 4.06Å; P1145-F1329 HydrophobicContact CG-CE1 3.77Å; P1227-F1329 HydrophobicContact CG-CD1 3.83Å; P1227-F1329 HydrophobicContact CG-CE1 3.92Å; I1229-F1329 HydrophobicContact CB-CB 4.47Å; I1229-F1329 HydrophobicContact CG2-CB 4.06Å; F1237-F1329 HydrophobicContact CD1-CZ 4.17Å; F1237-F1329 AromaticContact CE1-CE1 3.96Å; F1237-F1329 HydrophobicContact CE1-CE1 3.96Å; F1237-F1329 AromaticContact CE1-CE2 3.97Å; F1237-F1329 HydrophobicContact CE1-CE2 3.97Å; F1237-F1329 AromaticContact CE1-CZ 3.3Å; F1237-F1329 HydrophobicContact CE1-CZ 3.3Å; F1237-F1329 HydrophobicContact CZ-CE1 4.19Å; F1237-F1329 AromaticContact CZ-CZ 3.84Å; F1237-F1329 HydrophobicContact CZ-CZ 3.84Å; M1242-F1329 HydrophobicContact SD-CE2 3.95Å; M1242-F1329 HydrophobicContact SD-CZ 4.49Å; A1248-F1329 HydrophobicContact CB-CD2 4.32Å; A1248-F1329 HydrophobicContact CB-CE2 4.27Å; V1249-F1329 PolarHBondContact O-N 3.24Å; I1250-F1329 WeakPolarHBondContact CA-O 3.33Å; I1250-F1329 HydrophobicContact CG1-CB 4.19Å; I1250-F1329 HydrophobicContact CG1-CD2 4.29Å; I1250-F1329 HydrophobicContact CG2-CB 4.27Å; I1251-F1329 PolarHBondContact N-O 3.27Å; I1251-F1329 VanDerWaalsContact N-O 3.08Å; R1327-F1329 HydrophobicContact CB-CD2 4.39Å; R1327-F1329 HydrophobicContact CB-CE2 3.45Å; R1327-F1329 VanDerWaalsContact CB-CE2 3.45Å; R1327-F1329 HydrophobicContact CB-CZ 3.68Å; R1327-F1329 HydrophobicContact CG-CZ 4.42Å
1330	I	85.7	Confident	70.1	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.5	170.6	-29.4	-176.4	0	0	0	108.8	T1225 P1226 P1227 A1228 I1229 I1251 Y1253	T1225-I1330 HydrophobicContact CG2-CD1 3.91Å; P1226-I1330 HydrophobicContact CB-CD1 4.23Å; P1226-I1330 HydrophobicContact CB-CG1 3.8Å; P1226-I1330 HydrophobicContact CG-CD1 4.09Å; P1226-I1330 HydrophobicContact CG-CG1 4.02Å; P1227-I1330 PolarHBondContact O-N 3.3Å; A1228-I1330 CarbonylContact C-O 3.56Å; A1228-I1330 VanDerWaalsContact CA-O 3.22Å; A1228-I1330 WeakPolarHBondContact CA-O 3.18Å; I1229-I1330 PolarHBondContact N-O 2.79Å; I1251-I1330 HydrophobicContact CB-CG2 4.44Å; I1251-I1330 HydrophobicContact CG2-CG2 4.47Å; I1251-I1330 CarbonylContact O-C 3.6Å; I1251-I1330 WeakPolarHBondContact O-CA 3.34Å; I1251-I1330 WeakPolarHBondContact O-CG2 3.27Å; Y1253-I1330 HydrophobicContact CD1-CB 4.37Å; Y1253-I1330 HydrophobicContact CD1-CG2 3.2Å; Y1253-I1330 HydrophobicContact CE1-CB 3.95Å; Y1253-I1330 HydrophobicContact CE1-CG2 3.19Å; Y1253-I1330 HydrophobicContact CG-CG2 4.29Å
1331	Y	85.9	Confident	69	Low	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.2	178.3	-177.3	-83.1	0	0	0	109.7	I1229 D1231 I1251 V1252 Y1253 I1333 N1336 P1348 L1350	I1229-Y1331 HydrophobicContact CG2-CD2 4.17Å; I1229-Y1331 VanDerWaalsContact O-CD2 3.22Å; I1229-Y1331 WeakPolarHBondContact O-CD2 3.31Å; D1231-Y1331 WeakPolarHBondContact OD1-CE2 3.45Å; D1231-Y1331 VanDerWaalsContact OD1-CZ 3.24Å; D1231-Y1331 PolarHBondContact OD1-OH 3.36Å; I1251-Y1331 PolarHBondContact O-N 3.13Å; V1252-Y1331 WeakPolarHBondContact CA-O 3.39Å; V1252-Y1331 HydrophobicContact CG1-CD1 4.42Å; Y1253-Y1331 VanDerWaalsContact CD1-O 3.23Å; Y1253-Y1331 WeakPolarHBondContact CD1-O 3.31Å; Y1253-Y1331 PolarHBondContact N-O 3.35Å; Y1331-I1333 HydrophobicContact CD1-CG1 4.34Å; Y1331-I1333 HydrophobicContact CE1-CG1 4.26Å; Y1331-N1336 WeakPolarHBondContact CE2-ND2 3.34Å; Y1331-N1336 PolarHBondContact OH-ND2 2.93Å; Y1331-P1348 HydrophobicContact CE1-CB 4.48Å; Y1331-P1348 WeakPolarHBondContact OH-CB 3.23Å; Y1331-L1350 HydrophobicContact CD1-CD1 3.48Å; Y1331-L1350 VanDerWaalsContact CD1-CD1 3.48Å; Y1331-L1350 HydrophobicContact CD1-CG 4.49Å; Y1331-L1350 HydrophobicContact CD2-CD1 3.54Å; Y1331-L1350 HydrophobicContact CD2-CG 4.3Å; Y1331-L1350 HydrophobicContact CE1-CB 4.16Å; Y1331-L1350 HydrophobicContact CE1-CD1 3.55Å; Y1331-L1350 HydrophobicContact CE1-CG 4.1Å; Y1331-L1350 HydrophobicContact CE2-CD1 3.62Å; Y1331-L1350 HydrophobicContact CE2-CG 3.9Å; Y1331-L1350 HydrophobicContact CG-CD1 3.44Å; Y1331-L1350 VanDerWaalsContact CG-CD1 3.44Å
1332	D	81.8	Confident	67.7	Low	3 Å²	3	52.3 Å²	52.3	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.9	178.8	-171	-8.4	0	0	0	110	Y1253 S1255 A1334 Q1335 N1336	Y1253-D1332 HydrophobicContact CD1-CB 4.4Å; Y1253-D1332 HydrophobicContact CE1-CB 3.71Å; Y1253-D1332 HydrophobicContact CE2-CB 4.23Å; Y1253-D1332 WeakPolarHBondContact O-CA 3.36Å; S1255-D1332 WeakPolarHBondContact CB-OD2 3.18Å; S1255-D1332 PolarHBondContact N-OD1 3.12Å; S1255-D1332 VanDerWaalsContact N-OD1 3.12Å; S1255-D1332 PolarHBondContact OG-OD1 2.8Å; S1255-D1332 PolarHBondContact OG-OD2 2.92Å; D1332-A1334 VanDerWaalsContact C-N 3.28Å; D1332-A1334 PolarHBondContact O-N 2.71Å; D1332-A1334 WeakPolarHBondContact OD1-CB 3.42Å; D1332-A1334 PolarHBondContact OD1-N 3.06Å; D1332-Q1335 HydrophobicContact CB-CB 4.11Å; D1332-Q1335 HydrophobicContact CB-CG 4.22Å; D1332-Q1335 WeakPolarHBondContact OD2-CG 3.43Å; D1332-Q1335 PolarHBondContact OD2-NE2 3.03Å; D1332-N1336 PolarHBondContact O-ND2 2.83Å
1333	I	77.1	Confident	66.2	Low	10 Å²	10	55.1 Å²	55.1	5%	0.051	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-36.8	177	-67.1	177.8	0	0	0	110.6	V1252 Y1253 Y1331 N1336 L1337 P1348 L1351 P1360	V1252-I1333 HydrophobicContact CG1-CD1 3.37Å; V1252-I1333 HydrophobicContact CG1-CG1 3.54Å; Y1253-I1333 PolarHBondContact O-N 3.27Å; Y1331-I1333 HydrophobicContact CD1-CG1 4.34Å; Y1331-I1333 HydrophobicContact CE1-CG1 4.26Å; I1333-N1336 PolarHBondContact O-N 2.97Å; I1333-L1337 PolarHBondContact O-N 2.99Å; I1333-P1348 HydrophobicContact CG2-CG 4.06Å; I1333-P1348 WeakPolarHBondContact O-CG 3.45Å; I1333-L1351 HydrophobicContact CG2-CD1 3.93Å; I1333-P1360 HydrophobicContact CD1-CG 4.08Å
1334	A	72.8	Confident	65.1	Low	15 Å²	15	57 Å²	57	12%	0.124	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-37.4	-174.2	0	0	0	0	0	113	D1254 S1255 R1256 D1332 N1336 L1337	D1254-A1334 WeakPolarHBondContact OD1-CB 3.34Å; S1255-A1334 WeakPolarHBondContact OG-CB 3.47Å; R1256-A1334 HydrophobicContact CG-CB 3.75Å; D1332-A1334 VanDerWaalsContact C-N 3.28Å; D1332-A1334 PolarHBondContact O-N 2.71Å; D1332-A1334 WeakPolarHBondContact OD1-CB 3.42Å; D1332-A1334 PolarHBondContact OD1-N 3.06Å; A1334-N1336 PolarHBondContact O-N 3.37Å; A1334-L1337 PolarHBondContact O-N 3.37Å; A1334-L1337 VanDerWaalsContact O-N 3.17Å
1335	Q	67.9	Low	63.9	Low	104 Å²	104	64.8 Å²	64.8	49%	0.486	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.8	176.5	-83.7	175.1	48.5	0	0	112.6	D1332	D1332-Q1335 HydrophobicContact CB-CB 4.11Å; D1332-Q1335 HydrophobicContact CB-CG 4.22Å; D1332-Q1335 WeakPolarHBondContact OD2-CG 3.43Å; D1332-Q1335 PolarHBondContact OD2-NE2 3.03Å
1336	N	60.6	Low	62.8	Low	25 Å²	25	65.1 Å²	65.1	13%	0.134	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-3.9	-179.6	-61.7	-54.5	0	0	0	113	D1231 Y1331 D1332 I1333 A1334 P1348	D1231-N1336 PolarHBondContact N-OD1 3.05Å; Y1331-N1336 WeakPolarHBondContact CE2-ND2 3.34Å; Y1331-N1336 PolarHBondContact OH-ND2 2.93Å; D1332-N1336 PolarHBondContact O-ND2 2.83Å; I1333-N1336 PolarHBondContact O-N 2.97Å; A1334-N1336 PolarHBondContact O-N 3.37Å; N1336-P1348 HydrophobicContact CB-CB 3.86Å; N1336-P1348 HydrophobicContact CB-CG 4.01Å
1337	L	59.1	Low	61.6	Low	51 Å²	51	65.6 Å²	65.6	27%	0.267	36%	0.355	S	S	.	.	S	Bend	trans	-94.9	94.7	172.5	-163.7	82.7	0	0	0	108	I1333 A1334 N1339 P1348	I1333-L1337 PolarHBondContact O-N 2.99Å; A1334-L1337 PolarHBondContact O-N 3.37Å; A1334-L1337 VanDerWaalsContact O-N 3.17Å; L1337-N1339 PolarHBondContact O-N 2.89Å; L1337-N1339 VanDerWaalsContact O-N 3.13Å; L1337-P1348 HydrophobicContact CB-CG 4.39Å; L1337-P1348 HydrophobicContact CD1-CG 4.34Å
1338	N	49.8	Very low	60.7	Low	105 Å²	105	64.8 Å²	64.8	56%	0.561	35%	0.352	S	S	*	.			trans	-58.8	122	174.4	-95.6	-27.5	0	0	0	109.2	N1340 E1346	N1338-N1340 PolarHBondContact O-N 3.01Å; N1338-E1346 PolarHBondContact ND2-OE2 3.43Å
1339	N	39.9	Very low	59.9	Low	139 Å²	139	65.7 Å²	65.7	74%	0.743	36%	0.357	S	S	*	.			trans	-66	24.9	178.1	-80.7	-25.1	0	0	0	113.9	L1337 V1341	L1337-N1339 PolarHBondContact O-N 2.89Å; L1337-N1339 VanDerWaalsContact O-N 3.13Å; N1339-V1341 VanDerWaalsContact C-N 3.34Å; N1339-V1341 PolarHBondContact O-N 2.97Å
1340	N	38.7	Very low	59.3	Low	106 Å²	106	65.5 Å²	65.5	57%	0.567	36%	0.356	S	S	*	.			trans	-82.1	85.9	-179.6	-142.2	-2.5	0	0	0	108.8	N1338 N1342 N1343	N1338-N1340 PolarHBondContact O-N 3.01Å; N1340-N1342 PolarHBondContact O-N 3.13Å; N1340-N1343 PolarHBondContact O-N 3.47Å
1341	V	39.8	Very low	58.6	Low	134 Å²	134	66.3 Å²	66.3	81%	0.812	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-16.8	-175.8	176	0	0	0	0	113.5	N1339	N1339-V1341 VanDerWaalsContact C-N 3.34Å; N1339-V1341 PolarHBondContact O-N 2.97Å
1342	N	41.3	Very low	57.8	Low	137 Å²	137	71.2 Å²	71.2	73%	0.733	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-1.9	-169.7	-67.4	-8.7	0	0	0	116	N1340	N1340-N1342 PolarHBondContact O-N 3.13Å
1343	N	35.3	Very low	57.3	Low	107 Å²	107	75.6 Å²	75.6	57%	0.572	40%	0.398	S	S	*	.	S	Bend	trans	-127.5	113.3	179.4	-71.1	-15.7	0	0	0	109.9	N1340 Q1345	N1340-N1343 PolarHBondContact O-N 3.47Å; N1343-Q1345 PolarHBondContact O-N 2.9Å; N1343-Q1345 VanDerWaalsContact O-N 3.16Å
1344	S	40.2	Very low	57	Low	105 Å²	105	77.8 Å²	77.8	73%	0.734	41%	0.406	S	S	*	.	S	Bend	trans	15.3	87.7	162	58.2	0	0	0	0	114.5	E1346	S1344-E1346 PolarHBondContact O-N 3.33Å
1345	Q	46.1	Very low	56.6	Low	183 Å²	183	83.6 Å²	83.6	86%	0.855	44%	0.435	S	S	*	.			trans	-15.8	96.1	178.2	-78.9	160.1	-38.1	0	0	113.6	N1343 C1347	N1343-Q1345 PolarHBondContact O-N 2.9Å; N1343-Q1345 VanDerWaalsContact O-N 3.16Å; Q1345-C1347 PolarHBondContact O-N 2.91Å
1346	E	52.5	Low	56.5	Low	66 Å²	66	80.9 Å²	80.9	31%	0.308	44%	0.435	S	S	.	.			trans	-67.6	85.7	167.9	-82.8	-169.3	143	0	0	108.1	N1182 N1338 S1344	N1182-E1346 PolarHBondContact ND2-OE1 3.38Å; N1338-E1346 PolarHBondContact ND2-OE2 3.43Å; S1344-E1346 PolarHBondContact O-N 3.33Å
1347	C	60.9	Low	56.9	Low	43 Å²	43	84.8 Å²	84.8	29%	0.291	45%	0.448	S	S	.	.			trans	-67.4	134.6	176	-169.1	0	0	0	0	108.8	Q1345 L1351 K1352	Q1345-C1347 PolarHBondContact O-N 2.91Å; C1347-L1351 WeakPolarHBondContact SG-CB 3.25Å; C1347-K1352 HydrophobicContact CB-CD 4.38Å; C1347-K1352 HydrophobicContact CB-CG 3.76Å; C1347-K1352 WeakPolarHBondContact O-CD 3.45Å; C1347-K1352 WeakPolarHBondContact O-CE 3.5Å; C1347-K1352 WeakPolarHBondContact O-CG 3.37Å; C1347-K1352 PolarHBondContact O-NZ 3.12Å
1348	P	66.3	Low	57.6	Low	0 Å²	0	82.4 Å²	82.4	0%	0	44%	0.436	C	S	.	.			trans	-49.1	144.7	175.6	-31.7	34.5	0	0	0	112.8	Y1331 I1333 N1336 L1337 L1350 L1351 K1352	Y1331-P1348 HydrophobicContact CE1-CB 4.48Å; Y1331-P1348 WeakPolarHBondContact OH-CB 3.23Å; I1333-P1348 HydrophobicContact CG2-CG 4.06Å; I1333-P1348 WeakPolarHBondContact O-CG 3.45Å; N1336-P1348 HydrophobicContact CB-CB 3.86Å; N1336-P1348 HydrophobicContact CB-CG 4.01Å; L1337-P1348 HydrophobicContact CB-CG 4.39Å; L1337-P1348 HydrophobicContact CD1-CG 4.34Å; P1348-L1350 PolarHBondContact O-N 2.89Å; P1348-L1350 VanDerWaalsContact O-N 3.17Å; P1348-L1351 HydrophobicContact CB-CB 4.47Å; P1348-L1351 HydrophobicContact CB-CD1 4.27Å; P1348-L1351 HydrophobicContact CB-CG 4.43Å; P1348-L1351 HydrophobicContact CG-CD1 3.97Å; P1348-L1351 PolarHBondContact O-N 2.87Å; P1348-K1352 PolarHBondContact O-N 2.9Å
1349	L	70.2	Confident	58.8	Low	30 Å²	30	83.3 Å²	83.3	16%	0.157	44%	0.435	C	S	.	.	H	α-helix	trans	-53.1	-41.7	-175.2	-177.7	67.7	0	0	0	112.6	D1231 F1234 K1352 R1353	D1231-L1349 HydrophobicContact CB-CB 4.01Å; D1231-L1349 HydrophobicContact CB-CD2 4.46Å; D1231-L1349 VanDerWaalsContact OD1-CB 3.3Å; D1231-L1349 WeakPolarHBondContact OD1-CB 3.22Å; D1231-L1349 WeakPolarHBondContact OD2-CB 3.33Å; D1231-L1349 PolarHBondContact OD2-N 3.35Å; F1234-L1349 HydrophobicContact CB-CD2 4.31Å; F1234-L1349 HydrophobicContact CD1-CD2 4.16Å; L1349-K1352 PolarHBondContact O-N 3.36Å; L1349-R1353 WeakPolarHBondContact O-CG 3.4Å; L1349-R1353 PolarHBondContact O-N 3.16Å
1350	L	74.1	Confident	60.4	Low	0 Å²	0	79 Å²	79	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-43.7	177.6	-76.9	-179.8	0	0	0	112.2	F1234 V1252 Y1331 P1348 R1353 Y1354 P1358 L1364	F1234-L1350 HydrophobicContact CE1-CD2 4.08Å; F1234-L1350 HydrophobicContact CE2-CD1 4.42Å; F1234-L1350 HydrophobicContact CE2-CD2 3.98Å; F1234-L1350 HydrophobicContact CE2-CG 4.41Å; F1234-L1350 HydrophobicContact CZ-CD2 3.53Å; F1234-L1350 HydrophobicContact CZ-CG 4.39Å; V1252-L1350 HydrophobicContact CG2-CD1 4.42Å; Y1331-L1350 HydrophobicContact CD1-CD1 3.48Å; Y1331-L1350 VanDerWaalsContact CD1-CD1 3.48Å; Y1331-L1350 HydrophobicContact CD1-CG 4.49Å; Y1331-L1350 HydrophobicContact CD2-CD1 3.54Å; Y1331-L1350 HydrophobicContact CD2-CG 4.3Å; Y1331-L1350 HydrophobicContact CE1-CB 4.16Å; Y1331-L1350 HydrophobicContact CE1-CD1 3.55Å; Y1331-L1350 HydrophobicContact CE1-CG 4.1Å; Y1331-L1350 HydrophobicContact CE2-CD1 3.62Å; Y1331-L1350 HydrophobicContact CE2-CG 3.9Å; Y1331-L1350 HydrophobicContact CG-CD1 3.44Å; Y1331-L1350 VanDerWaalsContact CG-CD1 3.44Å; P1348-L1350 PolarHBondContact O-N 2.89Å; P1348-L1350 VanDerWaalsContact O-N 3.17Å; L1350-R1353 PolarHBondContact O-N 2.98Å; L1350-Y1354 HydrophobicContact CD2-CD2 4.28Å; L1350-Y1354 HydrophobicContact CD2-CE2 3.72Å; L1350-Y1354 WeakPolarHBondContact O-CD2 3.48Å; L1350-Y1354 PolarHBondContact O-N 3.28Å; L1350-Y1354 VanDerWaalsContact O-N 3.14Å; L1350-P1358 HydrophobicContact CB-CG 4.15Å; L1350-P1358 HydrophobicContact CD1-CG 4.33Å; L1350-L1364 HydrophobicContact CD1-CD1 3.83Å; L1350-L1364 HydrophobicContact CD2-CD1 4.03Å
1351	L	70.6	Confident	62	Low	30 Å²	30	74.2 Å²	74.2	16%	0.157	39%	0.39	C	S	.	.	H	α-helix	trans	-68.3	-36.2	179.1	-72.7	175.4	0	0	0	112	I1333 C1347 P1348 N1355 G1356 P1358	I1333-L1351 HydrophobicContact CG2-CD1 3.93Å; C1347-L1351 WeakPolarHBondContact SG-CB 3.25Å; P1348-L1351 HydrophobicContact CB-CB 4.47Å; P1348-L1351 HydrophobicContact CB-CD1 4.27Å; P1348-L1351 HydrophobicContact CB-CG 4.43Å; P1348-L1351 HydrophobicContact CG-CD1 3.97Å; P1348-L1351 PolarHBondContact O-N 2.87Å; L1351-N1355 PolarHBondContact O-N 3.03Å; L1351-G1356 PolarHBondContact O-N 3.22Å; L1351-P1358 VanDerWaalsContact CD2-O 3.22Å; L1351-P1358 WeakPolarHBondContact CD2-O 3.41Å
1352	K	69.4	Low	64	Low	102 Å²	102	68 Å²	68	44%	0.443	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-40.7	173	-75.3	178.1	172.6	152	0	112.3	C1347 P1348 L1349	C1347-K1352 HydrophobicContact CB-CD 4.38Å; C1347-K1352 HydrophobicContact CB-CG 3.76Å; C1347-K1352 WeakPolarHBondContact O-CD 3.45Å; C1347-K1352 WeakPolarHBondContact O-CE 3.5Å; C1347-K1352 WeakPolarHBondContact O-CG 3.37Å; C1347-K1352 PolarHBondContact O-NZ 3.12Å; P1348-K1352 PolarHBondContact O-N 2.9Å; L1349-K1352 PolarHBondContact O-N 3.36Å
1353	R	70.5	Confident	66	Low	96 Å²	96	61.6 Å²	61.6	36%	0.362	32%	0.318	S	S	.	.	H	α-helix	trans	-73.9	-33.9	-177.1	-79.2	-177.6	-175.2	179.6	3.7	114.4	D1235 L1349 L1350	D1235-R1353 IonicContact OD1-CZ 3.59Å; D1235-R1353 IonicContact OD1-NH1 3.58Å; D1235-R1353 PolarHBondContact OD1-NH1 3.34Å; D1235-R1353 IonicContact OD1-NH2 3.1Å; D1235-R1353 PolarHBondContact OD1-NH2 2.79Å; D1235-R1353 IonicContact OD2-CZ 2.87Å; D1235-R1353 IonicContact OD2-NH1 3.29Å; D1235-R1353 IonicContact OD2-NH2 2.63Å; D1235-R1353 PolarHBondContact OD2-NH2 3.01Å; L1349-R1353 WeakPolarHBondContact O-CG 3.4Å; L1349-R1353 PolarHBondContact O-N 3.16Å; L1350-R1353 PolarHBondContact O-N 2.98Å
1354	Y	71	Confident	68.4	Low	56 Å²	56	56.5 Å²	56.5	22%	0.22	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-116.5	32.6	-173	-49.1	-67.4	0	0	0	112	L1350 G1356 R1357 L1371	L1350-Y1354 HydrophobicContact CD2-CD2 4.28Å; L1350-Y1354 HydrophobicContact CD2-CE2 3.72Å; L1350-Y1354 WeakPolarHBondContact O-CD2 3.48Å; L1350-Y1354 PolarHBondContact O-N 3.28Å; L1350-Y1354 VanDerWaalsContact O-N 3.14Å; Y1354-G1356 PolarHBondContact O-N 3.41Å; Y1354-R1357 WeakPolarHBondContact CB-O 3.33Å; Y1354-R1357 WeakPolarHBondContact O-CB 3.37Å; Y1354-R1357 PolarHBondContact O-N 3.25Å; Y1354-L1371 HydrophobicContact CD1-CD2 3.59Å; Y1354-L1371 HydrophobicContact CD2-CD2 4.3Å; Y1354-L1371 HydrophobicContact CE1-CB 3.93Å; Y1354-L1371 HydrophobicContact CE1-CD2 3.28Å; Y1354-L1371 HydrophobicContact CE1-CG 4.19Å; Y1354-L1371 HydrophobicContact CE2-CD2 4.05Å; Y1354-L1371 HydrophobicContact CG-CD2 4.1Å; Y1354-L1371 WeakPolarHBondContact OH-CB 3.34Å
1355	N	65	Low	70.7	Confident	136 Å²	136	51.5 Å²	51.5	73%	0.727	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	53.1	170.2	-65.2	-10.5	0	0	0	114	L1351 R1357	L1351-N1355 PolarHBondContact O-N 3.03Å; N1355-R1357 VanDerWaalsContact C-N 3.35Å; N1355-R1357 PolarHBondContact O-N 2.89Å
1356	G	65.2	Low	72.5	Confident	48 Å²	48	43 Å²	43	50%	0.495	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-4.1	177.4	0	0	0	0	0	115.6	L1351 Y1354	L1351-G1356 PolarHBondContact O-N 3.22Å; Y1354-G1356 PolarHBondContact O-N 3.41Å
1357	R	70.1	Confident	73.9	Confident	107 Å²	107	40.1 Å²	40.1	40%	0.404	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-93.3	156.4	154.7	-79.5	-94.5	-169.9	-177.3	3.6	108.5	Y1354 N1355 D1362 I1374	Y1354-R1357 WeakPolarHBondContact CB-O 3.33Å; Y1354-R1357 WeakPolarHBondContact O-CB 3.37Å; Y1354-R1357 PolarHBondContact O-N 3.25Å; N1355-R1357 VanDerWaalsContact C-N 3.35Å; N1355-R1357 PolarHBondContact O-N 2.89Å; R1357-D1362 IonicContact CZ-OD2 3.76Å; R1357-D1362 IonicContact NH1-OD1 2.7Å; R1357-D1362 PolarHBondContact NH1-OD1 3.01Å; R1357-D1362 IonicContact NH1-OD2 2.62Å; R1357-D1362 PolarHBondContact NH1-OD2 3.37Å; R1357-I1374 HydrophobicContact CB-CD1 3.74Å; R1357-I1374 HydrophobicContact CG-CD1 4.48Å
1358	P	73.1	Confident	74.6	Confident	1 Å²	1	43 Å²	43	1%	0.006	21%	0.212	C	C	.	.	P	Polyproline II helix	cis	-78	156	-3.2	30.5	-36	0	0	0	115.1	V1252 L1350 L1351 D1362 L1364 I1374	V1252-P1358 HydrophobicContact CB-CB 4.21Å; V1252-P1358 HydrophobicContact CB-CG 4.27Å; V1252-P1358 HydrophobicContact CG1-CB 4.13Å; V1252-P1358 HydrophobicContact CG1-CG 3.91Å; V1252-P1358 HydrophobicContact CG2-CB 3.79Å; V1252-P1358 HydrophobicContact CG2-CG 3.63Å; L1350-P1358 HydrophobicContact CB-CG 4.15Å; L1350-P1358 HydrophobicContact CD1-CG 4.33Å; L1351-P1358 VanDerWaalsContact CD2-O 3.22Å; L1351-P1358 WeakPolarHBondContact CD2-O 3.41Å; P1358-D1362 HydrophobicContact CB-CB 3.95Å; P1358-L1364 HydrophobicContact CB-CD2 4.23Å; P1358-L1364 HydrophobicContact CG-CD1 4.22Å; P1358-I1374 HydrophobicContact CB-CD1 3.88Å; P1358-I1374 HydrophobicContact CB-CG1 4.43Å
1359	K	75	Confident	75	Confident	124 Å²	124	44.4 Å²	44.4	54%	0.539	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-93.2	157.4	170.9	-64.3	-177.7	-179.2	-177.3	0	111.3	G1361 D1362	K1359-G1361 PolarHBondContact O-N 2.7Å; K1359-D1362 PolarHBondContact N-OD2 2.88Å; K1359-D1362 VanDerWaalsContact O-CB 3.28Å; K1359-D1362 WeakPolarHBondContact O-CB 3.39Å; K1359-D1362 PolarHBondContact O-N 3.25Å
1360	P	73.7	Confident	75.4	Confident	47 Å²	47	48.2 Å²	48.2	31%	0.305	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	128.9	169.3	-22.1	32.2	0	0	0	110.8	D1254 L1257 I1333	D1254-P1360 HydrophobicContact CB-CB 4.19Å; D1254-P1360 HydrophobicContact CB-CG 3.79Å; L1257-P1360 HydrophobicContact CD1-CB 4.3Å; L1257-P1360 HydrophobicContact CD1-CG 4.06Å; I1333-P1360 HydrophobicContact CD1-CG 4.08Å
1361	G	72.5	Confident	75.8	Confident	6 Å²	6	50 Å²	50	6%	0.062	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-16.9	-173.4	0	0	0	0	0	114.7	V1252 K1359	V1252-G1361 PolarHBondContact O-N 3.37Å; K1359-G1361 PolarHBondContact O-N 2.7Å
1362	D	81.4	Confident	76.2	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	25%	0.247	C	C	.	.			trans	-69.5	141.8	176.5	-76.3	-20	0	0	0	111.2	V1252 R1357 P1358 K1359 S1376	V1252-D1362 PolarHBondContact N-O 3.46Å; R1357-D1362 IonicContact CZ-OD2 3.76Å; R1357-D1362 IonicContact NH1-OD1 2.7Å; R1357-D1362 PolarHBondContact NH1-OD1 3.01Å; R1357-D1362 IonicContact NH1-OD2 2.62Å; R1357-D1362 PolarHBondContact NH1-OD2 3.37Å; P1358-D1362 HydrophobicContact CB-CB 3.95Å; K1359-D1362 PolarHBondContact N-OD2 2.88Å; K1359-D1362 VanDerWaalsContact O-CB 3.28Å; K1359-D1362 WeakPolarHBondContact O-CB 3.39Å; K1359-D1362 PolarHBondContact O-N 3.25Å; D1362-S1376 PolarHBondContact OD1-N 3.27Å; D1362-S1376 VanDerWaalsContact OD1-N 3.17Å
1363	C	83.6	Confident	76.8	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.4	170.5	-175.1	0	0	0	0	110	T1265 I1374 G1375 W1386	T1265-C1363 HydrophobicContact CG2-CB 4.31Å; C1363-I1374 WeakPolarHBondContact O-CA 3.45Å; C1363-G1375 PolarHBondContact N-O 2.88Å; C1363-G1375 PolarHBondContact O-N 2.95Å; C1363-W1386 HydrophobicContact CB-CH2 3.5Å; C1363-W1386 HydrophobicContact CB-CZ3 3.76Å
1364	L	86	Confident	77.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.4	175.4	-57.2	169.9	0	0	0	110.1	V1249 I1250 V1252 L1350 P1358 L1371 F1373 I1374	V1249-L1364 WeakPolarHBondContact CA-O 3.36Å; I1250-L1364 HydrophobicContact CB-CB 4.21Å; I1250-L1364 PolarHBondContact N-O 2.88Å; I1250-L1364 PolarHBondContact O-N 3.39Å; V1252-L1364 HydrophobicContact CG2-CD1 3.76Å; V1252-L1364 HydrophobicContact CG2-CG 4.07Å; L1350-L1364 HydrophobicContact CD1-CD1 3.83Å; L1350-L1364 HydrophobicContact CD2-CD1 4.03Å; P1358-L1364 HydrophobicContact CB-CD2 4.23Å; P1358-L1364 HydrophobicContact CG-CD1 4.22Å; L1364-L1371 HydrophobicContact CB-CD1 4.1Å; L1364-L1371 HydrophobicContact CD2-CD1 3.77Å; L1364-L1371 HydrophobicContact CG-CD1 4.49Å; L1364-F1373 WeakPolarHBondContact CA-O 3.45Å; L1364-I1374 HydrophobicContact CD2-CB 3.78Å; L1364-I1374 HydrophobicContact CD2-CD1 3.52Å; L1364-I1374 HydrophobicContact CD2-CG1 3.48Å; L1364-I1374 VanDerWaalsContact CD2-CG1 3.48Å
1365	I	87.4	Confident	77.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117	168.7	-57	171.8	0	0	0	108.4	A1247 A1248 I1367 C1372 F1373 F1378 L1391 K1394 V1395	A1247-I1365 HydrophobicContact CB-CG2 4.37Å; A1248-I1365 WeakPolarHBondContact O-CA 3.48Å; I1365-I1367 HydrophobicContact CG2-CD1 4.28Å; I1365-I1367 HydrophobicContact CG2-CG1 4.15Å; I1365-C1372 PolarHBondContact O-N 3.48Å; I1365-F1373 HydrophobicContact CB-CB 4.07Å; I1365-F1373 HydrophobicContact CD1-CB 4.12Å; I1365-F1373 HydrophobicContact CD1-CD1 3.87Å; I1365-F1373 HydrophobicContact CD1-CG 4.3Å; I1365-F1373 HydrophobicContact CG1-CB 4.27Å; I1365-F1373 HydrophobicContact CG1-CD1 4.06Å; I1365-F1373 PolarHBondContact N-O 3.48Å; I1365-F1373 PolarHBondContact O-N 3.47Å; I1365-F1378 HydrophobicContact CD1-CE1 3.88Å; I1365-L1391 HydrophobicContact CD1-CD1 4.36Å; I1365-K1394 HydrophobicContact CD1-CB 4.34Å; I1365-K1394 HydrophobicContact CD1-CG 3.99Å; I1365-V1395 HydrophobicContact CD1-CG2 3.98Å; I1365-V1395 HydrophobicContact CG2-CG2 4.19Å
1366	I	85.2	Confident	78.2	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.9	178.9	-57.3	174.6	0	0	0	108.9	F1234 L1238 A1248 I1250 K1370 L1371	F1234-I1366 HydrophobicContact CE1-CD1 4.46Å; F1234-I1366 HydrophobicContact CE2-CD1 4.47Å; F1234-I1366 HydrophobicContact CZ-CD1 3.67Å; L1238-I1366 HydrophobicContact CD1-CD1 3.67Å; L1238-I1366 HydrophobicContact CD1-CG2 4.32Å; A1248-I1366 HydrophobicContact CB-CB 4.22Å; A1248-I1366 PolarHBondContact N-O 2.85Å; A1248-I1366 PolarHBondContact O-N 3.43Å; I1250-I1366 HydrophobicContact CD1-CD1 3.81Å; I1366-K1370 CarbonylContact C-O 3.57Å; I1366-K1370 VanDerWaalsContact CA-O 3.3Å; I1366-K1370 WeakPolarHBondContact CA-O 3.18Å; I1366-K1370 WeakPolarHBondContact CG2-O 3.31Å; I1366-L1371 HydrophobicContact CG1-CD1 3.96Å
1367	I	82	Confident	78.5	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.5	179.7	-56.6	179.1	0	0	0	107.7	A1247 I1365 G1369 K1370 V1395 C1398 R1399 L1402	A1247-I1367 HydrophobicContact CB-CD1 4.16Å; A1247-I1367 HydrophobicContact CB-CG1 3.79Å; I1365-I1367 HydrophobicContact CG2-CD1 4.28Å; I1365-I1367 HydrophobicContact CG2-CG1 4.15Å; I1367-G1369 PolarHBondContact O-N 3.1Å; I1367-K1370 PolarHBondContact N-O 2.87Å; I1367-K1370 PolarHBondContact O-N 3.26Å; I1367-V1395 HydrophobicContact CD1-CG1 4.25Å; I1367-C1398 HydrophobicContact CD1-CB 4Å; I1367-R1399 HydrophobicContact CD1-CG 3.71Å; I1367-L1402 HydrophobicContact CB-CD1 4.14Å; I1367-L1402 HydrophobicContact CG2-CD1 4.27Å
1368	Q	75.5	Confident	78.5	Confident	105 Å²	105	29.6 Å²	29.6	49%	0.491	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	40.3	-177.9	-62.8	175.9	-3.8	0	0	113.3	S1244 K1370	S1244-Q1368 WeakPolarHBondContact O-CG 3.43Å; S1244-Q1368 PolarHBondContact O-NE2 3.42Å; S1244-Q1368 VanDerWaalsContact O-NE2 3.13Å; Q1368-K1370 PolarHBondContact O-N 3.39Å
1369	G	73.2	Confident	78.2	Confident	28 Å²	28	32.3 Å²	32.3	29%	0.289	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	-0.9	-177.9	0	0	0	0	0	115.3	N1239 I1367	N1239-G1369 WeakPolarHBondContact OD1-CA 3.39Å; I1367-G1369 PolarHBondContact O-N 3.1Å
1370	K	78.6	Confident	77.5	Confident	110 Å²	110	29.3 Å²	29.3	48%	0.478	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.8	-177.2	-60.2	-176.3	-177.9	179.8	0	112	I1366 I1367 Q1368 C1372 F1407	I1366-K1370 CarbonylContact C-O 3.57Å; I1366-K1370 VanDerWaalsContact CA-O 3.3Å; I1366-K1370 WeakPolarHBondContact CA-O 3.18Å; I1366-K1370 WeakPolarHBondContact CG2-O 3.31Å; I1367-K1370 PolarHBondContact N-O 2.87Å; I1367-K1370 PolarHBondContact O-N 3.26Å; Q1368-K1370 PolarHBondContact O-N 3.39Å; K1370-C1372 PolarHBondContact O-N 3.08Å; K1370-C1372 PolarHBondContact O-SG 3.27Å; K1370-C1372 VanDerWaalsContact O-SG 3.4Å; K1370-F1407 HydrophobicContact CB-CE2 4.27Å; K1370-F1407 HydrophobicContact CB-CZ 3.93Å; K1370-F1407 HydrophobicContact CD-CD2 4.27Å; K1370-F1407 HydrophobicContact CD-CE2 3.44Å; K1370-F1407 VanDerWaalsContact CD-CE2 3.44Å; K1370-F1407 HydrophobicContact CD-CZ 3.98Å; K1370-F1407 HydrophobicContact CG-CE2 4.48Å
1371	L	82.3	Confident	76.9	Confident	38 Å²	38	34.8 Å²	34.8	20%	0.199	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	122.3	173.8	-177	68.6	0	0	0	110	Y1354 L1364 I1366 F1373 I1374	Y1354-L1371 HydrophobicContact CD1-CD2 3.59Å; Y1354-L1371 HydrophobicContact CD2-CD2 4.3Å; Y1354-L1371 HydrophobicContact CE1-CB 3.93Å; Y1354-L1371 HydrophobicContact CE1-CD2 3.28Å; Y1354-L1371 HydrophobicContact CE1-CG 4.19Å; Y1354-L1371 HydrophobicContact CE2-CD2 4.05Å; Y1354-L1371 HydrophobicContact CG-CD2 4.1Å; Y1354-L1371 WeakPolarHBondContact OH-CB 3.34Å; L1364-L1371 HydrophobicContact CB-CD1 4.1Å; L1364-L1371 HydrophobicContact CD2-CD1 3.77Å; L1364-L1371 HydrophobicContact CG-CD1 4.49Å; I1366-L1371 HydrophobicContact CG1-CD1 3.96Å; L1371-F1373 VanDerWaalsContact CD1-O 3.32Å; L1371-F1373 WeakPolarHBondContact CD1-O 3.21Å; L1371-I1374 HydrophobicContact CD2-CB 4.42Å
1372	C	79.8	Confident	76.3	Confident	12 Å²	12	41.7 Å²	41.7	8%	0.081	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-26.8	179.8	-56.5	0	0	0	0	112.7	I1365 K1370 C1398	I1365-C1372 PolarHBondContact O-N 3.48Å; K1370-C1372 PolarHBondContact O-N 3.08Å; K1370-C1372 PolarHBondContact O-SG 3.27Å; K1370-C1372 VanDerWaalsContact O-SG 3.4Å; C1372-C1398 HydrophobicContact CB-CB 3.6Å
1373	F	82.7	Confident	75.1	Confident	21 Å²	21	50.7 Å²	50.7	9%	0.092	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	144.2	-179.3	173.2	-102.2	0	0	0	111.4	L1364 I1365 L1371 S1377 F1378 K1394	L1364-F1373 WeakPolarHBondContact CA-O 3.45Å; I1365-F1373 HydrophobicContact CB-CB 4.07Å; I1365-F1373 HydrophobicContact CD1-CB 4.12Å; I1365-F1373 HydrophobicContact CD1-CD1 3.87Å; I1365-F1373 HydrophobicContact CD1-CG 4.3Å; I1365-F1373 HydrophobicContact CG1-CB 4.27Å; I1365-F1373 HydrophobicContact CG1-CD1 4.06Å; I1365-F1373 PolarHBondContact N-O 3.48Å; I1365-F1373 PolarHBondContact O-N 3.47Å; L1371-F1373 VanDerWaalsContact CD1-O 3.32Å; L1371-F1373 WeakPolarHBondContact CD1-O 3.21Å; F1373-S1377 WeakPolarHBondContact CZ-O 3.49Å; F1373-F1378 HydrophobicContact CD1-CD1 4.22Å; F1373-F1378 HydrophobicContact CD1-CE1 4.26Å; F1373-F1378 AromaticContact CE1-CD1 3.67Å; F1373-F1378 HydrophobicContact CE1-CD1 3.67Å; F1373-F1378 AromaticContact CE1-CE1 3.94Å; F1373-F1378 HydrophobicContact CE1-CE1 3.94Å; F1373-F1378 HydrophobicContact CZ-CD1 4.22Å; F1373-K1394 HydrophobicContact CD1-CG 4.44Å; F1373-K1394 HydrophobicContact CD2-CD 4.35Å; F1373-K1394 HydrophobicContact CD2-CG 4.44Å; F1373-K1394 HydrophobicContact CG-CG 4.27Å
1374	I	83	Confident	73.8	Confident	39 Å²	39	54.5 Å²	54.5	20%	0.2	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	128.5	173.6	-175.8	163.2	0	0	0	108.6	R1357 P1358 C1363 L1364 L1371	R1357-I1374 HydrophobicContact CB-CD1 3.74Å; R1357-I1374 HydrophobicContact CG-CD1 4.48Å; P1358-I1374 HydrophobicContact CB-CD1 3.88Å; P1358-I1374 HydrophobicContact CB-CG1 4.43Å; C1363-I1374 WeakPolarHBondContact O-CA 3.45Å; L1364-I1374 HydrophobicContact CD2-CB 3.78Å; L1364-I1374 HydrophobicContact CD2-CD1 3.52Å; L1364-I1374 HydrophobicContact CD2-CG1 3.48Å; L1364-I1374 VanDerWaalsContact CD2-CG1 3.48Å; L1371-I1374 HydrophobicContact CD2-CB 4.42Å
1375	G	78.2	Confident	72.5	Confident	10 Å²	10	59.5 Å²	59.5	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	164.2	172.9	0	0	0	0	0	115.2	C1363 S1377	C1363-G1375 PolarHBondContact N-O 2.88Å; C1363-G1375 PolarHBondContact O-N 2.95Å; G1375-S1377 VanDerWaalsContact C-N 3.31Å
1376	S	74.1	Confident	71.5	Confident	37 Å²	37	61.1 Å²	61.1	26%	0.259	33%	0.326	S	S	.	.	S	Bend	trans	-82.1	-2.1	178.2	57.4	0	0	0	0	113.8	D1362 E1382 W1386	D1362-S1376 PolarHBondContact OD1-N 3.27Å; D1362-S1376 VanDerWaalsContact OD1-N 3.17Å; S1376-E1382 PolarHBondContact OG-OE1 3.29Å; S1376-W1386 WeakPolarHBondContact O-CZ2 3.4Å
1377	S	71	Confident	71	Confident	10 Å²	10	62.9 Å²	62.9	7%	0.07	34%	0.339	C	S	.	.			trans	-158.9	147.5	171.5	64.5	0	0	0	0	111	F1373 G1375 T1379 G1380 Y1381	F1373-S1377 WeakPolarHBondContact CZ-O 3.49Å; G1375-S1377 VanDerWaalsContact C-N 3.31Å; S1377-T1379 VanDerWaalsContact C-N 3.31Å; S1377-T1379 PolarHBondContact O-N 2.98Å; S1377-G1380 VanDerWaalsContact OG-C 3.23Å; S1377-G1380 WeakPolarHBondContact OG-CA 3.42Å; S1377-G1380 PolarHBondContact OG-N 2.89Å; S1377-Y1381 PolarHBondContact OG-N 3.27Å
1378	F	70.1	Confident	70.8	Confident	17 Å²	17	68.2 Å²	68.2	8%	0.075	36%	0.362	C	S	.	.	S	Bend	trans	-72.6	-24.6	176.4	-66.8	-45.9	0	0	0	113.7	I1365 F1373 W1386 Q1390 L1391 K1394	I1365-F1378 HydrophobicContact CD1-CE1 3.88Å; F1373-F1378 HydrophobicContact CD1-CD1 4.22Å; F1373-F1378 HydrophobicContact CD1-CE1 4.26Å; F1373-F1378 AromaticContact CE1-CD1 3.67Å; F1373-F1378 HydrophobicContact CE1-CD1 3.67Å; F1373-F1378 AromaticContact CE1-CE1 3.94Å; F1373-F1378 HydrophobicContact CE1-CE1 3.94Å; F1373-F1378 HydrophobicContact CZ-CD1 4.22Å; F1378-W1386 HydrophobicContact CD1-CE3 4.46Å; F1378-W1386 AromaticContact CD1-CZ3 3.81Å; F1378-W1386 HydrophobicContact CD1-CZ3 3.81Å; F1378-W1386 HydrophobicContact CD2-CD2 4.47Å; F1378-W1386 AromaticContact CD2-CE3 3.42Å; F1378-W1386 HydrophobicContact CD2-CE3 3.42Å; F1378-W1386 VanDerWaalsContact CD2-CE3 3.42Å; F1378-W1386 AromaticContact CD2-CZ3 3.63Å; F1378-W1386 HydrophobicContact CD2-CZ3 3.63Å; F1378-W1386 HydrophobicContact CE1-CE3 4.29Å; F1378-W1386 HydrophobicContact CE1-CH2 4.47Å; F1378-W1386 AromaticContact CE1-CZ3 3.55Å; F1378-W1386 HydrophobicContact CE1-CZ3 3.55Å; F1378-W1386 HydrophobicContact CE2-CD2 4.49Å; F1378-W1386 AromaticContact CE2-CE3 3.21Å; F1378-W1386 HydrophobicContact CE2-CE3 3.21Å; F1378-W1386 AromaticContact CE2-CZ3 3.36Å; F1378-W1386 HydrophobicContact CE2-CZ3 3.36Å; F1378-W1386 HydrophobicContact CG-CE3 4.07Å; F1378-W1386 AromaticContact CG-CZ3 3.85Å; F1378-W1386 HydrophobicContact CG-CZ3 3.85Å; F1378-W1386 AromaticContact CZ-CE3 3.69Å; F1378-W1386 HydrophobicContact CZ-CE3 3.69Å; F1378-W1386 AromaticContact CZ-CZ3 3.32Å; F1378-W1386 HydrophobicContact CZ-CZ3 3.32Å; F1378-Q1390 HydrophobicContact CB-CB 4.2Å; F1378-Q1390 HydrophobicContact CD2-CB 3.97Å; F1378-L1391 HydrophobicContact CD2-CB 4.3Å; F1378-L1391 HydrophobicContact CE1-CD1 4.08Å; F1378-L1391 HydrophobicContact CE2-CB 3.56Å; F1378-L1391 HydrophobicContact CE2-CD1 3.91Å; F1378-L1391 HydrophobicContact CE2-CG 4.3Å; F1378-L1391 HydrophobicContact CZ-CB 3.99Å; F1378-L1391 HydrophobicContact CZ-CD1 3.37Å; F1378-L1391 HydrophobicContact CZ-CG 4.24Å; F1378-K1394 HydrophobicContact CB-CB 4.32Å; F1378-K1394 HydrophobicContact CB-CG 4.47Å; F1378-K1394 HydrophobicContact CD1-CB 3.96Å; F1378-K1394 HydrophobicContact CD1-CG 3.85Å; F1378-K1394 HydrophobicContact CG-CB 4.21Å; F1378-K1394 HydrophobicContact CG-CG 4.45Å
1379	T	66.3	Low	70.9	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.362	37%	0.37	S	S	.	.	S	Bend	trans	-99.8	-14.4	-174.9	55.6	0	0	0	0	113.7	S1377 Y1381 Q1390	S1377-T1379 VanDerWaalsContact C-N 3.31Å; S1377-T1379 PolarHBondContact O-N 2.98Å; T1379-Y1381 VanDerWaalsContact C-N 3.32Å; T1379-Y1381 PolarHBondContact OG1-N 3.36Å; T1379-Q1390 HydrophobicContact CG2-CG 4.13Å
1380	G	61.5	Low	71.2	Confident	61 Å²	61	70.4 Å²	70.4	63%	0.629	37%	0.365	S	S	*	.	S	Bend	trans	88	-7	-170.7	0	0	0	0	0	114.2	S1377	S1377-G1380 VanDerWaalsContact OG-C 3.23Å; S1377-G1380 WeakPolarHBondContact OG-CA 3.42Å; S1377-G1380 PolarHBondContact OG-N 2.89Å
1381	Y	61.5	Low	71.4	Confident	162 Å²	162	65.3 Å²	65.3	64%	0.635	34%	0.343	S	S	*	.			trans	-105.2	109.9	176.4	-58.2	-81.4	0	0	0	109.5	S1377 T1379 E1383 L1384	S1377-Y1381 PolarHBondContact OG-N 3.27Å; T1379-Y1381 VanDerWaalsContact C-N 3.32Å; T1379-Y1381 PolarHBondContact OG1-N 3.36Å; Y1381-E1383 PolarHBondContact O-N 2.9Å; Y1381-L1384 HydrophobicContact CD2-CD1 4.13Å; Y1381-L1384 HydrophobicContact CG-CD1 4.34Å; Y1381-L1384 PolarHBondContact O-N 2.95Å
1382	E	59.2	Low	71.4	Confident	150 Å²	150	66 Å²	66	70%	0.701	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.3	-178.3	-61.6	-168.2	150.9	0	0	113.1	S1376	S1376-E1382 PolarHBondContact OG-OE1 3.29Å
1383	E	56	Low	71.4	Confident	193 Å²	193	72.1 Å²	72.1	90%	0.902	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-19	-178.7	-60.8	-178	-176.9	0	0	114	Y1381	Y1381-E1383 PolarHBondContact O-N 2.9Å
1384	L	56.2	Low	71.3	Confident	83 Å²	83	73.2 Å²	73.2	44%	0.435	38%	0.377	S	S	.	.	S	Bend	trans	-80	129.3	-178.1	-80.1	170.4	0	0	0	110.5	Y1381 W1386	Y1381-L1384 HydrophobicContact CD2-CD1 4.13Å; Y1381-L1384 HydrophobicContact CG-CD1 4.34Å; Y1381-L1384 PolarHBondContact O-N 2.95Å; L1384-W1386 PolarHBondContact O-N 3.09Å
1385	P	58.9	Low	71.4	Confident	104 Å²	104	71.4 Å²	71.4	68%	0.675	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-62.3	134	175.7	25.4	-32.3	0	0	0	109.6	S1387 Q1390	P1385-S1387 PolarHBondContact O-N 3.39Å; P1385-Q1390 PolarHBondContact O-OE1 3.05Å
1386	W	67.3	Low	71.3	Confident	34 Å²	34	73 Å²	73	13%	0.129	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-61.4	134.8	176.2	-65.6	68	0	0	0	109.5	T1265 L1268 C1363 S1376 F1378 L1384	T1265-W1386 HydrophobicContact CG2-CD2 3.76Å; T1265-W1386 HydrophobicContact CG2-CE3 3.76Å; T1265-W1386 HydrophobicContact CG2-CH2 3.48Å; T1265-W1386 VanDerWaalsContact CG2-CH2 3.48Å; T1265-W1386 HydrophobicContact CG2-CZ2 3.36Å; T1265-W1386 HydrophobicContact CG2-CZ3 3.66Å; T1265-W1386 WeakPolarHBondContact OG1-CZ2 3.28Å; T1265-W1386 PolarHBondContact OG1-NE1 3.28Å; T1265-W1386 VanDerWaalsContact OG1-NE1 3.09Å; L1268-W1386 HydrophobicContact CB-CB 4.38Å; L1268-W1386 HydrophobicContact CD2-CB 3.36Å; L1268-W1386 HydrophobicContact CG-CB 4.43Å; C1363-W1386 HydrophobicContact CB-CH2 3.5Å; C1363-W1386 HydrophobicContact CB-CZ3 3.76Å; S1376-W1386 WeakPolarHBondContact O-CZ2 3.4Å; F1378-W1386 HydrophobicContact CD1-CE3 4.46Å; F1378-W1386 AromaticContact CD1-CZ3 3.81Å; F1378-W1386 HydrophobicContact CD1-CZ3 3.81Å; F1378-W1386 HydrophobicContact CD2-CD2 4.47Å; F1378-W1386 AromaticContact CD2-CE3 3.42Å; F1378-W1386 HydrophobicContact CD2-CE3 3.42Å; F1378-W1386 VanDerWaalsContact CD2-CE3 3.42Å; F1378-W1386 AromaticContact CD2-CZ3 3.63Å; F1378-W1386 HydrophobicContact CD2-CZ3 3.63Å; F1378-W1386 HydrophobicContact CE1-CE3 4.29Å; F1378-W1386 HydrophobicContact CE1-CH2 4.47Å; F1378-W1386 AromaticContact CE1-CZ3 3.55Å; F1378-W1386 HydrophobicContact CE1-CZ3 3.55Å; F1378-W1386 HydrophobicContact CE2-CD2 4.49Å; F1378-W1386 AromaticContact CE2-CE3 3.21Å; F1378-W1386 HydrophobicContact CE2-CE3 3.21Å; F1378-W1386 AromaticContact CE2-CZ3 3.36Å; F1378-W1386 HydrophobicContact CE2-CZ3 3.36Å; F1378-W1386 HydrophobicContact CG-CE3 4.07Å; F1378-W1386 AromaticContact CG-CZ3 3.85Å; F1378-W1386 HydrophobicContact CG-CZ3 3.85Å; F1378-W1386 AromaticContact CZ-CE3 3.69Å; F1378-W1386 HydrophobicContact CZ-CE3 3.69Å; F1378-W1386 AromaticContact CZ-CZ3 3.32Å; F1378-W1386 HydrophobicContact CZ-CZ3 3.32Å; L1384-W1386 PolarHBondContact O-N 3.09Å
1387	S	73.2	Confident	71.6	Confident	41 Å²	41	76 Å²	76	29%	0.287	39%	0.39	S	S	.	.			trans	-128.6	156.4	176.1	81.2	0	0	0	0	112.8	P1385 Q1389 Q1390 L1391	P1385-S1387 PolarHBondContact O-N 3.39Å; S1387-Q1389 PolarHBondContact O-N 2.62Å; S1387-Q1390 VanDerWaalsContact N-OE1 3.1Å; S1387-Q1390 PolarHBondContact O-N 2.84Å; S1387-Q1390 WeakPolarHBondContact OG-CG 3.26Å; S1387-Q1390 PolarHBondContact OG-N 2.99Å; S1387-L1391 PolarHBondContact O-N 3.1Å; S1387-L1391 VanDerWaalsContact O-N 3.13Å
1388	K	79	Confident	72	Confident	119 Å²	119	75.6 Å²	75.6	52%	0.517	39%	0.387	S	S	.	.	H	α-helix	trans	-56.7	-41.2	174.5	-169.6	-170.6	168.1	-167	0	111.6	L1272 Q1390 L1391 D1392	L1272-K1388 HydrophobicContact CD2-CB 3.92Å; L1272-K1388 HydrophobicContact CD2-CD 4.15Å; L1272-K1388 HydrophobicContact CD2-CG 3.84Å; K1388-Q1390 VanDerWaalsContact C-N 3.31Å; K1388-Q1390 PolarHBondContact O-N 3.26Å; K1388-L1391 WeakPolarHBondContact O-CB 3.1Å; K1388-L1391 PolarHBondContact O-N 3.25Å; K1388-D1392 VanDerWaalsContact O-CG 3.28Å; K1388-D1392 PolarHBondContact O-N 3.32Å
1389	Q	77.2	Confident	72.5	Confident	140 Å²	140	78.4 Å²	78.4	65%	0.654	40%	0.397	S	S	*	.	H	α-helix	trans	-63.9	-36.8	-179.4	-66.3	179.2	-3.3	0	0	112	S1387 K1393	S1387-Q1389 PolarHBondContact O-N 2.62Å; Q1389-K1393 WeakPolarHBondContact O-CB 3.48Å; Q1389-K1393 VanDerWaalsContact O-CG 3.28Å; Q1389-K1393 WeakPolarHBondContact O-CG 3.37Å; Q1389-K1393 PolarHBondContact O-N 3.04Å
1390	Q	78.8	Confident	72.8	Confident	39 Å²	39	79.6 Å²	79.6	18%	0.182	40%	0.401	C	S	.	.	H	α-helix	trans	-67.6	-41.5	174.7	-72.1	169	-17.2	0	0	111.6	F1378 T1379 P1385 S1387 K1388 K1393 K1394	F1378-Q1390 HydrophobicContact CB-CB 4.2Å; F1378-Q1390 HydrophobicContact CD2-CB 3.97Å; T1379-Q1390 HydrophobicContact CG2-CG 4.13Å; P1385-Q1390 PolarHBondContact O-OE1 3.05Å; S1387-Q1390 VanDerWaalsContact N-OE1 3.1Å; S1387-Q1390 PolarHBondContact O-N 2.84Å; S1387-Q1390 WeakPolarHBondContact OG-CG 3.26Å; S1387-Q1390 PolarHBondContact OG-N 2.99Å; K1388-Q1390 VanDerWaalsContact C-N 3.31Å; K1388-Q1390 PolarHBondContact O-N 3.26Å; Q1390-K1393 PolarHBondContact O-N 3.44Å; Q1390-K1394 WeakPolarHBondContact O-CB 3.48Å; Q1390-K1394 PolarHBondContact O-N 3.37Å
1391	L	82.3	Confident	73.2	Confident	3 Å²	3	81.9 Å²	81.9	2%	0.016	40%	0.396	C	S	.	.	H	α-helix	trans	-58.1	-50.8	172.9	173.9	64.3	0	0	0	110.8	V1249 L1272 Y1326 F1328 I1365 F1378 S1387 K1388 K1393 K1394 V1395	V1249-L1391 HydrophobicContact CG1-CD1 4.28Å; V1249-L1391 HydrophobicContact CG2-CD1 4.03Å; L1272-L1391 HydrophobicContact CD1-CD2 3.87Å; Y1326-L1391 HydrophobicContact CD2-CD2 4.47Å; Y1326-L1391 HydrophobicContact CE2-CD2 4.49Å; F1328-L1391 HydrophobicContact CE1-CD2 3.96Å; F1328-L1391 HydrophobicContact CZ-CD2 4.17Å; I1365-L1391 HydrophobicContact CD1-CD1 4.36Å; F1378-L1391 HydrophobicContact CD2-CB 4.3Å; F1378-L1391 HydrophobicContact CE1-CD1 4.08Å; F1378-L1391 HydrophobicContact CE2-CB 3.56Å; F1378-L1391 HydrophobicContact CE2-CD1 3.91Å; F1378-L1391 HydrophobicContact CE2-CG 4.3Å; F1378-L1391 HydrophobicContact CZ-CB 3.99Å; F1378-L1391 HydrophobicContact CZ-CD1 3.37Å; F1378-L1391 HydrophobicContact CZ-CG 4.24Å; S1387-L1391 PolarHBondContact O-N 3.1Å; S1387-L1391 VanDerWaalsContact O-N 3.13Å; K1388-L1391 WeakPolarHBondContact O-CB 3.1Å; K1388-L1391 PolarHBondContact O-N 3.25Å; L1391-K1393 VanDerWaalsContact C-N 3.34Å; L1391-K1393 PolarHBondContact O-N 3.27Å; L1391-K1394 PolarHBondContact O-N 3.43Å; L1391-K1394 VanDerWaalsContact O-N 3.15Å; L1391-V1395 HydrophobicContact CD1-CG2 3.89Å; L1391-V1395 HydrophobicContact CG-CG2 4.41Å; L1391-V1395 WeakPolarHBondContact O-CG2 3.35Å; L1391-V1395 PolarHBondContact O-N 3.05Å
1392	D	82.7	Confident	73.4	Confident	52 Å²	52	76 Å²	76	28%	0.278	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-45.2	-179.4	-67.5	-25.6	0	0	0	111	Y1326 K1388 V1395 A1396	Y1326-D1392 WeakPolarHBondContact CE2-OD1 3.34Å; Y1326-D1392 PolarHBondContact OH-OD1 3.29Å; K1388-D1392 VanDerWaalsContact O-CG 3.28Å; K1388-D1392 PolarHBondContact O-N 3.32Å; D1392-V1395 PolarHBondContact O-N 3.12Å; D1392-A1396 WeakPolarHBondContact O-CB 3.47Å; D1392-A1396 PolarHBondContact O-N 2.84Å
1393	K	79.6	Confident	73.7	Confident	141 Å²	141	73.1 Å²	73.1	61%	0.613	36%	0.363	S	S	*	.	H	α-helix	trans	-60.7	-44.8	174.4	-76.6	176.9	-178.6	179.9	0	112	Q1389 Q1390 L1391 A1396 Q1397	Q1389-K1393 WeakPolarHBondContact O-CB 3.48Å; Q1389-K1393 VanDerWaalsContact O-CG 3.28Å; Q1389-K1393 WeakPolarHBondContact O-CG 3.37Å; Q1389-K1393 PolarHBondContact O-N 3.04Å; Q1390-K1393 PolarHBondContact O-N 3.44Å; L1391-K1393 VanDerWaalsContact C-N 3.34Å; L1391-K1393 PolarHBondContact O-N 3.27Å; K1393-A1396 PolarHBondContact O-N 2.76Å; K1393-Q1397 WeakPolarHBondContact O-CG 3.39Å; K1393-Q1397 PolarHBondContact O-N 2.94Å
1394	K	82.2	Confident	73.7	Confident	43 Å²	43	72 Å²	72	19%	0.187	36%	0.356	C	S	.	.	H	α-helix	trans	-68.7	-40.1	-178.3	-164.4	65.6	172	-172.4	0	111.9	I1365 F1373 F1378 Q1390 L1391 Q1397 C1398	I1365-K1394 HydrophobicContact CD1-CB 4.34Å; I1365-K1394 HydrophobicContact CD1-CG 3.99Å; F1373-K1394 HydrophobicContact CD1-CG 4.44Å; F1373-K1394 HydrophobicContact CD2-CD 4.35Å; F1373-K1394 HydrophobicContact CD2-CG 4.44Å; F1373-K1394 HydrophobicContact CG-CG 4.27Å; F1378-K1394 HydrophobicContact CB-CB 4.32Å; F1378-K1394 HydrophobicContact CB-CG 4.47Å; F1378-K1394 HydrophobicContact CD1-CB 3.96Å; F1378-K1394 HydrophobicContact CD1-CG 3.85Å; F1378-K1394 HydrophobicContact CG-CB 4.21Å; F1378-K1394 HydrophobicContact CG-CG 4.45Å; Q1390-K1394 WeakPolarHBondContact O-CB 3.48Å; Q1390-K1394 PolarHBondContact O-N 3.37Å; L1391-K1394 PolarHBondContact O-N 3.43Å; L1391-K1394 VanDerWaalsContact O-N 3.15Å; K1394-Q1397 WeakPolarHBondContact O-CB 3.45Å; K1394-Q1397 PolarHBondContact O-N 2.84Å; K1394-C1398 WeakPolarHBondContact O-CB 3.46Å; K1394-C1398 PolarHBondContact O-N 2.92Å; K1394-C1398 PolarHBondContact O-SG 3.49Å
1395	V	83.4	Confident	73.4	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-65.4	-40.7	174.2	176.1	0	0	0	0	110.9	A1247 Y1326 I1365 I1367 L1391 D1392 Q1397 C1398 R1399	A1247-V1395 HydrophobicContact CB-CG1 4.01Å; Y1326-V1395 HydrophobicContact CD1-CG2 4.44Å; Y1326-V1395 HydrophobicContact CE1-CB 4.11Å; Y1326-V1395 HydrophobicContact CE1-CG1 3.95Å; Y1326-V1395 HydrophobicContact CE1-CG2 3.85Å; I1365-V1395 HydrophobicContact CD1-CG2 3.98Å; I1365-V1395 HydrophobicContact CG2-CG2 4.19Å; I1367-V1395 HydrophobicContact CD1-CG1 4.25Å; L1391-V1395 HydrophobicContact CD1-CG2 3.89Å; L1391-V1395 HydrophobicContact CG-CG2 4.41Å; L1391-V1395 WeakPolarHBondContact O-CG2 3.35Å; L1391-V1395 PolarHBondContact O-N 3.05Å; D1392-V1395 PolarHBondContact O-N 3.12Å; V1395-Q1397 VanDerWaalsContact C-N 3.34Å; V1395-Q1397 PolarHBondContact O-N 3.06Å; V1395-C1398 WeakPolarHBondContact O-CB 3.48Å; V1395-C1398 PolarHBondContact O-N 3.19Å; V1395-R1399 HydrophobicContact CG1-CG 4.3Å; V1395-R1399 WeakPolarHBondContact O-CB 3.23Å; V1395-R1399 WeakPolarHBondContact O-CG 3.29Å; V1395-R1399 PolarHBondContact O-N 2.94Å
1396	A	77.7	Confident	72.8	Confident	45 Å²	45	72.3 Å²	72.3	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-61.4	-41.9	174.1	0	0	0	0	0	111.9	D1392 K1393 R1399 N1400	D1392-A1396 WeakPolarHBondContact O-CB 3.47Å; D1392-A1396 PolarHBondContact O-N 2.84Å; K1393-A1396 PolarHBondContact O-N 2.76Å; A1396-R1399 PolarHBondContact O-N 3.36Å; A1396-N1400 WeakPolarHBondContact O-CB 3.33Å; A1396-N1400 VanDerWaalsContact O-CG 3.31Å; A1396-N1400 PolarHBondContact O-N 3.47Å; A1396-N1400 PolarHBondContact O-ND2 2.94Å
1397	Q	78.7	Confident	71.7	Confident	99 Å²	99	75.1 Å²	75.1	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-47.3	172.1	-74.1	176.4	-7.3	0	0	111.8	K1393 K1394 V1395 R1399 N1400 Q1401	K1393-Q1397 WeakPolarHBondContact O-CG 3.39Å; K1393-Q1397 PolarHBondContact O-N 2.94Å; K1394-Q1397 WeakPolarHBondContact O-CB 3.45Å; K1394-Q1397 PolarHBondContact O-N 2.84Å; V1395-Q1397 VanDerWaalsContact C-N 3.34Å; V1395-Q1397 PolarHBondContact O-N 3.06Å; Q1397-R1399 PolarHBondContact O-N 3.34Å; Q1397-N1400 PolarHBondContact O-N 3.46Å; Q1397-Q1401 WeakPolarHBondContact O-CG 3.42Å; Q1397-Q1401 PolarHBondContact O-N 3.42Å
1398	C	80.5	Confident	70.1	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.007	39%	0.391	C	S	.	.	H	α-helix	trans	-59.1	-46.4	177.4	-69.5	0	0	0	0	111.8	I1367 C1372 K1394 V1395 N1400 Q1401 L1402	I1367-C1398 HydrophobicContact CD1-CB 4Å; C1372-C1398 HydrophobicContact CB-CB 3.6Å; K1394-C1398 WeakPolarHBondContact O-CB 3.46Å; K1394-C1398 PolarHBondContact O-N 2.92Å; K1394-C1398 PolarHBondContact O-SG 3.49Å; V1395-C1398 WeakPolarHBondContact O-CB 3.48Å; V1395-C1398 PolarHBondContact O-N 3.19Å; C1398-N1400 VanDerWaalsContact C-N 3.34Å; C1398-N1400 PolarHBondContact O-N 3.04Å; C1398-Q1401 PolarHBondContact O-N 3.31Å; C1398-L1402 WeakPolarHBondContact O-CB 3.38Å; C1398-L1402 PolarHBondContact O-N 3.4Å
1399	R	80	Confident	68.2	Low	76 Å²	76	75 Å²	75	29%	0.287	39%	0.388	S	S	.	.	H	α-helix	trans	-60.6	-44.3	176.1	-74.8	178.2	172.5	160.6	-4.8	111.1	Y1245 I1367 V1395 A1396 Q1397 L1402 I1403	Y1245-R1399 PolarHBondContact O-NH2 2.88Å; I1367-R1399 HydrophobicContact CD1-CG 3.71Å; V1395-R1399 HydrophobicContact CG1-CG 4.3Å; V1395-R1399 WeakPolarHBondContact O-CB 3.23Å; V1395-R1399 WeakPolarHBondContact O-CG 3.29Å; V1395-R1399 PolarHBondContact O-N 2.94Å; A1396-R1399 PolarHBondContact O-N 3.36Å; Q1397-R1399 PolarHBondContact O-N 3.34Å; R1399-L1402 PolarHBondContact O-N 3.13Å; R1399-I1403 WeakPolarHBondContact O-CD1 3.1Å; R1399-I1403 VanDerWaalsContact O-CG1 3.24Å; R1399-I1403 WeakPolarHBondContact O-CG1 3.33Å; R1399-I1403 PolarHBondContact O-N 3.2Å
1400	N	72.5	Confident	66.8	Low	85 Å²	85	71.1 Å²	71.1	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-38.9	177.2	-77.7	-24.2	0	0	0	112.6	A1396 Q1397 C1398 I1403 K1404	A1396-N1400 WeakPolarHBondContact O-CB 3.33Å; A1396-N1400 VanDerWaalsContact O-CG 3.31Å; A1396-N1400 PolarHBondContact O-N 3.47Å; A1396-N1400 PolarHBondContact O-ND2 2.94Å; Q1397-N1400 PolarHBondContact O-N 3.46Å; C1398-N1400 VanDerWaalsContact C-N 3.34Å; C1398-N1400 PolarHBondContact O-N 3.04Å; N1400-I1403 PolarHBondContact O-N 2.98Å; N1400-K1404 VanDerWaalsContact O-CB 3.28Å; N1400-K1404 WeakPolarHBondContact O-CB 3.5Å; N1400-K1404 VanDerWaalsContact O-CG 3.31Å; N1400-K1404 WeakPolarHBondContact O-CG 3.28Å; N1400-K1404 PolarHBondContact O-N 2.89Å
1401	Q	69.9	Low	65	Low	109 Å²	109	76.6 Å²	76.6	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-62.8	-45.1	174.5	-76	173.4	-21.8	0	0	111.1	Q1397 C1398 I1403 K1404 Q1405	Q1397-Q1401 WeakPolarHBondContact O-CG 3.42Å; Q1397-Q1401 PolarHBondContact O-N 3.42Å; C1398-Q1401 PolarHBondContact O-N 3.31Å; Q1401-I1403 PolarHBondContact O-N 3.47Å; Q1401-K1404 PolarHBondContact O-N 3.41Å; Q1401-Q1405 PolarHBondContact O-N 3.33Å
1402	L	66.5	Low	63	Low	38 Å²	38	82.4 Å²	82.4	20%	0.199	44%	0.442	C	S	.	.	H	α-helix	trans	-62.6	-29.5	178.1	-155.9	145.7	0	0	0	112.5	I1367 C1398 R1399 F1407	I1367-L1402 HydrophobicContact CB-CD1 4.14Å; I1367-L1402 HydrophobicContact CG2-CD1 4.27Å; C1398-L1402 WeakPolarHBondContact O-CB 3.38Å; C1398-L1402 PolarHBondContact O-N 3.4Å; R1399-L1402 PolarHBondContact O-N 3.13Å; L1402-F1407 HydrophobicContact CB-CZ 4.49Å; L1402-F1407 HydrophobicContact CD1-CE2 4.13Å; L1402-F1407 HydrophobicContact CD1-CZ 3.68Å; L1402-F1407 HydrophobicContact CG-CE2 3.91Å; L1402-F1407 HydrophobicContact CG-CZ 3.85Å
1403	I	65.3	Low	61.3	Low	89 Å²	89	84.1 Å²	84.1	46%	0.456	45%	0.447	S	S	.	.	H	α-helix	trans	-80.8	-45.1	175	-68.8	163.9	0	0	0	111.9	L357 R1399 N1400 Q1401	L357-I1403 HydrophobicContact CB-CG2 4.5Å; L357-I1403 HydrophobicContact CD1-CG2 4.24Å; R1399-I1403 WeakPolarHBondContact O-CD1 3.1Å; R1399-I1403 VanDerWaalsContact O-CG1 3.24Å; R1399-I1403 WeakPolarHBondContact O-CG1 3.33Å; R1399-I1403 PolarHBondContact O-N 3.2Å; N1400-I1403 PolarHBondContact O-N 2.98Å; Q1401-I1403 PolarHBondContact O-N 3.47Å
1404	K	55.7	Low	59.2	Low	171 Å²	171	85.2 Å²	85.2	74%	0.743	45%	0.454	S	S	*	.	H	α-helix	trans	-81.6	-27.5	-168.7	-74.6	-175.8	177.2	-172.4	0	114.4	N1400 Q1401	N1400-K1404 VanDerWaalsContact O-CB 3.28Å; N1400-K1404 WeakPolarHBondContact O-CB 3.5Å; N1400-K1404 VanDerWaalsContact O-CG 3.31Å; N1400-K1404 WeakPolarHBondContact O-CG 3.28Å; N1400-K1404 PolarHBondContact O-N 2.89Å; Q1401-K1404 PolarHBondContact O-N 3.41Å
1405	Q	50.3	Low	57.1	Low	109 Å²	109	90.9 Å²	90.9	51%	0.509	48%	0.479	S	S	.	.	S	Bend	trans	-136.2	129.9	178.6	-68	-174.5	-3.1	0	0	109.4	Q1401 F1407 S1408	Q1401-Q1405 PolarHBondContact O-N 3.33Å; Q1405-F1407 PolarHBondContact O-N 3.28Å; Q1405-S1408 PolarHBondContact OE1-OG 3.49Å
1406	G	45.8	Very low	54.9	Low	84 Å²	84	97 Å²	97	87%	0.866	52%	0.517	S	S	*	.	S	Bend	trans	-54.9	114.5	150	0	0	0	0	0	106.5	S1408	G1406-S1408 PolarHBondContact O-N 2.85Å
1407	F	44.1	Very low	52.8	Low	93 Å²	93	107.2 Å²	107.2	41%	0.408	56%	0.556	S	S	.	*			trans	-29.7	123.8	-159.1	-76.5	-99	0	0	0	117.3	K1370 L1402 Q1405	K1370-F1407 HydrophobicContact CB-CE2 4.27Å; K1370-F1407 HydrophobicContact CB-CZ 3.93Å; K1370-F1407 HydrophobicContact CD-CD2 4.27Å; K1370-F1407 HydrophobicContact CD-CE2 3.44Å; K1370-F1407 VanDerWaalsContact CD-CE2 3.44Å; K1370-F1407 HydrophobicContact CD-CZ 3.98Å; K1370-F1407 HydrophobicContact CG-CE2 4.48Å; L1402-F1407 HydrophobicContact CB-CZ 4.49Å; L1402-F1407 HydrophobicContact CD1-CE2 4.13Å; L1402-F1407 HydrophobicContact CD1-CZ 3.68Å; L1402-F1407 HydrophobicContact CG-CE2 3.91Å; L1402-F1407 HydrophobicContact CG-CZ 3.85Å; Q1405-F1407 PolarHBondContact O-N 3.28Å
1408	S	40.4	Very low	51.5	Low	68 Å²	68	107.6 Å²	107.6	48%	0.476	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-87.7	147.2	142.9	80	0	0	0	0	108.8	Q1405 G1406	Q1405-S1408 PolarHBondContact OE1-OG 3.49Å; G1406-S1408 PolarHBondContact O-N 2.85Å
1409	I	39.6	Very low	49.9	Very low	90 Å²	90	113.2 Å²	113.2	46%	0.462	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-58.3	145.9	164.2	-61.7	173.6	0	0	0	108.1	T1411 F1413 F1415	I1409-T1411 PolarHBondContact O-N 2.89Å; I1409-F1413 HydrophobicContact CG2-CB 3.11Å; I1409-F1413 HydrophobicContact CG2-CD1 3.44Å; I1409-F1413 VanDerWaalsContact CG2-CD1 3.44Å; I1409-F1413 HydrophobicContact CG2-CD2 3.85Å; I1409-F1413 HydrophobicContact CG2-CE1 4.25Å; I1409-F1413 HydrophobicContact CG2-CG 3.19Å; I1409-F1415 HydrophobicContact CD1-CZ 4.1Å
1410	P	46.4	Very low	48.3	Very low	58 Å²	58	115.3 Å²	115.3	38%	0.377	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-50.6	138.1	172.5	-24.7	33.3	0	0	0	111.1	D1412 F1413	P1410-D1412 WeakPolarHBondContact CB-OD1 3.46Å; P1410-D1412 PolarHBondContact O-N 3.12Å; P1410-D1412 VanDerWaalsContact O-N 3.07Å; P1410-F1413 WeakPolarHBondContact O-CB 3.05Å; P1410-F1413 PolarHBondContact O-N 2.89Å
1411	T	41.1	Very low	46.8	Very low	153 Å²	153	117.1 Å²	117.1	94%	0.939	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-18.9	-177.9	35.2	0	0	0	0	113.9	I1409	I1409-T1411 PolarHBondContact O-N 2.89Å
1412	D	41.6	Very low	45.4	Very low	126 Å²	126	117.6 Å²	117.6	67%	0.674	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	1.3	175.8	57.1	-35.9	0	0	0	113.8	P1410 Q1414	P1410-D1412 WeakPolarHBondContact CB-OD1 3.46Å; P1410-D1412 PolarHBondContact O-N 3.12Å; P1410-D1412 VanDerWaalsContact O-N 3.07Å; D1412-Q1414 PolarHBondContact O-N 3.14Å; D1412-Q1414 VanDerWaalsContact O-N 3.13Å
1413	F	45.4	Very low	44	Very low	87 Å²	87	122.9 Å²	122.9	38%	0.382	65%	0.651	S	S	.	*			trans	-70	111.4	174.8	-172	-92.5	0	0	0	110.5	I1409 P1410 F1415	I1409-F1413 HydrophobicContact CG2-CB 3.11Å; I1409-F1413 HydrophobicContact CG2-CD1 3.44Å; I1409-F1413 VanDerWaalsContact CG2-CD1 3.44Å; I1409-F1413 HydrophobicContact CG2-CD2 3.85Å; I1409-F1413 HydrophobicContact CG2-CE1 4.25Å; I1409-F1413 HydrophobicContact CG2-CG 3.19Å; P1410-F1413 WeakPolarHBondContact O-CB 3.05Å; P1410-F1413 PolarHBondContact O-N 2.89Å; F1413-F1415 HydrophobicContact CD1-CE2 4.46Å; F1413-F1415 HydrophobicContact CE1-CD1 4.19Å; F1413-F1415 HydrophobicContact CE1-CE1 4.16Å; F1413-F1415 HydrophobicContact CE1-CG 4.45Å; F1413-F1415 HydrophobicContact CE1-CZ 4.38Å
1414	Q	35.9	Very low	42.5	Very low	164 Å²	164	125.3 Å²	125.3	77%	0.766	67%	0.665	S	S	*	*			trans	-87.6	124.8	171.5	-66.9	179.8	-10.6	0	0	109.1	D1412 V1416	D1412-Q1414 PolarHBondContact O-N 3.14Å; D1412-Q1414 VanDerWaalsContact O-N 3.13Å; Q1414-V1416 PolarHBondContact O-N 2.85Å; Q1414-V1416 VanDerWaalsContact O-N 3.14Å
1415	F	39.1	Very low	41.5	Very low	163 Å²	163	121.8 Å²	121.8	72%	0.715	66%	0.659	S	S	*	*			trans	-66.7	108.5	160.9	-70.7	-86	0	0	0	107.2	I1409 F1413 Q1417	I1409-F1415 HydrophobicContact CD1-CZ 4.1Å; F1413-F1415 HydrophobicContact CD1-CE2 4.46Å; F1413-F1415 HydrophobicContact CE1-CD1 4.19Å; F1413-F1415 HydrophobicContact CE1-CE1 4.16Å; F1413-F1415 HydrophobicContact CE1-CG 4.45Å; F1413-F1415 HydrophobicContact CE1-CZ 4.38Å; F1415-Q1417 PolarHBondContact O-N 3.05Å
1416	V	36.8	Very low	40.7	Very low	130 Å²	130	122.8 Å²	122.8	79%	0.788	67%	0.671	S	S	*	*			trans	-72.4	118.6	164.8	-175.5	0	0	0	0	105.9	Q1414	Q1414-V1416 PolarHBondContact O-N 2.85Å; Q1414-V1416 VanDerWaalsContact O-N 3.14Å
1417	Q	32.7	Very low	40.3	Very low	258 Å²	258	126.4 Å²	126.4	100%	1.206	65%	0.654	S	S	*	*			trans	-77.6	0	177.1	-138.5	175.8	11.4	0	0	110.9	F1415	F1415-Q1417 PolarHBondContact O-N 3.05Å

Retrieved 1,417 of 1,417 residues in 266.1 ms (Link to these results)

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